*HEADER    DNA BINDING PROTEIN                     28-APR-15   2N26              
*TITLE     SOLUTION STRUCTURE OF MIZ-1 ZINC FINGERS 3 AND 4                      
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC FINGER AND BTB DOMAIN-CONTAINING PROTEIN 17;          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 304-414;                                      
*COMPND   5 SYNONYM: MYC-INTERACTING ZINC FINGER PROTEIN 1, MIZ-1, ZINC FINGER   
*COMPND   6 PROTEIN 151, ZINC FINGER PROTEIN 60;                                 
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: MIZ1, ZBTB17, ZNF151, ZNF60;                                   
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21 STAR (DE3);                           
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET-3A                                     
*KEYWDS    MIZ-1, ZBTB17, C2H2 ZINC FINGER, DNA BINDING PROTEIN                  
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    M.BEDARD, P.LAVIGNE                                                   
*REVDAT   1   17-JUN-15 2N26    0                                                


assign ( resid 98 and name HG2#
  )
       ( resid 85 and name HA
  or resid 86 and name HA
  ) 3.6 1.8 0.7 volume=0.463 peak=41 ppm1=1.130 ppm2=4.100

assign ( resid 96 and name HD1#
  )
       ( resid 86 and name HA
  or resid 94 and name HA2
  ) 4.2 2.4 0.8 volume=0.203 peak=14 ppm1=0.564 ppm2=4.103

assign ( resid 60 and name HB2
  )
       ( resid 72 and name HG2#
  or resid 72 and name HD1#
  ) 4.3 2.5 0.9 volume=0.169 peak=36 ppm1=2.624 ppm2=0.571

assign ( resid 103 and name HD1#
  )
       ( resid 88 and name HE1 or resid 88 and name HE2
  or resid 97 and name HE1 or resid 97 and name HE2
  ) 2.9 1.1 0.6 volume=1.944 peak=35 ppm1=0.808 ppm2=6.680

assign ( resid 86 and name HA
  )
       ( resid 80 and name HG1
  or resid 87 and name HB2
  or resid 87 and name HB1
  or resid 96 and name HB1
  ) 3.4 1.6 0.7 volume=0.706 peak=8 ppm1=4.102 ppm2=1.345

assign ( resid 76 and name HD22
  )
       ( resid 72 and name HB
  or resid 75 and name HD2#
  ) 4.2 2.4 0.8 volume=0.188 peak=11 ppm1=6.594 ppm2=0.842

assign ( resid 75 and name HN
  )
       ( resid 72 and name HG12
  or resid 74 and name HD2#
  ) 3.2 1.4 0.6 volume=1.072 peak=2 ppm1=7.047 ppm2=0.790

assign ( resid 96 and name HD2#
  )
       ( resid 86 and name HB#
  or resid 96 and name HB2
  ) 2.6 0.8 0.5 volume=3.763 peak=16 ppm1=0.685 ppm2=1.071

assign ( resid 86 and name HB#
  )
       ( resid 79 and name HB1
  or resid 79 and name HB2
  or resid 85 and name HB2
  ) 3.7 1.9 0.7 volume=0.388 peak=19 ppm1=1.069 ppm2=1.792

assign ( resid 77 and name HN
  )
       ( resid 74 and name HB2
  or resid 80 and name HB2
  or resid 80 and name HB1
  ) 3.5 1.7 0.7 volume=0.580 peak=23 ppm1=7.293 ppm2=1.730

assign ( resid 80 and name HE1
  or resid 95 and name HE2
  )
       ( resid 80 and name HA
  ) 3.3 1.5 0.7 volume=0.782 peak=38 ppm1=2.822 ppm2=3.925

assign ( resid 103 and name HD2#
  )
       ( resid 88 and name HB1
  or resid 97 and name HB1
  ) 3.0 1.2 0.6 volume=1.376 peak=6 ppm1=0.876 ppm2=2.650

assign ( resid 107 and name HB1
  )
       ( resid 107 and name HE22
  or resid 108 and name HN
  ) 3.9 2.1 0.8 volume=0.323 peak=39 ppm1=2.054 ppm2=6.924

assign ( resid 60 and name HB1
  )
       ( resid 72 and name HG2#
  or resid 72 and name HD1#
  ) 4.5 2.7 0.9 volume=0.125 peak=28 ppm1=2.842 ppm2=0.577

assign ( resid 103 and name HD2#
  )
       ( resid 88 and name HE1 or resid 88 and name HE2
  or resid 97 and name HE1 or resid 97 and name HE2
  ) 3.6 1.8 0.7 volume=0.486 peak=15 ppm1=0.876 ppm2=6.673

assign ( resid 85 and name HG1
  )
       ( resid 80 and name HG1
  or resid 87 and name HB2
  or resid 87 and name HB1
  ) 3.7 1.9 0.7 volume=0.403 peak=9 ppm1=2.121 ppm2=1.358

assign ( resid 103 and name HD1#
  )
       ( resid 88 and name HB1
  or resid 97 and name HB1
  ) 2.8 1.0 0.6 volume=2.054 peak=40 ppm1=0.807 ppm2=2.649

assign ( resid 76 and name HD22
  )
       ( resid 72 and name HG11
  or resid 77 and name HD2#
  or resid 77 and name HD1#
  or resid 96 and name HD2#
  ) 3.8 2.0 0.8 volume=0.342 peak=43 ppm1=6.597 ppm2=0.725

assign ( resid 96 and name HD2#
  )
       ( resid 86 and name HA
  or resid 94 and name HA2
  ) 4.7 2.9 0.9 volume=0.104 peak=42 ppm1=0.681 ppm2=4.129

assign ( resid 75 and name HD2#
  )
       ( resid 72 and name HG2#
  or resid 72 and name HD1#
  ) 2.8 1.0 0.6 volume=2.042 peak=4 ppm1=0.843 ppm2=0.575

assign ( resid 76 and name HD21
  )
       ( resid 72 and name HG12
  or resid 75 and name HD2#
  ) 4.2 2.4 0.8 volume=0.196 peak=13 ppm1=7.307 ppm2=0.831

assign ( resid 77 and name HD1#
  )
       ( resid 78 and name HB1
  or resid 80 and name HE1
  or resid 80 and name HE2
  ) 3.2 1.4 0.6 volume=0.920 peak=33 ppm1=0.714 ppm2=2.821

assign ( resid 76 and name HD21
  )
       ( resid 72 and name HG2#
  or resid 72 and name HD1#
  or resid 96 and name HD1#
  ) 3.4 1.6 0.7 volume=0.652 peak=31 ppm1=7.309 ppm2=0.582

assign ( resid 76 and name HD22
  )
       ( resid 72 and name HG2#
  or resid 72 and name HD1#
  or resid 96 and name HD1#
  ) 3.3 1.5 0.7 volume=0.760 peak=5 ppm1=6.589 ppm2=0.574

assign ( resid 73 and name HN
  )
       ( resid 72 and name HG2#
  or resid 72 and name HD1#
  ) 3.6 1.8 0.7 volume=0.495 peak=10 ppm1=7.960 ppm2=0.586

assign ( resid 95 and name HB2
  )
       ( resid 95 and name HG1
  or resid 96 and name HB2
  ) 2.9 1.1 0.6 volume=1.639 peak=27 ppm1=1.187 ppm2=1.035

assign ( resid 76 and name HD21
  )
       ( resid 72 and name HG11
  or resid 77 and name HD2#
  or resid 77 and name HD1#
  or resid 96 and name HD2#
  ) 3.9 2.1 0.8 volume=0.301 peak=25 ppm1=7.303 ppm2=0.724

assign ( resid 76 and name HB2
  or resid 76 and name HB1
  )
       ( resid 72 and name HG2#
  or resid 72 and name HD1#
  ) 4.3 2.5 0.9 volume=0.161 peak=12 ppm1=2.557 ppm2=0.574

assign ( resid 94 and name HN
  )
       ( resid 95 and name HD2
  or resid 95 and name HG2
  ) 4.0 2.2 0.8 volume=0.276 peak=22 ppm1=8.296 ppm2=1.424

assign ( resid 103 and name HA
  )
       ( resid 88 and name HB1
  or resid 97 and name HB1
  ) 3.4 1.6 0.7 volume=0.639 peak=17 ppm1=3.031 ppm2=2.648

assign ( resid 76 and name HD22
  )
       ( resid 73 and name HA
  or resid 77 and name HA
  ) 4.2 2.4 0.8 volume=0.205 peak=1 ppm1=6.598 ppm2=3.906

assign ( resid 86 and name HA
  )
       ( resid 79 and name HB1
  or resid 79 and name HB2
  or resid 85 and name HB1
  or resid 85 and name HB2
  ) 3.8 2.0 0.8 volume=0.337 peak=20 ppm1=4.099 ppm2=1.820

assign ( resid 60 and name HD1 or resid 60 and name HD2
  )
       ( resid 72 and name HG2#
  or resid 72 and name HD1#
  ) 3.2 1.4 0.6 volume=0.958 peak=18 ppm1=6.834 ppm2=0.567

assign ( resid 86 and name HA
  )
       ( resid 79 and name HE2
  or resid 87 and name HD1
  ) 4.0 2.2 0.8 volume=0.246 peak=24 ppm1=4.105 ppm2=2.926

assign ( resid 96 and name HD1#
  )
       ( resid 86 and name HB#
  or resid 96 and name HB2
  ) 2.6 0.8 0.5 volume=3.780 peak=37 ppm1=0.564 ppm2=1.070

assign ( resid 76 and name HD21
  )
       ( resid 73 and name HA
  or resid 77 and name HA
  ) 3.9 2.1 0.8 volume=0.320 peak=26 ppm1=7.296 ppm2=3.912

assign ( resid 107 and name HB2
  )
       ( resid 107 and name HE22
  or resid 108 and name HN
  ) 3.9 2.1 0.8 volume=0.286 peak=30 ppm1=2.127 ppm2=6.926

assign ( resid 85 and name HG2
  )
       ( resid 80 and name HG1
  or resid 87 and name HB2
  or resid 87 and name HB1
  ) 3.9 2.1 0.8 volume=0.323 peak=32 ppm1=2.075 ppm2=1.359

assign ( resid 60 and name HE1 or resid 60 and name HE2
  )
       ( resid 72 and name HG2#
  or resid 72 and name HD1#
  ) 3.0 1.2 0.6 volume=1.550 peak=29 ppm1=6.756 ppm2=0.568

assign ( resid 86 and name HB#
  )
       ( resid 79 and name HE2
  or resid 87 and name HD1
  or resid 89 and name HD2
  or resid 89 and name HD1
  ) 4.0 2.2 0.8 volume=0.276 peak=21 ppm1=1.070 ppm2=2.946

assign ( resid 82 and name HB2
  )
       ( resid 79 and name HA
  ) 4.0 2.2 0.8 volume=0.248 peak=2268 ppm1=3.136 ppm2=3.454

assign ( resid 59 and name HD2
  )
       ( resid 59 and name HB1
  ) 4.0 2.2 0.8 volume=0.265 peak=1913 ppm1=3.433 ppm2=0.920

assign ( resid 87 and name HG2
  )
       ( resid 87 and name HD1
  ) 3.3 1.5 0.7 volume=0.903 peak=2319 ppm1=1.201 ppm2=2.932

assign ( resid 105 and name HN
  )
       ( resid 105 and name HG1
  ) 2.9 1.1 0.6 volume=1.746 peak=579 ppm1=7.548 ppm2=1.456

assign ( resid 98 and name HG2#
  )
       ( resid 84 and name HN
  ) 4.6 2.8 0.9 volume=0.117 peak=1703 ppm1=1.135 ppm2=8.263

assign ( resid 87 and name HD2
  )
       ( resid 87 and name HN
  ) 4.2 2.4 0.8 volume=0.201 peak=2312 ppm1=2.852 ppm2=7.709

assign ( resid 105 and name HG2
  )
       ( resid 105 and name HN
  ) 3.5 1.7 0.7 volume=0.635 peak=1463 ppm1=1.572 ppm2=7.550

assign ( resid 106 and name HB1
  )
       ( resid 103 and name HD1#
  ) 3.8 2.0 0.8 volume=0.330 peak=1279 ppm1=2.584 ppm2=0.811

assign ( resid 98 and name HG2#
  )
       ( resid 98 and name HA
  ) 4.2 2.4 0.8 volume=0.193 peak=2050 ppm1=1.128 ppm2=4.479

assign ( resid 74 and name HB1
  )
       ( resid 74 and name HN
  ) 4.3 2.5 0.9 volume=0.178 peak=1336 ppm1=1.284 ppm2=6.406

assign ( resid 108 and name HG
  )
       ( resid 108 and name HA
  ) 3.5 1.7 0.7 volume=0.543 peak=930 ppm1=1.685 ppm2=3.972

assign ( resid 95 and name HG2
  )
       ( resid 95 and name HA
  ) 3.2 1.4 0.6 volume=1.009 peak=2201 ppm1=1.428 ppm2=3.840

assign ( resid 96 and name HG
  )
       ( resid 96 and name HD2#
  ) 2.6 0.8 0.5 volume=3.477 peak=1560 ppm1=1.422 ppm2=0.700

assign ( resid 71 and name HD1#
  )
       ( resid 71 and name HA
  ) 3.8 2.0 0.8 volume=0.383 peak=2041 ppm1=0.918 ppm2=4.872

assign ( resid 88 and name HB1
  )
       ( resid 103 and name HD2#
  ) 3.1 1.3 0.6 volume=1.118 peak=2342 ppm1=2.631 ppm2=0.873

assign ( resid 103 and name HD1#
  )
       ( resid 107 and name HN
  ) 3.7 1.9 0.7 volume=0.398 peak=2016 ppm1=0.808 ppm2=8.029

assign ( resid 71 and name HN
  )
       ( resid 71 and name HG
  ) 3.4 1.6 0.7 volume=0.731 peak=618 ppm1=6.743 ppm2=1.493

assign ( resid 87 and name HN
  )
       ( resid 98 and name HA
  ) 3.4 1.6 0.7 volume=0.753 peak=2345 ppm1=7.709 ppm2=4.461

assign ( resid 89 and name HN
  )
       ( resid 88 and name HA
  ) 2.5 0.7 0.5 volume=4.282 peak=151 ppm1=8.392 ppm2=4.444

assign ( resid 74 and name HD1#
  )
       ( resid 69 and name HB1
  ) 4.5 2.7 0.9 volume=0.132 peak=2185 ppm1=1.040 ppm2=2.520

assign ( resid 112 and name HN
  )
       ( resid 108 and name HA
  ) 3.7 1.9 0.7 volume=0.436 peak=351 ppm1=7.866 ppm2=3.960

assign ( resid 72 and name HG2#
  )
       ( resid 72 and name HB
  ) 2.6 0.8 0.5 volume=3.677 peak=1586 ppm1=0.583 ppm2=0.876

assign ( resid 72 and name HG2#
  )
       ( resid 76 and name HN
  ) 3.3 1.5 0.7 volume=0.865 peak=1729 ppm1=0.584 ppm2=8.457

assign ( resid 70 and name HG2
  or resid 70 and name HG1
  )
       ( resid 71 and name HD2#
  ) 3.3 1.5 0.7 volume=0.821 peak=1115 ppm1=1.674 ppm2=0.800

assign ( resid 69 and name HB2
  )
       ( resid 75 and name HD1#
  ) 4.5 2.7 0.9 volume=0.137 peak=1158 ppm1=3.054 ppm2=0.897

assign ( resid 106 and name HA
  )
       ( resid 108 and name HN
  ) 4.1 2.3 0.8 volume=0.234 peak=1132 ppm1=4.048 ppm2=6.917

assign ( resid 103 and name HD1#
  )
       ( resid 97 and name HD1 or resid 97 and name HD2
  ) 3.0 1.2 0.6 volume=1.360 peak=1319 ppm1=0.808 ppm2=7.097

assign ( resid 61 and name HN
  )
       ( resid 60 and name HN
  ) 3.7 1.9 0.7 volume=0.416 peak=790 ppm1=8.405 ppm2=7.685

assign ( resid 110 and name HB2
  )
       ( resid 110 and name HE1
  ) 4.2 2.4 0.8 volume=0.208 peak=1428 ppm1=3.030 ppm2=7.843

assign ( resid 87 and name HG2
  )
       ( resid 87 and name HN
  ) 3.7 1.9 0.7 volume=0.394 peak=2298 ppm1=1.202 ppm2=7.710

assign ( resid 85 and name HG1
  )
       ( resid 85 and name HA
  ) 3.5 1.7 0.7 volume=0.606 peak=2291 ppm1=2.129 ppm2=4.076

assign ( resid 90 and name HN
  )
       ( resid 89 and name HB1
  ) 3.6 1.8 0.7 volume=0.503 peak=664 ppm1=9.143 ppm2=1.596

assign ( resid 77 and name HA
  )
       ( resid 79 and name HN
  ) 3.9 2.1 0.8 volume=0.289 peak=2023 ppm1=3.918 ppm2=8.419

assign ( resid 106 and name HA
  )
       ( resid 109 and name HN
  ) 3.9 2.1 0.8 volume=0.295 peak=1344 ppm1=4.048 ppm2=7.832

assign ( resid 61 and name HA2
  )
       ( resid 62 and name HN
  ) 3.9 2.1 0.8 volume=0.326 peak=2283 ppm1=3.419 ppm2=8.879

assign ( resid 111 and name HN
  )
       ( resid 110 and name HA
  ) 3.6 1.8 0.7 volume=0.492 peak=131 ppm1=7.587 ppm2=4.739

assign ( resid 69 and name HB1
  )
       ( resid 75 and name HB1
  ) 4.1 2.3 0.8 volume=0.229 peak=1776 ppm1=2.516 ppm2=1.853

assign ( resid 68 and name HB2
  )
       ( resid 68 and name HA
  ) 4.2 2.4 0.8 volume=0.190 peak=1448 ppm1=3.345 ppm2=5.131

assign ( resid 109 and name HG2#
  )
       ( resid 110 and name HN
  ) 3.6 1.8 0.7 volume=0.516 peak=1630 ppm1=0.486 ppm2=7.120

assign ( resid 75 and name HB1
  )
       ( resid 75 and name HN
  ) 3.8 2.0 0.8 volume=0.352 peak=879 ppm1=1.854 ppm2=7.057

assign ( resid 59 and name HB1
  )
       ( resid 59 and name HD2
  ) 4.1 2.3 0.8 volume=0.214 peak=2259 ppm1=0.915 ppm2=3.429

assign ( resid 86 and name HB#
  )
       ( resid 80 and name HD2
  or resid 80 and name HD1
  ) 3.4 1.6 0.7 volume=0.649 peak=1116 ppm1=1.068 ppm2=1.526

assign ( resid 91 and name HB1
  )
       ( resid 91 and name HG2
  ) 2.5 0.7 0.5 volume=4.140 peak=1211 ppm1=1.890 ppm2=2.223

assign ( resid 71 and name HA
  )
       ( resid 72 and name HN
  ) 4.5 2.7 0.9 volume=0.136 peak=2164 ppm1=4.873 ppm2=8.462

assign ( resid 86 and name HB#
  )
       ( resid 80 and name HA
  ) 3.8 2.0 0.8 volume=0.376 peak=2296 ppm1=1.070 ppm2=3.932

assign ( resid 59 and name HA
  )
       ( resid 59 and name HB2
  ) 3.2 1.4 0.6 volume=0.964 peak=1036 ppm1=4.064 ppm2=0.976

assign ( resid 106 and name HA
  )
       ( resid 106 and name HB2
  ) 3.1 1.3 0.6 volume=1.209 peak=1911 ppm1=4.048 ppm2=2.822

assign ( resid 107 and name HE22
  )
       ( resid 90 and name HA
  ) 4.0 2.2 0.8 volume=0.244 peak=370 ppm1=6.928 ppm2=4.425

assign ( resid 72 and name HG12
  )
       ( resid 72 and name HG11
  ) 2.8 1.0 0.6 volume=2.299 peak=1547 ppm1=0.786 ppm2=0.703

assign ( resid 103 and name HD1#
  )
       ( resid 88 and name HN
  ) 4.0 2.2 0.8 volume=0.253 peak=2353 ppm1=0.808 ppm2=8.313

assign ( resid 107 and name HN
  )
       ( resid 108 and name HB2
  ) 3.5 1.7 0.7 volume=0.628 peak=555 ppm1=8.022 ppm2=1.346

assign ( resid 85 and name HG2
  )
       ( resid 80 and name HE2
  or resid 80 and name HE1
  ) 4.0 2.2 0.8 volume=0.245 peak=2260 ppm1=2.078 ppm2=2.829

assign ( resid 93 and name HB2
  )
       ( resid 93 and name HB1
  ) 2.6 0.8 0.5 volume=3.791 peak=1836 ppm1=2.747 ppm2=3.285

assign ( resid 66 and name HA2
  )
       ( resid 67 and name HN
  ) 3.1 1.3 0.6 volume=1.211 peak=2234 ppm1=3.677 ppm2=7.831

assign ( resid 110 and name HB1
  )
       ( resid 110 and name HD2
  ) 3.5 1.7 0.7 volume=0.576 peak=1217 ppm1=3.136 ppm2=6.606

assign ( resid 79 and name HA
  )
       ( resid 81 and name HN
  ) 4.2 2.4 0.8 volume=0.195 peak=2125 ppm1=3.488 ppm2=7.630

assign ( resid 76 and name HB2
  or resid 76 and name HB1
  )
       ( resid 76 and name HD21
  ) 3.6 1.8 0.7 volume=0.526 peak=1769 ppm1=2.572 ppm2=7.314

assign ( resid 102 and name HB1
  )
       ( resid 103 and name HN
  ) 3.9 2.1 0.8 volume=0.325 peak=1953 ppm1=2.812 ppm2=7.223

assign ( resid 88 and name HN
  )
       ( resid 88 and name HB2
  ) 3.1 1.3 0.6 volume=1.302 peak=2384 ppm1=8.305 ppm2=2.760

assign ( resid 89 and name HA
  )
       ( resid 96 and name HD1#
  ) 3.9 2.1 0.8 volume=0.328 peak=2169 ppm1=4.864 ppm2=0.563

assign ( resid 63 and name HB2
  )
       ( resid 63 and name HN
  ) 4.6 2.8 0.9 volume=0.119 peak=1903 ppm1=1.944 ppm2=9.632

assign ( resid 104 and name HN
  )
       ( resid 107 and name HG1
  ) 3.5 1.7 0.7 volume=0.560 peak=511 ppm1=8.127 ppm2=2.661

assign ( resid 87 and name HG2
  )
       ( resid 88 and name HN
  ) 4.2 2.4 0.8 volume=0.199 peak=2318 ppm1=1.201 ppm2=8.299

assign ( resid 109 and name HN
  )
       ( resid 107 and name HN
  ) 3.2 1.4 0.6 volume=0.993 peak=560 ppm1=7.810 ppm2=8.023

assign ( resid 107 and name HN
  )
       ( resid 107 and name HA
  ) 2.9 1.1 0.6 volume=1.792 peak=404 ppm1=8.027 ppm2=3.450

assign ( resid 70 and name HN
  )
       ( resid 69 and name HB2
  ) 4.4 2.6 0.9 volume=0.145 peak=204 ppm1=9.260 ppm2=3.062

assign ( resid 91 and name HB2
  )
       ( resid 91 and name HG1
  ) 2.3 0.5 0.5 volume=6.554 peak=2233 ppm1=1.998 ppm2=2.261

assign ( resid 109 and name HG2#
  )
       ( resid 106 and name HA
  ) 3.8 2.0 0.8 volume=0.351 peak=1692 ppm1=0.483 ppm2=4.030

assign ( resid 106 and name HB2
  )
       ( resid 106 and name HD2
  ) 3.4 1.6 0.7 volume=0.711 peak=1699 ppm1=2.820 ppm2=6.680

assign ( resid 72 and name HA
  )
       ( resid 72 and name HB
  ) 3.0 1.2 0.6 volume=1.406 peak=1274 ppm1=3.157 ppm2=0.878

assign ( resid 72 and name HA
  )
       ( resid 71 and name HB2
  ) 4.2 2.4 0.8 volume=0.183 peak=1264 ppm1=3.162 ppm2=1.656

assign ( resid 63 and name HG1
  )
       ( resid 63 and name HA
  ) 3.1 1.3 0.6 volume=1.265 peak=2080 ppm1=2.260 ppm2=4.011

assign ( resid 78 and name HA
  )
       ( resid 79 and name HN
  ) 3.3 1.5 0.7 volume=0.761 peak=1757 ppm1=3.988 ppm2=8.417

assign ( resid 108 and name HG
  )
       ( resid 108 and name HD1#
  ) 2.9 1.1 0.6 volume=1.913 peak=1960 ppm1=1.685 ppm2=0.723

assign ( resid 107 and name HA
  )
       ( resid 107 and name HB2
  ) 3.2 1.4 0.6 volume=1.098 peak=1846 ppm1=3.455 ppm2=2.120

assign ( resid 103 and name HN
  )
       ( resid 105 and name HN
  ) 3.7 1.9 0.7 volume=0.441 peak=346 ppm1=7.216 ppm2=7.525

assign ( resid 75 and name HD1#
  )
       ( resid 79 and name HB2
  or resid 79 and name HB1
  ) 2.9 1.1 0.6 volume=1.758 peak=1267 ppm1=0.892 ppm2=1.814

assign ( resid 86 and name HN
  )
       ( resid 85 and name HA
  ) 2.6 0.8 0.5 volume=3.430 peak=146 ppm1=8.201 ppm2=4.088

assign ( resid 101 and name HA1
  )
       ( resid 101 and name HN
  ) 4.3 2.5 0.9 volume=0.176 peak=1821 ppm1=3.664 ppm2=8.366

assign ( resid 60 and name HD1 or resid 60 and name HD2
  )
       ( resid 60 and name HN
  ) 3.2 1.4 0.6 volume=0.949 peak=30 ppm1=6.834 ppm2=7.700

assign ( resid 97 and name HZ
  )
       ( resid 95 and name HB2
  ) 3.6 1.8 0.7 volume=0.502 peak=94 ppm1=5.915 ppm2=1.201

assign ( resid 74 and name HB1
  )
       ( resid 74 and name HB2
  ) 3.4 1.6 0.7 volume=0.750 peak=1992 ppm1=1.280 ppm2=1.736

assign ( resid 95 and name HB2
  )
       ( resid 95 and name HE2
  or resid 95 and name HE1
  ) 3.6 1.8 0.7 volume=0.455 peak=1144 ppm1=1.193 ppm2=2.820

assign ( resid 74 and name HD2#
  )
       ( resid 78 and name HN
  ) 4.2 2.4 0.8 volume=0.190 peak=1436 ppm1=0.770 ppm2=7.465

assign ( resid 85 and name HA
  )
       ( resid 85 and name HN
  ) 3.6 1.8 0.7 volume=0.471 peak=2036 ppm1=4.088 ppm2=7.944

assign ( resid 105 and name HA
  )
       ( resid 108 and name HN
  ) 3.9 2.1 0.8 volume=0.307 peak=1188 ppm1=3.843 ppm2=6.921

assign ( resid 77 and name HD2#
  )
       ( resid 77 and name HA
  ) 3.0 1.2 0.6 volume=1.383 peak=1698 ppm1=0.735 ppm2=3.902

assign ( resid 88 and name HE1 or resid 88 and name HE2
  )
       ( resid 100 and name HA
  ) 3.4 1.6 0.7 volume=0.746 peak=8 ppm1=6.669 ppm2=3.202

assign ( resid 99 and name HG2#
  )
       ( resid 102 and name HD21
  ) 4.0 2.2 0.8 volume=0.259 peak=1282 ppm1=1.080 ppm2=6.800

assign ( resid 60 and name HB2
  )
       ( resid 60 and name HD1 or resid 60 and name HD2
  ) 3.2 1.4 0.6 volume=1.079 peak=1225 ppm1=2.619 ppm2=6.824

assign ( resid 100 and name HN
  )
       ( resid 100 and name HA
  ) 3.2 1.4 0.6 volume=1.068 peak=665 ppm1=8.334 ppm2=3.210

assign ( resid 104 and name HN
  )
       ( resid 103 and name HG
  ) 2.9 1.1 0.6 volume=1.932 peak=264 ppm1=8.128 ppm2=1.325

assign ( resid 66 and name HN
  )
       ( resid 67 and name HN
  ) 3.0 1.2 0.6 volume=1.391 peak=354 ppm1=8.127 ppm2=7.829

assign ( resid 79 and name HA
  )
       ( resid 79 and name HN
  ) 3.7 1.9 0.7 volume=0.405 peak=1377 ppm1=3.478 ppm2=8.412

assign ( resid 74 and name HN
  )
       ( resid 72 and name HN
  ) 3.6 1.8 0.7 volume=0.481 peak=218 ppm1=6.396 ppm2=8.445

assign ( resid 108 and name HB2
  )
       ( resid 108 and name HA
  ) 3.4 1.6 0.7 volume=0.729 peak=1272 ppm1=1.353 ppm2=3.961

assign ( resid 101 and name HA1
  )
       ( resid 104 and name HB2
  ) 3.3 1.5 0.7 volume=0.836 peak=1324 ppm1=3.662 ppm2=1.675

assign ( resid 104 and name HA
  )
       ( resid 107 and name HB2
  ) 3.2 1.4 0.6 volume=1.045 peak=1984 ppm1=3.914 ppm2=2.136

assign ( resid 67 and name HN
  )
       ( resid 66 and name HA1
  ) 3.5 1.7 0.7 volume=0.547 peak=592 ppm1=7.821 ppm2=4.091

assign ( resid 103 and name HB1
  )
       ( resid 88 and name HB1
  ) 3.8 2.0 0.8 volume=0.359 peak=2383 ppm1=1.131 ppm2=2.654

assign ( resid 78 and name HD2
  )
       ( resid 79 and name HB2
  or resid 79 and name HB1
  ) 3.4 1.6 0.7 volume=0.739 peak=102 ppm1=6.724 ppm2=1.809

assign ( resid 76 and name HN
  )
       ( resid 74 and name HN
  ) 4.0 2.2 0.8 volume=0.268 peak=394 ppm1=8.458 ppm2=6.399

assign ( resid 74 and name HN
  )
       ( resid 74 and name HA
  ) 3.2 1.4 0.6 volume=0.966 peak=662 ppm1=6.394 ppm2=3.942

assign ( resid 96 and name HB1
  )
       ( resid 96 and name HG
  ) 3.3 1.5 0.7 volume=0.888 peak=1653 ppm1=1.310 ppm2=1.426

assign ( resid 97 and name HB2
  )
       ( resid 103 and name HD1#
  ) 3.8 2.0 0.8 volume=0.334 peak=1110 ppm1=3.116 ppm2=0.823

assign ( resid 107 and name HB2
  )
       ( resid 104 and name HA
  ) 3.8 2.0 0.8 volume=0.354 peak=1443 ppm1=2.123 ppm2=3.919

assign ( resid 78 and name HB1
  )
       ( resid 78 and name HA
  ) 3.6 1.8 0.7 volume=0.527 peak=1642 ppm1=2.856 ppm2=3.993

assign ( resid 60 and name HB2
  )
       ( resid 75 and name HB1
  ) 4.0 2.2 0.8 volume=0.260 peak=1142 ppm1=2.625 ppm2=1.851

assign ( resid 92 and name HN
  )
       ( resid 91 and name HG1
  ) 3.3 1.5 0.7 volume=0.830 peak=255 ppm1=8.369 ppm2=2.272

assign ( resid 104 and name HB1
  or resid 104 and name HB2
  )
       ( resid 104 and name HG1
  ) 2.6 0.8 0.5 volume=3.768 peak=1170 ppm1=1.678 ppm2=1.268

assign ( resid 75 and name HB2
  )
       ( resid 75 and name HB1
  ) 3.7 1.9 0.7 volume=0.410 peak=2284 ppm1=1.260 ppm2=1.850

assign ( resid 71 and name HN
  )
       ( resid 71 and name HD1#
  ) 3.4 1.6 0.7 volume=0.697 peak=804 ppm1=6.744 ppm2=0.937

assign ( resid 72 and name HB
  )
       ( resid 72 and name HG11
  ) 3.0 1.2 0.6 volume=1.461 peak=2051 ppm1=0.879 ppm2=0.718

assign ( resid 103 and name HD2#
  )
       ( resid 100 and name HB1
  ) 4.2 2.4 0.8 volume=0.208 peak=1762 ppm1=0.876 ppm2=3.367

assign ( resid 75 and name HD2#
  )
       ( resid 69 and name HB2
  ) 3.6 1.8 0.7 volume=0.500 peak=2202 ppm1=0.850 ppm2=3.076

assign ( resid 109 and name HN
  )
       ( resid 109 and name HB
  ) 2.8 1.0 0.6 volume=2.348 peak=224 ppm1=7.806 ppm2=1.775

assign ( resid 67 and name HB2
  or resid 67 and name HB1
  )
       ( resid 67 and name HN
  ) 3.3 1.5 0.7 volume=0.848 peak=1972 ppm1=1.216 ppm2=7.829

assign ( resid 89 and name HB2
  )
       ( resid 89 and name HD2
  ) 3.5 1.7 0.7 volume=0.538 peak=1537 ppm1=1.288 ppm2=2.929

assign ( resid 101 and name HA1
  )
       ( resid 104 and name HB1
  or resid 104 and name HB2
  ) 3.4 1.6 0.7 volume=0.652 peak=2191 ppm1=3.567 ppm2=1.675

assign ( resid 109 and name HN
  )
       ( resid 108 and name HD1#
  ) 3.6 1.8 0.7 volume=0.458 peak=289 ppm1=7.806 ppm2=0.724

assign ( resid 109 and name HN
  )
       ( resid 108 and name HB2
  ) 3.2 1.4 0.6 volume=1.006 peak=477 ppm1=7.807 ppm2=1.356

assign ( resid 71 and name HB1
  )
       ( resid 71 and name HB2
  ) 4.5 2.7 0.9 volume=0.132 peak=1958 ppm1=1.343 ppm2=1.651

assign ( resid 65 and name HB2
  )
       ( resid 64 and name HG1
  ) 4.2 2.4 0.8 volume=0.190 peak=1205 ppm1=3.290 ppm2=1.623

assign ( resid 74 and name HD2#
  )
       ( resid 71 and name HN
  ) 3.6 1.8 0.7 volume=0.510 peak=1248 ppm1=0.770 ppm2=6.724

assign ( resid 82 and name HB2
  )
       ( resid 82 and name HN
  ) 3.4 1.6 0.7 volume=0.720 peak=1905 ppm1=3.150 ppm2=7.138

assign ( resid 90 and name HN
  )
       ( resid 89 and name HA
  ) 2.6 0.8 0.5 volume=3.201 peak=519 ppm1=9.125 ppm2=4.850

assign ( resid 111 and name HN
  )
       ( resid 109 and name HA
  ) 3.0 1.2 0.6 volume=1.565 peak=791 ppm1=7.582 ppm2=3.757

assign ( resid 74 and name HB2
  )
       ( resid 74 and name HD1#
  ) 3.5 1.7 0.7 volume=0.618 peak=1174 ppm1=1.751 ppm2=1.050

assign ( resid 69 and name HN
  )
       ( resid 60 and name HN
  ) 3.4 1.6 0.7 volume=0.640 peak=260 ppm1=8.412 ppm2=7.686

assign ( resid 71 and name HD1#
  )
       ( resid 71 and name HN
  ) 3.4 1.6 0.7 volume=0.718 peak=1522 ppm1=0.912 ppm2=6.750

assign ( resid 75 and name HD1#
  )
       ( resid 62 and name HN
  ) 4.1 2.3 0.8 volume=0.239 peak=1033 ppm1=0.888 ppm2=8.879

assign ( resid 107 and name HN
  )
       ( resid 106 and name HB2
  ) 2.9 1.1 0.6 volume=1.903 peak=116 ppm1=8.026 ppm2=2.824

assign ( resid 89 and name HB1
  )
       ( resid 89 and name HD2
  ) 3.4 1.6 0.7 volume=0.657 peak=1346 ppm1=1.606 ppm2=2.930

assign ( resid 69 and name HD1 or resid 69 and name HD2
  )
       ( resid 75 and name HD1#
  ) 2.8 1.0 0.6 volume=2.314 peak=101 ppm1=6.905 ppm2=0.882

assign ( resid 96 and name HB1
  )
       ( resid 96 and name HN
  ) 3.3 1.5 0.7 volume=0.796 peak=1011 ppm1=1.316 ppm2=7.584

assign ( resid 97 and name HZ
  )
       ( resid 95 and name HG1
  ) 3.9 2.1 0.8 volume=0.284 peak=47 ppm1=5.907 ppm2=1.033

assign ( resid 74 and name HA
  )
       ( resid 74 and name HN
  ) 3.8 2.0 0.8 volume=0.342 peak=1362 ppm1=3.933 ppm2=6.406

assign ( resid 75 and name HB1
  )
       ( resid 76 and name HN
  ) 4.0 2.2 0.8 volume=0.265 peak=1387 ppm1=1.857 ppm2=8.442

assign ( resid 89 and name HN
  )
       ( resid 89 and name HD2
  ) 3.6 1.8 0.7 volume=0.531 peak=273 ppm1=8.390 ppm2=2.934

assign ( resid 80 and name HA
  )
       ( resid 80 and name HG1
  ) 2.7 0.9 0.5 volume=2.989 peak=1101 ppm1=3.924 ppm2=1.349

assign ( resid 97 and name HB1
  )
       ( resid 97 and name HB2
  ) 3.7 1.9 0.7 volume=0.387 peak=1254 ppm1=2.661 ppm2=3.121

assign ( resid 78 and name HN
  )
       ( resid 77 and name HD1#
  ) 3.6 1.8 0.7 volume=0.535 peak=175 ppm1=7.445 ppm2=0.731

assign ( resid 104 and name HA
  )
       ( resid 104 and name HG1
  ) 3.0 1.2 0.6 volume=1.534 peak=1192 ppm1=3.915 ppm2=1.268

assign ( resid 69 and name HD1 or resid 69 and name HD2
  )
       ( resid 74 and name HD1#
  ) 3.1 1.3 0.6 volume=1.121 peak=31 ppm1=6.906 ppm2=1.053

assign ( resid 109 and name HA
  )
       ( resid 108 and name HB2
  ) 3.8 2.0 0.8 volume=0.344 peak=1853 ppm1=3.780 ppm2=1.353

assign ( resid 95 and name HB2
  )
       ( resid 95 and name HB1
  ) 2.4 0.6 0.5 volume=6.047 peak=1119 ppm1=1.194 ppm2=1.266

assign ( resid 90 and name HN
  )
       ( resid 89 and name HB2
  ) 3.2 1.4 0.6 volume=1.096 peak=217 ppm1=9.117 ppm2=1.304

assign ( resid 74 and name HD2#
  )
       ( resid 74 and name HB2
  ) 3.0 1.2 0.6 volume=1.454 peak=1508 ppm1=0.763 ppm2=1.748

assign ( resid 103 and name HD1#
  )
       ( resid 103 and name HA
  ) 2.9 1.1 0.6 volume=1.740 peak=2084 ppm1=0.809 ppm2=3.027

assign ( resid 96 and name HN
  )
       ( resid 96 and name HB2
  ) 2.7 0.9 0.5 volume=2.584 peak=263 ppm1=7.583 ppm2=1.075

assign ( resid 90 and name HA
  )
       ( resid 90 and name HN
  ) 5.1 3.3 0.9 volume=0.062 peak=1495 ppm1=4.432 ppm2=9.155

assign ( resid 109 and name HA
  )
       ( resid 109 and name HG1#
  ) 3.0 1.2 0.6 volume=1.613 peak=1018 ppm1=3.775 ppm2=0.318

assign ( resid 74 and name HB2
  )
       ( resid 74 and name HN
  ) 4.1 2.3 0.8 volume=0.219 peak=1040 ppm1=1.751 ppm2=6.399

assign ( resid 96 and name HB2
  )
       ( resid 97 and name HN
  ) 4.0 2.2 0.8 volume=0.260 peak=1392 ppm1=1.054 ppm2=8.690

assign ( resid 99 and name HN
  )
       ( resid 97 and name HB1
  ) 2.8 1.0 0.6 volume=2.358 peak=318 ppm1=7.055 ppm2=2.676

assign ( resid 88 and name HE1 or resid 88 and name HE2
  )
       ( resid 103 and name HD2#
  ) 3.2 1.4 0.6 volume=0.988 peak=26 ppm1=6.668 ppm2=0.878

assign ( resid 60 and name HN
  )
       ( resid 70 and name HA
  ) 3.5 1.7 0.7 volume=0.561 peak=632 ppm1=7.708 ppm2=4.314

assign ( resid 74 and name HD2#
  )
       ( resid 69 and name HB2
  ) 3.6 1.8 0.7 volume=0.461 peak=1213 ppm1=0.765 ppm2=3.058

assign ( resid 74 and name HB1
  )
       ( resid 74 and name HD1#
  ) 3.3 1.5 0.7 volume=0.813 peak=1262 ppm1=1.293 ppm2=1.049

assign ( resid 103 and name HD1#
  )
       ( resid 90 and name HA
  ) 4.0 2.2 0.8 volume=0.271 peak=1787 ppm1=0.808 ppm2=4.426

assign ( resid 98 and name HB
  )
       ( resid 98 and name HG2#
  ) 3.1 1.3 0.6 volume=1.260 peak=1816 ppm1=4.343 ppm2=1.128

assign ( resid 74 and name HD1#
  )
       ( resid 71 and name HN
  ) 3.7 1.9 0.7 volume=0.432 peak=1589 ppm1=1.038 ppm2=6.732

assign ( resid 97 and name HB2
  )
       ( resid 103 and name HN
  ) 3.9 2.1 0.8 volume=0.318 peak=1708 ppm1=3.118 ppm2=7.204

assign ( resid 104 and name HB1
  or resid 104 and name HB2
  )
       ( resid 105 and name HN
  ) 3.2 1.4 0.6 volume=0.930 peak=1123 ppm1=1.676 ppm2=7.549

assign ( resid 75 and name HA
  )
       ( resid 75 and name HN
  ) 3.9 2.1 0.8 volume=0.296 peak=2171 ppm1=3.468 ppm2=7.046

assign ( resid 106 and name HN
  )
       ( resid 108 and name HN
  ) 3.8 2.0 0.8 volume=0.353 peak=508 ppm1=7.301 ppm2=6.909

assign ( resid 87 and name HA
  )
       ( resid 87 and name HD2
  ) 3.6 1.8 0.7 volume=0.458 peak=2322 ppm1=4.187 ppm2=2.857

assign ( resid 76 and name HN
  )
       ( resid 76 and name HA
  ) 2.9 1.1 0.6 volume=1.647 peak=459 ppm1=8.458 ppm2=4.202

assign ( resid 85 and name HB1
  )
       ( resid 85 and name HG2
  ) 2.4 0.6 0.5 volume=5.304 peak=1395 ppm1=1.857 ppm2=2.081

assign ( resid 64 and name HN
  )
       ( resid 63 and name HB1
  ) 3.4 1.6 0.7 volume=0.758 peak=205 ppm1=8.557 ppm2=1.999

assign ( resid 103 and name HN
  )
       ( resid 103 and name HB2
  ) 2.8 1.0 0.6 volume=2.452 peak=814 ppm1=7.218 ppm2=1.824

assign ( resid 107 and name HB1
  )
       ( resid 107 and name HG1
  ) 3.2 1.4 0.6 volume=1.037 peak=1689 ppm1=2.049 ppm2=2.640

assign ( resid 74 and name HA
  )
       ( resid 77 and name HN
  ) 3.4 1.6 0.7 volume=0.654 peak=1580 ppm1=3.920 ppm2=7.291

assign ( resid 100 and name HB2
  )
       ( resid 88 and name HB2
  ) 4.2 2.4 0.8 volume=0.189 peak=2306 ppm1=3.532 ppm2=2.775

assign ( resid 59 and name HA
  )
       ( resid 59 and name HG2
  ) 3.7 1.9 0.7 volume=0.420 peak=1160 ppm1=4.065 ppm2=1.576

assign ( resid 110 and name HN
  )
       ( resid 110 and name HA
  ) 3.1 1.3 0.6 volume=1.300 peak=794 ppm1=7.117 ppm2=4.720

assign ( resid 107 and name HG2
  )
       ( resid 107 and name HB2
  ) 3.5 1.7 0.7 volume=0.622 peak=1924 ppm1=2.697 ppm2=2.126

assign ( resid 110 and name HN
  )
       ( resid 110 and name HB2
  ) 2.8 1.0 0.6 volume=2.133 peak=347 ppm1=7.118 ppm2=3.002

assign ( resid 75 and name HB1
  )
       ( resid 75 and name HD2#
  ) 3.0 1.2 0.6 volume=1.451 peak=1442 ppm1=1.853 ppm2=0.847

assign ( resid 78 and name HN
  )
       ( resid 79 and name HN
  ) 3.1 1.3 0.6 volume=1.139 peak=738 ppm1=7.446 ppm2=8.421

assign ( resid 103 and name HA
  )
       ( resid 103 and name HN
  ) 3.5 1.7 0.7 volume=0.609 peak=1798 ppm1=3.031 ppm2=7.224

assign ( resid 78 and name HN
  )
       ( resid 78 and name HB2
  ) 2.8 1.0 0.6 volume=2.022 peak=493 ppm1=7.447 ppm2=3.199

assign ( resid 105 and name HG2
  )
       ( resid 106 and name HN
  ) 3.8 2.0 0.8 volume=0.373 peak=1980 ppm1=1.572 ppm2=7.307

assign ( resid 79 and name HN
  )
       ( resid 77 and name HN
  ) 4.1 2.3 0.8 volume=0.220 peak=585 ppm1=8.419 ppm2=7.272

assign ( resid 69 and name HN
  )
       ( resid 68 and name HA
  ) 3.0 1.2 0.6 volume=1.367 peak=737 ppm1=8.415 ppm2=5.105

assign ( resid 108 and name HN
  )
       ( resid 107 and name HN
  ) 3.0 1.2 0.6 volume=1.346 peak=385 ppm1=6.917 ppm2=8.023

assign ( resid 79 and name HE2
  )
       ( resid 75 and name HD2#
  or resid 75 and name HD1#
  ) 3.4 1.6 0.7 volume=0.686 peak=1639 ppm1=2.956 ppm2=0.871

assign ( resid 95 and name HD1
  )
       ( resid 95 and name HG1
  ) 2.8 1.0 0.6 volume=2.474 peak=1910 ppm1=1.344 ppm2=1.029

assign ( resid 88 and name HN
  )
       ( resid 88 and name HA
  ) 3.0 1.2 0.6 volume=1.361 peak=2333 ppm1=8.308 ppm2=4.449

assign ( resid 105 and name HN
  )
       ( resid 105 and name HA
  ) 2.6 0.8 0.5 volume=3.216 peak=570 ppm1=7.547 ppm2=3.854

assign ( resid 109 and name HG2#
  )
       ( resid 108 and name HB2
  ) 3.8 2.0 0.8 volume=0.330 peak=1880 ppm1=0.487 ppm2=1.358

assign ( resid 59 and name HD1
  )
       ( resid 60 and name HN
  ) 4.3 2.5 0.9 volume=0.165 peak=2073 ppm1=3.396 ppm2=7.703

assign ( resid 70 and name HN
  )
       ( resid 74 and name HB1
  ) 4.3 2.5 0.9 volume=0.182 peak=211 ppm1=9.249 ppm2=1.345

assign ( resid 90 and name HB1
  )
       ( resid 90 and name HB2
  ) 2.8 1.0 0.6 volume=2.076 peak=1167 ppm1=3.262 ppm2=2.726

assign ( resid 68 and name HN
  )
       ( resid 68 and name HB1
  ) 3.4 1.6 0.7 volume=0.687 peak=799 ppm1=7.667 ppm2=3.491

assign ( resid 97 and name HE1 or resid 97 and name HE2
  )
       ( resid 103 and name HD1#
  ) 3.0 1.2 0.6 volume=1.542 peak=19 ppm1=6.683 ppm2=0.820

assign ( resid 85 and name HN
  )
       ( resid 85 and name HG2
  ) 3.2 1.4 0.6 volume=0.996 peak=661 ppm1=7.944 ppm2=2.089

assign ( resid 72 and name HG11
  )
       ( resid 60 and name HD1 or resid 60 and name HD2
  ) 4.2 2.4 0.8 volume=0.184 peak=1923 ppm1=0.702 ppm2=6.825

assign ( resid 87 and name HA
  )
       ( resid 87 and name HB2
  or resid 87 and name HB1
  ) 2.9 1.1 0.6 volume=1.950 peak=2340 ppm1=4.186 ppm2=1.363

assign ( resid 89 and name HN
  )
       ( resid 89 and name HB2
  ) 2.9 1.1 0.6 volume=1.879 peak=324 ppm1=8.391 ppm2=1.294

assign ( resid 96 and name HD1#
  )
       ( resid 87 and name HA
  ) 4.1 2.3 0.8 volume=0.212 peak=1400 ppm1=0.563 ppm2=4.167

assign ( resid 94 and name HA1
  )
       ( resid 94 and name HN
  ) 3.1 1.3 0.6 volume=1.113 peak=1601 ppm1=3.576 ppm2=8.299

assign ( resid 97 and name HE1 or resid 97 and name HE2
  )
       ( resid 95 and name HB1
  ) 3.3 1.5 0.7 volume=0.870 peak=77 ppm1=6.680 ppm2=1.267

assign ( resid 66 and name HA1
  )
       ( resid 66 and name HN
  ) 3.5 1.7 0.7 volume=0.590 peak=2129 ppm1=4.095 ppm2=8.126

assign ( resid 100 and name HB1
  )
       ( resid 100 and name HB2
  ) 2.7 0.9 0.5 volume=2.758 peak=1916 ppm1=3.370 ppm2=3.523

assign ( resid 98 and name HG2#
  )
       ( resid 99 and name HN
  ) 4.6 2.8 0.9 volume=0.112 peak=1444 ppm1=1.128 ppm2=7.053

assign ( resid 85 and name HB2
  )
       ( resid 85 and name HG2
  ) 2.4 0.6 0.5 volume=5.336 peak=989 ppm1=1.794 ppm2=2.085

assign ( resid 97 and name HD1 or resid 97 and name HD2
  )
       ( resid 97 and name HB2
  ) 3.1 1.3 0.6 volume=1.109 peak=76 ppm1=7.102 ppm2=3.108

assign ( resid 94 and name HN
  )
       ( resid 90 and name HN
  ) 3.9 2.1 0.8 volume=0.294 peak=736 ppm1=8.295 ppm2=9.123

assign ( resid 105 and name HN
  )
       ( resid 105 and name HB2
  or resid 105 and name HB1
  ) 2.2 0.4 0.4 volume=9.238 peak=256 ppm1=7.547 ppm2=1.669

assign ( resid 87 and name HA
  )
       ( resid 87 and name HG2
  ) 3.5 1.7 0.7 volume=0.588 peak=2314 ppm1=4.184 ppm2=1.192

assign ( resid 106 and name HB2
  )
       ( resid 106 and name HB1
  ) 3.0 1.2 0.6 volume=1.586 peak=1658 ppm1=2.811 ppm2=2.587

assign ( resid 67 and name HN
  )
       ( resid 66 and name HN
  ) 3.4 1.6 0.7 volume=0.737 peak=673 ppm1=7.825 ppm2=8.103

assign ( resid 71 and name HN
  )
       ( resid 74 and name HB2
  ) 3.3 1.5 0.7 volume=0.857 peak=707 ppm1=6.745 ppm2=1.770

assign ( resid 105 and name HA
  )
       ( resid 105 and name HD2
  or resid 105 and name HD1
  ) 3.5 1.7 0.7 volume=0.561 peak=1340 ppm1=3.845 ppm2=3.054

assign ( resid 107 and name HE21
  )
       ( resid 103 and name HD1#
  ) 3.4 1.6 0.7 volume=0.744 peak=411 ppm1=7.493 ppm2=0.812

assign ( resid 89 and name HN
  )
       ( resid 90 and name HN
  ) 3.8 2.0 0.8 volume=0.368 peak=225 ppm1=8.391 ppm2=9.118

assign ( resid 95 and name HE2
  or resid 95 and name HE1
  )
       ( resid 95 and name HA
  ) 3.4 1.6 0.7 volume=0.722 peak=1403 ppm1=2.820 ppm2=3.844

assign ( resid 101 and name HA1
  )
       ( resid 99 and name HG2#
  ) 3.6 1.8 0.7 volume=0.477 peak=1384 ppm1=3.578 ppm2=1.096

assign ( resid 68 and name HB1
  )
       ( resid 69 and name HN
  ) 3.6 1.8 0.7 volume=0.509 peak=1541 ppm1=3.496 ppm2=8.414

assign ( resid 89 and name HA
  )
       ( resid 97 and name HN
  ) 4.8 3.0 1.0 volume=0.087 peak=2066 ppm1=4.859 ppm2=8.714

assign ( resid 75 and name HN
  )
       ( resid 74 and name HN
  ) 3.3 1.5 0.7 volume=0.870 peak=267 ppm1=7.048 ppm2=6.393

assign ( resid 100 and name HN
  )
       ( resid 99 and name HG2#
  ) 3.2 1.4 0.6 volume=1.065 peak=542 ppm1=8.336 ppm2=1.082

assign ( resid 77 and name HN
  )
       ( resid 76 and name HN
  ) 3.1 1.3 0.6 volume=1.207 peak=124 ppm1=7.291 ppm2=8.450

assign ( resid 109 and name HG1#
  )
       ( resid 112 and name HA1
  or resid 112 and name HA2
  ) 4.7 2.9 0.9 volume=0.104 peak=1622 ppm1=0.307 ppm2=3.620

assign ( resid 92 and name HN
  )
       ( resid 90 and name HN
  ) 4.1 2.3 0.8 volume=0.218 peak=687 ppm1=8.370 ppm2=9.110

assign ( resid 96 and name HG
  )
       ( resid 96 and name HD1#
  ) 3.0 1.2 0.6 volume=1.406 peak=1943 ppm1=1.423 ppm2=0.562

assign ( resid 110 and name HB1
  )
       ( resid 110 and name HN
  ) 3.5 1.7 0.7 volume=0.559 peak=1745 ppm1=3.140 ppm2=7.126

assign ( resid 107 and name HB1
  )
       ( resid 107 and name HN
  ) 3.4 1.6 0.7 volume=0.717 peak=996 ppm1=2.053 ppm2=8.025

assign ( resid 89 and name HN
  )
       ( resid 96 and name HD1#
  ) 3.4 1.6 0.7 volume=0.728 peak=378 ppm1=8.397 ppm2=0.564

assign ( resid 60 and name HE1 or resid 60 and name HE2
  )
       ( resid 72 and name HG11
  ) 3.2 1.4 0.6 volume=1.006 peak=39 ppm1=6.756 ppm2=0.720

assign ( resid 75 and name HD2#
  )
       ( resid 72 and name HA
  ) 3.5 1.7 0.7 volume=0.593 peak=1646 ppm1=0.849 ppm2=3.151

assign ( resid 59 and name HA
  )
       ( resid 60 and name HN
  ) 3.5 1.7 0.7 volume=0.588 peak=2267 ppm1=4.065 ppm2=7.710

assign ( resid 89 and name HB1
  )
       ( resid 89 and name HB2
  ) 2.7 0.9 0.5 volume=2.899 peak=1175 ppm1=1.598 ppm2=1.290

assign ( resid 87 and name HN
  )
       ( resid 88 and name HN
  ) 2.9 1.1 0.6 volume=1.854 peak=2311 ppm1=7.707 ppm2=8.303

assign ( resid 71 and name HD2#
  )
       ( resid 74 and name HN
  ) 3.7 1.9 0.7 volume=0.406 peak=1240 ppm1=0.809 ppm2=6.396

assign ( resid 76 and name HD21
  )
       ( resid 76 and name HB2
  or resid 76 and name HB1
  ) 3.1 1.3 0.6 volume=1.254 peak=715 ppm1=7.306 ppm2=2.565

assign ( resid 107 and name HB1
  )
       ( resid 107 and name HA
  ) 3.4 1.6 0.7 volume=0.708 peak=2081 ppm1=2.051 ppm2=3.449

assign ( resid 64 and name HG2
  )
       ( resid 64 and name HB1
  ) 3.1 1.3 0.6 volume=1.262 peak=931 ppm1=1.760 ppm2=1.348

assign ( resid 77 and name HN
  )
       ( resid 77 and name HD1#
  or resid 77 and name HD2#
  ) 3.0 1.2 0.6 volume=1.506 peak=474 ppm1=7.293 ppm2=0.730

assign ( resid 108 and name HA
  )
       ( resid 108 and name HD1#
  ) 2.5 0.7 0.5 volume=4.665 peak=1489 ppm1=3.950 ppm2=0.728

assign ( resid 107 and name HA
  )
       ( resid 107 and name HG1
  ) 3.2 1.4 0.6 volume=1.006 peak=1013 ppm1=3.453 ppm2=2.644

assign ( resid 72 and name HG12
  )
       ( resid 72 and name HN
  ) 4.7 2.9 0.9 volume=0.103 peak=1719 ppm1=0.774 ppm2=8.444

assign ( resid 64 and name HN
  )
       ( resid 62 and name HA
  ) 3.8 2.0 0.8 volume=0.365 peak=231 ppm1=8.559 ppm2=4.306

assign ( resid 80 and name HE2
  or resid 80 and name HE1
  )
       ( resid 77 and name HD1#
  ) 3.1 1.3 0.6 volume=1.102 peak=2254 ppm1=2.817 ppm2=0.716

assign ( resid 110 and name HE1
  )
       ( resid 93 and name HB1
  ) 3.0 1.2 0.6 volume=1.426 peak=45 ppm1=7.858 ppm2=3.286

assign ( resid 74 and name HN
  )
       ( resid 71 and name HN
  ) 3.7 1.9 0.7 volume=0.434 peak=621 ppm1=6.392 ppm2=6.731

assign ( resid 72 and name HA
  )
       ( resid 60 and name HB1
  ) 4.1 2.3 0.8 volume=0.227 peak=1363 ppm1=3.160 ppm2=2.860

assign ( resid 100 and name HA
  )
       ( resid 103 and name HD2#
  ) 3.5 1.7 0.7 volume=0.592 peak=1388 ppm1=3.213 ppm2=0.871

assign ( resid 88 and name HB2
  )
       ( resid 88 and name HE1 or resid 88 and name HE2
  ) 3.8 2.0 0.8 volume=0.331 peak=2356 ppm1=2.752 ppm2=6.674

assign ( resid 103 and name HB1
  )
       ( resid 103 and name HD2#
  ) 3.2 1.4 0.6 volume=1.016 peak=2257 ppm1=1.131 ppm2=0.879

assign ( resid 88 and name HN
  )
       ( resid 96 and name HA
  ) 3.8 2.0 0.8 volume=0.350 peak=2389 ppm1=8.308 ppm2=4.775

assign ( resid 80 and name HD2
  or resid 80 and name HD1
  )
       ( resid 80 and name HE2
  ) 2.4 0.6 0.5 volume=6.191 peak=1102 ppm1=1.526 ppm2=2.822

assign ( resid 103 and name HD2#
  )
       ( resid 103 and name HB2
  ) 3.0 1.2 0.6 volume=1.535 peak=2122 ppm1=0.876 ppm2=1.821

assign ( resid 75 and name HN
  )
       ( resid 71 and name HB1
  ) 3.4 1.6 0.7 volume=0.720 peak=834 ppm1=7.046 ppm2=1.377

assign ( resid 103 and name HD2#
  )
       ( resid 88 and name HD1 or resid 88 and name HD2
  ) 3.3 1.5 0.7 volume=0.901 peak=1782 ppm1=0.876 ppm2=6.809

assign ( resid 76 and name HB2
  or resid 76 and name HB1
  )
       ( resid 76 and name HD22
  ) 4.0 2.2 0.8 volume=0.257 peak=1801 ppm1=2.571 ppm2=6.571

assign ( resid 69 and name HB1
  )
       ( resid 75 and name HN
  ) 4.4 2.6 0.9 volume=0.155 peak=2136 ppm1=2.512 ppm2=7.059

assign ( resid 65 and name HA
  )
       ( resid 66 and name HN
  ) 4.4 2.6 0.9 volume=0.158 peak=1173 ppm1=5.000 ppm2=8.125

assign ( resid 109 and name HN
  )
       ( resid 109 and name HA
  ) 2.7 0.9 0.5 volume=2.550 peak=314 ppm1=7.805 ppm2=3.775

assign ( resid 100 and name HA
  )
       ( resid 100 and name HB2
  ) 3.3 1.5 0.7 volume=0.796 peak=1137 ppm1=3.214 ppm2=3.524

assign ( resid 82 and name HN
  )
       ( resid 79 and name HA
  ) 3.5 1.7 0.7 volume=0.558 peak=407 ppm1=7.134 ppm2=3.459

assign ( resid 111 and name HN
  )
       ( resid 108 and name HA
  ) 3.3 1.5 0.7 volume=0.824 peak=702 ppm1=7.587 ppm2=3.955

assign ( resid 92 and name HN
  )
       ( resid 93 and name HN
  ) 2.5 0.7 0.5 volume=3.934 peak=398 ppm1=8.367 ppm2=7.746

assign ( resid 100 and name HB1
  )
       ( resid 100 and name HN
  ) 4.2 2.4 0.8 volume=0.198 peak=1133 ppm1=3.369 ppm2=8.329

assign ( resid 72 and name HA
  )
       ( resid 60 and name HD1 or resid 60 and name HD2
  ) 4.1 2.3 0.8 volume=0.241 peak=2028 ppm1=3.157 ppm2=6.835

assign ( resid 71 and name HN
  )
       ( resid 70 and name HN
  ) 4.0 2.2 0.8 volume=0.274 peak=377 ppm1=6.745 ppm2=9.270

assign ( resid 89 and name HB2
  )
       ( resid 96 and name HD1#
  ) 3.3 1.5 0.7 volume=0.788 peak=1526 ppm1=1.289 ppm2=0.566

assign ( resid 103 and name HD1#
  )
       ( resid 88 and name HA
  ) 4.1 2.3 0.8 volume=0.233 peak=1086 ppm1=0.809 ppm2=4.449

assign ( resid 104 and name HE2
  or resid 104 and name HE1
  )
       ( resid 104 and name HN
  ) 4.0 2.2 0.8 volume=0.254 peak=1199 ppm1=2.777 ppm2=8.129

assign ( resid 100 and name HN
  )
       ( resid 99 and name HA
  ) 2.8 1.0 0.6 volume=2.249 peak=338 ppm1=8.334 ppm2=4.479

assign ( resid 61 and name HN
  )
       ( resid 60 and name HB2
  ) 3.8 2.0 0.8 volume=0.341 peak=301 ppm1=8.402 ppm2=2.621

assign ( resid 75 and name HN
  )
       ( resid 74 and name HA
  ) 3.8 2.0 0.8 volume=0.351 peak=492 ppm1=7.048 ppm2=3.944

assign ( resid 89 and name HD2
  )
       ( resid 96 and name HD1#
  ) 3.3 1.5 0.7 volume=0.792 peak=1770 ppm1=2.929 ppm2=0.564

assign ( resid 75 and name HN
  )
       ( resid 76 and name HN
  ) 3.2 1.4 0.6 volume=1.097 peak=180 ppm1=7.051 ppm2=8.462

assign ( resid 93 and name HB1
  )
       ( resid 93 and name HN
  ) 3.6 1.8 0.7 volume=0.519 peak=2229 ppm1=3.284 ppm2=7.747

assign ( resid 82 and name HN
  )
       ( resid 81 and name HB1
  ) 3.3 1.5 0.7 volume=0.907 peak=583 ppm1=7.140 ppm2=1.382

assign ( resid 77 and name HA
  )
       ( resid 77 and name HD1#
  ) 2.7 0.9 0.5 volume=2.906 peak=890 ppm1=3.907 ppm2=0.709

assign ( resid 82 and name HE1
  )
       ( resid 65 and name HB1
  ) 2.9 1.1 0.6 volume=1.670 peak=64 ppm1=7.873 ppm2=2.752

assign ( resid 109 and name HN
  )
       ( resid 109 and name HG2#
  ) 2.6 0.8 0.5 volume=3.347 peak=653 ppm1=7.805 ppm2=0.479

assign ( resid 62 and name HB2
  )
       ( resid 62 and name HB1
  ) 3.3 1.5 0.7 volume=0.852 peak=2172 ppm1=2.662 ppm2=3.227

assign ( resid 95 and name HN
  )
       ( resid 95 and name HA
  ) 2.8 1.0 0.6 volume=2.184 peak=856 ppm1=7.735 ppm2=3.841

assign ( resid 90 and name HB1
  )
       ( resid 90 and name HN
  ) 3.6 1.8 0.7 volume=0.506 peak=1226 ppm1=3.255 ppm2=9.128

assign ( resid 64 and name HB1
  )
       ( resid 65 and name HN
  ) 3.4 1.6 0.7 volume=0.675 peak=1184 ppm1=1.347 ppm2=7.875

assign ( resid 108 and name HA
  )
       ( resid 108 and name HN
  ) 3.1 1.3 0.6 volume=1.230 peak=909 ppm1=3.959 ppm2=6.920

assign ( resid 71 and name HN
  )
       ( resid 74 and name HD1#
  ) 3.3 1.5 0.7 volume=0.811 peak=616 ppm1=6.744 ppm2=1.049

assign ( resid 86 and name HB#
  )
       ( resid 96 and name HB1
  ) 2.7 0.9 0.5 volume=2.559 peak=1765 ppm1=1.067 ppm2=1.317

assign ( resid 88 and name HB2
  )
       ( resid 103 and name HB1
  ) 3.5 1.7 0.7 volume=0.578 peak=2351 ppm1=2.751 ppm2=1.137

assign ( resid 81 and name HN
  )
       ( resid 81 and name HD2
  or resid 81 and name HD1
  ) 3.6 1.8 0.7 volume=0.531 peak=795 ppm1=7.622 ppm2=2.970

assign ( resid 86 and name HB#
  )
       ( resid 96 and name HG
  ) 3.1 1.3 0.6 volume=1.298 peak=923 ppm1=1.070 ppm2=1.426

assign ( resid 72 and name HD1#
  )
       ( resid 75 and name HB1
  ) 3.5 1.7 0.7 volume=0.549 peak=956 ppm1=0.555 ppm2=1.849

assign ( resid 74 and name HD2#
  )
       ( resid 75 and name HA
  ) 4.4 2.6 0.9 volume=0.140 peak=1607 ppm1=0.768 ppm2=3.470

assign ( resid 75 and name HA
  )
       ( resid 75 and name HB2
  ) 4.0 2.2 0.8 volume=0.251 peak=1326 ppm1=3.465 ppm2=1.262

assign ( resid 107 and name HE21
  )
       ( resid 107 and name HE22
  ) 2.2 0.4 0.4 volume=10.158 peak=348 ppm1=7.493 ppm2=6.926

assign ( resid 80 and name HE2
  or resid 80 and name HE1
  )
       ( resid 80 and name HB2
  or resid 80 and name HB1
  ) 2.9 1.1 0.6 volume=1.863 peak=1269 ppm1=2.823 ppm2=1.711

assign ( resid 68 and name HA
  )
       ( resid 68 and name HN
  ) 4.7 2.9 0.9 volume=0.096 peak=1799 ppm1=5.125 ppm2=7.686

assign ( resid 106 and name HN
  )
       ( resid 106 and name HB2
  ) 2.6 0.8 0.5 volume=3.668 peak=499 ppm1=7.303 ppm2=2.812

assign ( resid 79 and name HE1
  )
       ( resid 75 and name HD2#
  or resid 75 and name HD1#
  ) 3.3 1.5 0.7 volume=0.831 peak=1981 ppm1=3.085 ppm2=0.868

assign ( resid 108 and name HB1
  )
       ( resid 108 and name HA
  ) 3.5 1.7 0.7 volume=0.592 peak=2006 ppm1=1.586 ppm2=3.955

assign ( resid 73 and name HN
  )
       ( resid 72 and name HB
  ) 3.8 2.0 0.8 volume=0.366 peak=221 ppm1=7.961 ppm2=0.886

assign ( resid 87 and name HD1
  )
       ( resid 87 and name HA
  ) 4.0 2.2 0.8 volume=0.270 peak=2385 ppm1=2.925 ppm2=4.179

assign ( resid 86 and name HN
  )
       ( resid 86 and name HB#
  ) 2.7 0.9 0.5 volume=2.954 peak=164 ppm1=8.201 ppm2=1.069

assign ( resid 69 and name HD1 or resid 69 and name HD2
  )
       ( resid 75 and name HA
  ) 3.4 1.6 0.7 volume=0.680 peak=98 ppm1=6.902 ppm2=3.473

assign ( resid 79 and name HA
  )
       ( resid 82 and name HB2
  ) 4.1 2.3 0.8 volume=0.222 peak=1884 ppm1=3.477 ppm2=3.124

assign ( resid 93 and name HA
  )
       ( resid 94 and name HN
  ) 3.9 2.1 0.8 volume=0.327 peak=1107 ppm1=5.000 ppm2=8.303

assign ( resid 74 and name HD2#
  )
       ( resid 74 and name HD1#
  ) 2.4 0.6 0.5 volume=6.237 peak=1024 ppm1=0.765 ppm2=1.044

assign ( resid 77 and name HD2#
  )
       ( resid 77 and name HG
  ) 2.4 0.6 0.5 volume=5.966 peak=1882 ppm1=0.735 ppm2=1.551

assign ( resid 91 and name HG2
  )
       ( resid 91 and name HB2
  ) 2.4 0.6 0.5 volume=5.286 peak=984 ppm1=2.220 ppm2=1.997

assign ( resid 109 and name HA
  )
       ( resid 109 and name HB
  ) 2.6 0.8 0.5 volume=3.507 peak=1419 ppm1=3.774 ppm2=1.784

assign ( resid 85 and name HG2
  )
       ( resid 85 and name HB2
  ) 2.6 0.8 0.5 volume=3.868 peak=1873 ppm1=2.079 ppm2=1.791

assign ( resid 93 and name HN
  )
       ( resid 93 and name HB1
  ) 3.1 1.3 0.6 volume=1.279 peak=251 ppm1=7.744 ppm2=3.309

assign ( resid 108 and name HD1#
  )
       ( resid 108 and name HA
  ) 2.6 0.8 0.5 volume=3.374 peak=1169 ppm1=0.708 ppm2=3.954

assign ( resid 72 and name HA
  )
       ( resid 75 and name HN
  ) 3.8 2.0 0.8 volume=0.343 peak=2281 ppm1=3.156 ppm2=7.043

assign ( resid 112 and name HN
  )
       ( resid 112 and name HA1
  or resid 112 and name HA2
  ) 2.4 0.6 0.5 volume=6.049 peak=800 ppm1=7.869 ppm2=3.643

assign ( resid 107 and name HB2
  )
       ( resid 107 and name HA
  ) 3.4 1.6 0.7 volume=0.669 peak=962 ppm1=2.128 ppm2=3.454

assign ( resid 112 and name HA1
  )
       ( resid 111 and name HN
  ) 4.3 2.5 0.9 volume=0.173 peak=1003 ppm1=3.646 ppm2=7.556

assign ( resid 71 and name HD2#
  )
       ( resid 71 and name HN
  ) 3.8 2.0 0.8 volume=0.335 peak=2199 ppm1=0.806 ppm2=6.768

assign ( resid 97 and name HD1 or resid 97 and name HD2
  )
       ( resid 97 and name HB1
  ) 2.9 1.1 0.6 volume=1.675 peak=22 ppm1=7.103 ppm2=2.662

assign ( resid 75 and name HN
  )
       ( resid 72 and name HA
  ) 3.4 1.6 0.7 volume=0.731 peak=723 ppm1=7.049 ppm2=3.152

assign ( resid 101 and name HA2
  )
       ( resid 99 and name HG2#
  ) 3.9 2.1 0.8 volume=0.304 peak=2058 ppm1=3.654 ppm2=1.093

assign ( resid 77 and name HG
  )
       ( resid 77 and name HA
  ) 3.3 1.5 0.7 volume=0.790 peak=1315 ppm1=1.555 ppm2=3.903

assign ( resid 87 and name HB2
  or resid 87 and name HB1
  )
       ( resid 87 and name HG2
  ) 2.6 0.8 0.5 volume=3.133 peak=2361 ppm1=1.358 ppm2=1.216

assign ( resid 81 and name HN
  )
       ( resid 81 and name HB2
  ) 2.8 1.0 0.6 volume=2.327 peak=808 ppm1=7.628 ppm2=1.498

assign ( resid 107 and name HG2
  )
       ( resid 107 and name HN
  ) 3.6 1.8 0.7 volume=0.527 peak=1917 ppm1=2.702 ppm2=8.030

assign ( resid 84 and name HN
  )
       ( resid 84 and name HA2
  or resid 84 and name HA1
  ) 3.3 1.5 0.7 volume=0.797 peak=242 ppm1=8.218 ppm2=3.848

assign ( resid 75 and name HB1
  )
       ( resid 75 and name HB2
  ) 3.3 1.5 0.7 volume=0.779 peak=1246 ppm1=1.854 ppm2=1.248

assign ( resid 97 and name HN
  )
       ( resid 88 and name HN
  ) 3.4 1.6 0.7 volume=0.739 peak=2343 ppm1=8.694 ppm2=8.323

assign ( resid 80 and name HN
  )
       ( resid 77 and name HA
  ) 2.8 1.0 0.6 volume=2.044 peak=789 ppm1=7.091 ppm2=3.904

assign ( resid 107 and name HN
  )
       ( resid 106 and name HA
  ) 3.4 1.6 0.7 volume=0.689 peak=257 ppm1=8.026 ppm2=4.066

assign ( resid 97 and name HD1 or resid 97 and name HD2
  )
       ( resid 102 and name HB1
  ) 3.0 1.2 0.6 volume=1.336 peak=5 ppm1=7.102 ppm2=2.805

assign ( resid 88 and name HB1
  )
       ( resid 97 and name HN
  ) 4.3 2.5 0.9 volume=0.169 peak=1792 ppm1=2.644 ppm2=8.693

assign ( resid 74 and name HD1#
  )
       ( resid 74 and name HG
  ) 2.8 1.0 0.6 volume=2.446 peak=1660 ppm1=1.042 ppm2=1.549

assign ( resid 75 and name HB1
  )
       ( resid 75 and name HD1#
  ) 3.2 1.4 0.6 volume=1.040 peak=1236 ppm1=1.855 ppm2=0.892

assign ( resid 107 and name HE21
  )
       ( resid 107 and name HN
  ) 4.1 2.3 0.8 volume=0.225 peak=676 ppm1=7.493 ppm2=8.031

assign ( resid 96 and name HD1#
  )
       ( resid 89 and name HD2
  ) 3.1 1.3 0.6 volume=1.165 peak=966 ppm1=0.563 ppm2=2.929

assign ( resid 108 and name HN
  )
       ( resid 107 and name HB1
  ) 3.3 1.5 0.7 volume=0.820 peak=133 ppm1=6.922 ppm2=2.074

assign ( resid 72 and name HD1#
  )
       ( resid 60 and name HD1 or resid 60 and name HD2
  ) 3.2 1.4 0.6 volume=0.972 peak=1010 ppm1=0.550 ppm2=6.827

assign ( resid 81 and name HN
  )
       ( resid 81 and name HB1
  ) 2.7 0.9 0.5 volume=2.637 peak=226 ppm1=7.626 ppm2=1.386

assign ( resid 88 and name HA
  )
       ( resid 89 and name HN
  ) 4.4 2.6 0.9 volume=0.149 peak=1322 ppm1=4.442 ppm2=8.390

assign ( resid 97 and name HE1 or resid 97 and name HE2
  )
       ( resid 95 and name HD2
  ) 3.3 1.5 0.7 volume=0.881 peak=13 ppm1=6.681 ppm2=1.404

assign ( resid 103 and name HA
  )
       ( resid 97 and name HB2
  ) 3.5 1.7 0.7 volume=0.561 peak=876 ppm1=3.033 ppm2=3.127

assign ( resid 93 and name HN
  )
       ( resid 90 and name HB1
  ) 2.9 1.1 0.6 volume=1.749 peak=130 ppm1=7.744 ppm2=3.268

assign ( resid 91 and name HG2
  )
       ( resid 91 and name HA
  ) 3.3 1.5 0.7 volume=0.770 peak=2117 ppm1=2.219 ppm2=4.002

assign ( resid 110 and name HN
  )
       ( resid 109 and name HG1#
  ) 3.2 1.4 0.6 volume=0.948 peak=240 ppm1=7.118 ppm2=0.308

assign ( resid 79 and name HA
  )
       ( resid 82 and name HB1
  ) 4.1 2.3 0.8 volume=0.220 peak=1944 ppm1=3.476 ppm2=3.013

assign ( resid 75 and name HD1#
  )
       ( resid 75 and name HA
  ) 3.2 1.4 0.6 volume=0.991 peak=1629 ppm1=0.890 ppm2=3.459

assign ( resid 106 and name HB1
  )
       ( resid 103 and name HA
  ) 4.1 2.3 0.8 volume=0.225 peak=1408 ppm1=2.582 ppm2=3.033

assign ( resid 64 and name HN
  )
       ( resid 63 and name HG2
  or resid 63 and name HG1
  ) 3.6 1.8 0.7 volume=0.457 peak=685 ppm1=8.555 ppm2=2.260

assign ( resid 107 and name HB1
  )
       ( resid 107 and name HG2
  ) 3.2 1.4 0.6 volume=1.029 peak=877 ppm1=2.050 ppm2=2.694

assign ( resid 106 and name HD2
  )
       ( resid 107 and name HA
  ) 3.0 1.2 0.6 volume=1.343 peak=82 ppm1=6.687 ppm2=3.454

assign ( resid 105 and name HD2
  or resid 105 and name HD1
  )
       ( resid 105 and name HA
  ) 3.8 2.0 0.8 volume=0.371 peak=1475 ppm1=3.052 ppm2=3.845

assign ( resid 75 and name HD2#
  )
       ( resid 60 and name HB2
  ) 3.2 1.4 0.6 volume=0.938 peak=2053 ppm1=0.847 ppm2=2.621

assign ( resid 71 and name HB2
  )
       ( resid 74 and name HN
  ) 4.3 2.5 0.9 volume=0.172 peak=1350 ppm1=1.646 ppm2=6.397

assign ( resid 96 and name HB1
  )
       ( resid 97 and name HN
  ) 4.3 2.5 0.9 volume=0.171 peak=1933 ppm1=1.320 ppm2=8.691

assign ( resid 95 and name HG1
  )
       ( resid 95 and name HA
  ) 3.4 1.6 0.7 volume=0.726 peak=1962 ppm1=1.025 ppm2=3.844

assign ( resid 95 and name HB2
  )
       ( resid 96 and name HN
  ) 3.5 1.7 0.7 volume=0.578 peak=1446 ppm1=1.185 ppm2=7.584

assign ( resid 72 and name HB
  )
       ( resid 60 and name HE1 or resid 60 and name HE2
  ) 4.0 2.2 0.8 volume=0.270 peak=1014 ppm1=0.876 ppm2=6.758

assign ( resid 75 and name HN
  )
       ( resid 72 and name HD1#
  ) 4.0 2.2 0.8 volume=0.264 peak=763 ppm1=7.049 ppm2=0.560

assign ( resid 89 and name HB1
  )
       ( resid 96 and name HD1#
  ) 3.4 1.6 0.7 volume=0.655 peak=892 ppm1=1.604 ppm2=0.565

assign ( resid 104 and name HG2
  )
       ( resid 104 and name HB1
  or resid 104 and name HB2
  ) 2.5 0.7 0.5 volume=4.393 peak=1734 ppm1=1.345 ppm2=1.676

assign ( resid 90 and name HN
  )
       ( resid 96 and name HD1#
  ) 3.4 1.6 0.7 volume=0.749 peak=313 ppm1=9.128 ppm2=0.562

assign ( resid 87 and name HG1
  )
       ( resid 87 and name HD2
  ) 3.2 1.4 0.6 volume=1.063 peak=2341 ppm1=1.128 ppm2=2.846

assign ( resid 109 and name HG1#
  )
       ( resid 109 and name HB
  ) 2.6 0.8 0.5 volume=3.564 peak=2103 ppm1=0.308 ppm2=1.782

assign ( resid 103 and name HN
  )
       ( resid 101 and name HA1
  ) 3.7 1.9 0.7 volume=0.440 peak=773 ppm1=7.215 ppm2=3.546

assign ( resid 72 and name HN
  )
       ( resid 71 and name HA
  ) 3.1 1.3 0.6 volume=1.266 peak=137 ppm1=8.437 ppm2=4.863

assign ( resid 109 and name HG2#
  )
       ( resid 112 and name HA1
  or resid 112 and name HA2
  ) 4.5 2.7 0.9 volume=0.129 peak=1742 ppm1=0.485 ppm2=3.623

assign ( resid 103 and name HN
  )
       ( resid 97 and name HB1
  ) 2.9 1.1 0.6 volume=1.726 peak=835 ppm1=7.217 ppm2=2.680

assign ( resid 100 and name HA
  )
       ( resid 88 and name HB1
  ) 4.0 2.2 0.8 volume=0.247 peak=2381 ppm1=3.215 ppm2=2.643

assign ( resid 91 and name HA
  )
       ( resid 91 and name HB1
  ) 2.6 0.8 0.5 volume=3.215 peak=1635 ppm1=3.998 ppm2=1.891

assign ( resid 85 and name HB1
  )
       ( resid 85 and name HA
  ) 3.3 1.5 0.7 volume=0.901 peak=2221 ppm1=1.866 ppm2=4.086

assign ( resid 93 and name HN
  )
       ( resid 92 and name HA
  ) 3.2 1.4 0.6 volume=1.034 peak=144 ppm1=7.743 ppm2=4.356

assign ( resid 97 and name HB1
  )
       ( resid 103 and name HD2#
  ) 4.1 2.3 0.8 volume=0.220 peak=910 ppm1=2.666 ppm2=0.865

assign ( resid 78 and name HB1
  )
       ( resid 78 and name HB2
  ) 3.6 1.8 0.7 volume=0.536 peak=1470 ppm1=2.854 ppm2=3.201

assign ( resid 80 and name HN
  )
       ( resid 77 and name HN
  ) 3.7 1.9 0.7 volume=0.419 peak=444 ppm1=7.089 ppm2=7.291

assign ( resid 87 and name HN
  )
       ( resid 96 and name HD1#
  ) 4.1 2.3 0.8 volume=0.216 peak=400 ppm1=7.712 ppm2=0.586

assign ( resid 97 and name HE1 or resid 97 and name HE2
  )
       ( resid 95 and name HB2
  ) 3.3 1.5 0.7 volume=0.882 peak=80 ppm1=6.680 ppm2=1.176

assign ( resid 72 and name HN
  )
       ( resid 72 and name HG2#
  ) 3.2 1.4 0.6 volume=0.935 peak=746 ppm1=8.439 ppm2=0.605

assign ( resid 108 and name HN
  )
       ( resid 108 and name HB2
  ) 2.9 1.1 0.6 volume=1.902 peak=830 ppm1=6.918 ppm2=1.362

assign ( resid 71 and name HB1
  )
       ( resid 71 and name HN
  ) 4.7 2.9 0.9 volume=0.103 peak=1690 ppm1=1.344 ppm2=6.742

assign ( resid 103 and name HD1#
  )
       ( resid 103 and name HB2
  ) 3.1 1.3 0.6 volume=1.166 peak=1201 ppm1=0.808 ppm2=1.820

assign ( resid 103 and name HA
  )
       ( resid 106 and name HN
  ) 3.7 1.9 0.7 volume=0.411 peak=1688 ppm1=3.029 ppm2=7.305

assign ( resid 99 and name HG2#
  )
       ( resid 102 and name HB1
  ) 3.6 1.8 0.7 volume=0.469 peak=1722 ppm1=1.076 ppm2=2.807

assign ( resid 103 and name HA
  )
       ( resid 106 and name HB2
  ) 3.4 1.6 0.7 volume=0.757 peak=1062 ppm1=3.029 ppm2=2.823

assign ( resid 106 and name HD2
  )
       ( resid 97 and name HZ
  ) 3.0 1.2 0.6 volume=1.444 peak=29 ppm1=6.681 ppm2=5.906

assign ( resid 81 and name HN
  )
       ( resid 79 and name HN
  ) 4.0 2.2 0.8 volume=0.264 peak=565 ppm1=7.622 ppm2=8.402

assign ( resid 110 and name HN
  )
       ( resid 107 and name HN
  ) 3.9 2.1 0.8 volume=0.293 peak=343 ppm1=7.119 ppm2=8.026

assign ( resid 75 and name HB2
  )
       ( resid 75 and name HA
  ) 4.3 2.5 0.9 volume=0.164 peak=1794 ppm1=1.245 ppm2=3.467

assign ( resid 85 and name HG2
  )
       ( resid 85 and name HG1
  ) 1.9 0.1 0.4 volume=22.752 peak=918 ppm1=2.080 ppm2=2.131

assign ( resid 74 and name HN
  )
       ( resid 71 and name HD2#
  ) 3.2 1.4 0.6 volume=1.030 peak=185 ppm1=6.393 ppm2=0.854

assign ( resid 60 and name HB2
  )
       ( resid 69 and name HB2
  ) 3.7 1.9 0.7 volume=0.434 peak=891 ppm1=2.628 ppm2=3.070

assign ( resid 78 and name HD2
  )
       ( resid 62 and name HB2
  ) 3.1 1.3 0.6 volume=1.153 peak=65 ppm1=6.723 ppm2=2.666

assign ( resid 108 and name HD1#
  )
       ( resid 107 and name HG2
  ) 3.7 1.9 0.7 volume=0.451 peak=1746 ppm1=0.706 ppm2=2.680

assign ( resid 106 and name HD2
  )
       ( resid 106 and name HB1
  ) 3.1 1.3 0.6 volume=1.241 peak=93 ppm1=6.685 ppm2=2.586

assign ( resid 104 and name HN
  )
       ( resid 101 and name HA1
  ) 3.4 1.6 0.7 volume=0.705 peak=382 ppm1=8.130 ppm2=3.573

assign ( resid 91 and name HB2
  )
       ( resid 91 and name HB1
  ) 2.2 0.4 0.4 volume=9.387 peak=1995 ppm1=1.995 ppm2=1.892

assign ( resid 103 and name HB2
  )
       ( resid 103 and name HB1
  ) 3.1 1.3 0.6 volume=1.194 peak=1143 ppm1=1.821 ppm2=1.135

assign ( resid 107 and name HE22
  )
       ( resid 91 and name HN
  ) 4.4 2.6 0.9 volume=0.155 peak=515 ppm1=6.925 ppm2=9.387

assign ( resid 107 and name HE22
  )
       ( resid 107 and name HG2
  ) 3.3 1.5 0.7 volume=0.772 peak=568 ppm1=6.928 ppm2=2.701

assign ( resid 69 and name HB1
  )
       ( resid 74 and name HD1#
  ) 4.5 2.7 0.9 volume=0.121 peak=1879 ppm1=2.506 ppm2=1.035

assign ( resid 104 and name HG2
  )
       ( resid 104 and name HE2
  or resid 104 and name HE1
  ) 2.9 1.1 0.6 volume=1.873 peak=1247 ppm1=1.344 ppm2=2.781

assign ( resid 89 and name HD1
  )
       ( resid 96 and name HD1#
  ) 3.4 1.6 0.7 volume=0.737 peak=1187 ppm1=2.960 ppm2=0.565

assign ( resid 71 and name HA
  )
       ( resid 71 and name HN
  ) 4.5 2.7 0.9 volume=0.127 peak=981 ppm1=4.878 ppm2=6.764

assign ( resid 112 and name HA1
  )
       ( resid 108 and name HD1#
  ) 4.1 2.3 0.8 volume=0.225 peak=907 ppm1=3.645 ppm2=0.712

assign ( resid 102 and name HB1
  )
       ( resid 102 and name HD21
  ) 3.7 1.9 0.7 volume=0.432 peak=1483 ppm1=2.826 ppm2=6.812

assign ( resid 103 and name HB1
  )
       ( resid 103 and name HB2
  ) 3.3 1.5 0.7 volume=0.895 peak=1280 ppm1=1.133 ppm2=1.823

assign ( resid 87 and name HD2
  )
       ( resid 87 and name HA
  ) 4.2 2.4 0.8 volume=0.202 peak=2309 ppm1=2.850 ppm2=4.184

assign ( resid 92 and name HN
  )
       ( resid 91 and name HG2
  ) 3.2 1.4 0.6 volume=0.995 peak=759 ppm1=8.369 ppm2=2.223

assign ( resid 108 and name HD2#
  )
       ( resid 105 and name HD2
  or resid 105 and name HD1
  ) 3.9 2.1 0.8 volume=0.288 peak=1675 ppm1=0.799 ppm2=3.068

assign ( resid 103 and name HD2#
  )
       ( resid 100 and name HN
  ) 3.8 2.0 0.8 volume=0.364 peak=1704 ppm1=0.878 ppm2=8.333

assign ( resid 97 and name HN
  )
       ( resid 97 and name HB1
  ) 3.0 1.2 0.6 volume=1.586 peak=152 ppm1=8.699 ppm2=2.681

assign ( resid 105 and name HB2
  or resid 105 and name HB1
  )
       ( resid 105 and name HN
  ) 2.8 1.0 0.6 volume=2.167 peak=2161 ppm1=1.669 ppm2=7.549

assign ( resid 74 and name HN
  )
       ( resid 73 and name HA
  ) 3.2 1.4 0.6 volume=1.019 peak=469 ppm1=6.393 ppm2=3.906

assign ( resid 100 and name HB1
  )
       ( resid 88 and name HE1 or resid 88 and name HE2
  ) 4.1 2.3 0.8 volume=0.231 peak=1979 ppm1=3.372 ppm2=6.667

assign ( resid 77 and name HB1
  )
       ( resid 77 and name HD1#
  ) 2.7 0.9 0.5 volume=2.805 peak=2007 ppm1=1.430 ppm2=0.710

assign ( resid 100 and name HB2
  )
       ( resid 100 and name HA
  ) 3.2 1.4 0.6 volume=0.992 peak=1597 ppm1=3.530 ppm2=3.218

assign ( resid 69 and name HE1 or resid 69 and name HE2
  )
       ( resid 75 and name HD1#
  ) 3.0 1.2 0.6 volume=1.395 peak=72 ppm1=6.137 ppm2=0.889

assign ( resid 85 and name HN
  )
       ( resid 83 and name HA
  ) 3.7 1.9 0.7 volume=0.449 peak=396 ppm1=7.941 ppm2=4.289

assign ( resid 69 and name HB2
  )
       ( resid 69 and name HN
  ) 4.3 2.5 0.9 volume=0.165 peak=1108 ppm1=3.067 ppm2=8.413

assign ( resid 85 and name HG1
  )
       ( resid 87 and name HG1
  ) 3.9 2.1 0.8 volume=0.286 peak=2331 ppm1=2.127 ppm2=1.142

assign ( resid 77 and name HN
  )
       ( resid 80 and name HN
  ) 3.9 2.1 0.8 volume=0.289 peak=627 ppm1=7.295 ppm2=7.091

assign ( resid 74 and name HN
  )
       ( resid 74 and name HD2#
  ) 3.0 1.2 0.6 volume=1.498 peak=607 ppm1=6.393 ppm2=0.776

assign ( resid 77 and name HB2
  )
       ( resid 77 and name HB1
  ) 2.7 0.9 0.5 volume=2.907 peak=1883 ppm1=1.555 ppm2=1.426

assign ( resid 74 and name HN
  )
       ( resid 69 and name HB1
  ) 4.2 2.4 0.8 volume=0.210 peak=216 ppm1=6.395 ppm2=2.550

assign ( resid 74 and name HN
  )
       ( resid 71 and name HA
  ) 4.2 2.4 0.8 volume=0.185 peak=238 ppm1=6.386 ppm2=4.864

assign ( resid 75 and name HD1#
  )
       ( resid 62 and name HB2
  ) 3.4 1.6 0.7 volume=0.752 peak=1379 ppm1=0.890 ppm2=2.663

assign ( resid 95 and name HG2
  )
       ( resid 95 and name HE2
  or resid 95 and name HE1
  ) 3.1 1.3 0.6 volume=1.188 peak=1420 ppm1=1.420 ppm2=2.821

assign ( resid 89 and name HN
  )
       ( resid 88 and name HB2
  ) 3.3 1.5 0.7 volume=0.771 peak=432 ppm1=8.393 ppm2=2.752

assign ( resid 74 and name HN
  )
       ( resid 75 and name HN
  ) 3.2 1.4 0.6 volume=0.991 peak=253 ppm1=6.395 ppm2=7.053

assign ( resid 64 and name HG1
  )
       ( resid 64 and name HG2
  ) 2.7 0.9 0.5 volume=2.693 peak=1511 ppm1=1.604 ppm2=1.759

assign ( resid 95 and name HB2
  )
       ( resid 95 and name HG2
  ) 2.6 0.8 0.5 volume=3.575 peak=1230 ppm1=1.194 ppm2=1.405

assign ( resid 71 and name HB1
  )
       ( resid 74 and name HN
  ) 4.4 2.6 0.9 volume=0.147 peak=1023 ppm1=1.346 ppm2=6.402

assign ( resid 82 and name HN
  )
       ( resid 81 and name HB2
  ) 3.3 1.5 0.7 volume=0.910 peak=701 ppm1=7.139 ppm2=1.494

assign ( resid 74 and name HB2
  )
       ( resid 74 and name HD2#
  ) 3.5 1.7 0.7 volume=0.548 peak=1006 ppm1=1.752 ppm2=0.768

assign ( resid 74 and name HD2#
  )
       ( resid 74 and name HA
  ) 2.9 1.1 0.6 volume=1.777 peak=1027 ppm1=0.764 ppm2=3.928

assign ( resid 84 and name HA2
  or resid 84 and name HA1
  )
       ( resid 85 and name HB2
  or resid 85 and name HB1
  ) 3.9 2.1 0.8 volume=0.310 peak=1354 ppm1=3.854 ppm2=1.818

assign ( resid 104 and name HG2
  )
       ( resid 104 and name HG1
  ) 2.0 0.2 0.4 volume=16.867 peak=1072 ppm1=1.344 ppm2=1.266

assign ( resid 108 and name HB1
  )
       ( resid 108 and name HD1#
  ) 3.0 1.2 0.6 volume=1.517 peak=916 ppm1=1.587 ppm2=0.723

assign ( resid 102 and name HA
  )
       ( resid 105 and name HN
  ) 4.5 2.7 0.9 volume=0.124 peak=2085 ppm1=4.335 ppm2=7.548

assign ( resid 64 and name HN
  )
       ( resid 62 and name HB2
  ) 3.7 1.9 0.7 volume=0.415 peak=298 ppm1=8.550 ppm2=2.673

assign ( resid 81 and name HN
  )
       ( resid 78 and name HA
  ) 2.8 1.0 0.6 volume=2.159 peak=269 ppm1=7.627 ppm2=3.979

assign ( resid 102 and name HA
  )
       ( resid 102 and name HB2
  ) 3.8 2.0 0.8 volume=0.366 peak=2246 ppm1=4.334 ppm2=2.722

assign ( resid 64 and name HB2
  )
       ( resid 64 and name HA
  ) 3.8 2.0 0.8 volume=0.333 peak=1091 ppm1=1.388 ppm2=4.112

assign ( resid 77 and name HA
  )
       ( resid 77 and name HD2#
  ) 2.7 0.9 0.5 volume=2.994 peak=976 ppm1=3.907 ppm2=0.742

assign ( resid 86 and name HN
  )
       ( resid 85 and name HG2
  ) 3.7 1.9 0.7 volume=0.421 peak=126 ppm1=8.201 ppm2=2.090

assign ( resid 75 and name HB2
  )
       ( resid 75 and name HD1#
  ) 3.4 1.6 0.7 volume=0.672 peak=1208 ppm1=1.249 ppm2=0.890

assign ( resid 110 and name HN
  )
       ( resid 108 and name HN
  ) 3.5 1.7 0.7 volume=0.571 peak=503 ppm1=7.119 ppm2=6.946

assign ( resid 60 and name HN
  )
       ( resid 60 and name HB1
  ) 3.5 1.7 0.7 volume=0.616 peak=710 ppm1=7.710 ppm2=2.840

assign ( resid 79 and name HN
  )
       ( resid 78 and name HN
  ) 3.2 1.4 0.6 volume=0.996 peak=798 ppm1=8.415 ppm2=7.441

assign ( resid 97 and name HN
  )
       ( resid 90 and name HN
  ) 4.0 2.2 0.8 volume=0.255 peak=142 ppm1=8.697 ppm2=9.130

assign ( resid 96 and name HD1#
  )
       ( resid 89 and name HB1
  ) 3.1 1.3 0.6 volume=1.225 peak=1712 ppm1=0.562 ppm2=1.602

assign ( resid 89 and name HB1
  )
       ( resid 89 and name HD1
  ) 3.4 1.6 0.7 volume=0.657 peak=973 ppm1=1.607 ppm2=2.960

assign ( resid 107 and name HN
  )
       ( resid 105 and name HN
  ) 3.6 1.8 0.7 volume=0.506 peak=258 ppm1=8.027 ppm2=7.517

assign ( resid 88 and name HA
  )
       ( resid 88 and name HN
  ) 4.5 2.7 0.9 volume=0.137 peak=2316 ppm1=4.444 ppm2=8.319

assign ( resid 96 and name HB2
  )
       ( resid 96 and name HN
  ) 3.4 1.6 0.7 volume=0.643 peak=1237 ppm1=1.056 ppm2=7.583

assign ( resid 69 and name HN
  )
       ( resid 69 and name HB1
  ) 3.1 1.3 0.6 volume=1.116 peak=728 ppm1=8.412 ppm2=2.541

assign ( resid 93 and name HB1
  )
       ( resid 93 and name HA
  ) 3.2 1.4 0.6 volume=0.916 peak=1928 ppm1=3.281 ppm2=4.998

assign ( resid 78 and name HB1
  )
       ( resid 75 and name HD2#
  or resid 75 and name HD1#
  ) 3.7 1.9 0.7 volume=0.401 peak=2099 ppm1=2.862 ppm2=0.870

assign ( resid 88 and name HE1 or resid 88 and name HE2
  )
       ( resid 100 and name HB1
  ) 3.4 1.6 0.7 volume=0.727 peak=18 ppm1=6.667 ppm2=3.367

assign ( resid 88 and name HB2
  )
       ( resid 97 and name HN
  ) 4.3 2.5 0.9 volume=0.176 peak=2198 ppm1=2.747 ppm2=8.689

assign ( resid 74 and name HD2#
  )
       ( resid 69 and name HE1 or resid 69 and name HE2
  ) 4.5 2.7 0.9 volume=0.133 peak=1209 ppm1=0.763 ppm2=6.126

assign ( resid 104 and name HD1
  or resid 104 and name HD2
  )
       ( resid 104 and name HG1
  ) 2.1 0.3 0.4 volume=13.030 peak=1737 ppm1=1.487 ppm2=1.269

assign ( resid 107 and name HG1
  )
       ( resid 103 and name HD1#
  ) 3.3 1.5 0.7 volume=0.829 peak=2214 ppm1=2.642 ppm2=0.818

assign ( resid 109 and name HG2#
  )
       ( resid 109 and name HN
  ) 2.8 1.0 0.6 volume=2.209 peak=1939 ppm1=0.487 ppm2=7.819

assign ( resid 108 and name HN
  )
       ( resid 110 and name HN
  ) 3.2 1.4 0.6 volume=0.946 peak=237 ppm1=6.917 ppm2=7.094

assign ( resid 76 and name HB2
  or resid 76 and name HB1
  )
       ( resid 73 and name HA
  ) 3.8 2.0 0.8 volume=0.363 peak=2131 ppm1=2.574 ppm2=3.899

assign ( resid 96 and name HA
  )
       ( resid 96 and name HD1#
  ) 4.6 2.8 0.9 volume=0.108 peak=1968 ppm1=4.759 ppm2=0.569

assign ( resid 89 and name HG1
  or resid 89 and name HG2
  )
       ( resid 89 and name HB1
  ) 3.0 1.2 0.6 volume=1.619 peak=1534 ppm1=1.097 ppm2=1.604

assign ( resid 108 and name HD2#
  )
       ( resid 108 and name HA
  ) 3.6 1.8 0.7 volume=0.514 peak=1482 ppm1=0.799 ppm2=3.955

assign ( resid 97 and name HB1
  )
       ( resid 97 and name HN
  ) 4.2 2.4 0.8 volume=0.208 peak=1669 ppm1=2.664 ppm2=8.701

assign ( resid 105 and name HD2
  or resid 105 and name HD1
  )
       ( resid 105 and name HB2
  or resid 105 and name HB1
  ) 2.5 0.7 0.5 volume=4.515 peak=1963 ppm1=3.053 ppm2=1.659

assign ( resid 107 and name HE22
  )
       ( resid 107 and name HE21
  ) 2.2 0.4 0.4 volume=8.471 peak=423 ppm1=6.929 ppm2=7.496

assign ( resid 82 and name HN
  )
       ( resid 82 and name HA
  ) 2.9 1.1 0.6 volume=1.664 peak=530 ppm1=7.141 ppm2=4.682

assign ( resid 75 and name HB2
  )
       ( resid 76 and name HN
  ) 4.4 2.6 0.9 volume=0.143 peak=1610 ppm1=1.242 ppm2=8.448

assign ( resid 88 and name HD1 or resid 88 and name HD2
  )
       ( resid 88 and name HB2
  ) 2.7 0.9 0.5 volume=2.940 peak=2355 ppm1=6.811 ppm2=2.757

assign ( resid 85 and name HG2
  )
       ( resid 85 and name HN
  ) 4.0 2.2 0.8 volume=0.269 peak=1358 ppm1=2.071 ppm2=7.940

assign ( resid 105 and name HB2
  or resid 105 and name HB1
  )
       ( resid 105 and name HD2
  or resid 105 and name HD1
  ) 2.9 1.1 0.6 volume=1.836 peak=2256 ppm1=1.669 ppm2=3.046

assign ( resid 72 and name HD1#
  )
       ( resid 72 and name HN
  ) 3.8 2.0 0.8 volume=0.383 peak=1744 ppm1=0.552 ppm2=8.446

assign ( resid 95 and name HG2
  )
       ( resid 95 and name HB2
  ) 2.3 0.5 0.5 volume=6.901 peak=963 ppm1=1.408 ppm2=1.193

assign ( resid 72 and name HN
  )
       ( resid 71 and name HB2
  ) 3.6 1.8 0.7 volume=0.470 peak=833 ppm1=8.440 ppm2=1.647

assign ( resid 102 and name HB1
  )
       ( resid 97 and name HD1 or resid 97 and name HD2
  ) 3.4 1.6 0.7 volume=0.719 peak=1934 ppm1=2.814 ppm2=7.107

assign ( resid 79 and name HN
  )
       ( resid 79 and name HB2
  or resid 79 and name HB1
  ) 2.6 0.8 0.5 volume=3.101 peak=182 ppm1=8.418 ppm2=1.833

assign ( resid 77 and name HB1
  )
       ( resid 77 and name HA
  ) 3.4 1.6 0.7 volume=0.653 peak=2143 ppm1=1.429 ppm2=3.903

assign ( resid 105 and name HG1
  )
       ( resid 105 and name HA
  ) 3.2 1.4 0.6 volume=1.010 peak=1588 ppm1=1.444 ppm2=3.844

assign ( resid 111 and name HN
  )
       ( resid 110 and name HB1
  ) 3.7 1.9 0.7 volume=0.390 peak=649 ppm1=7.583 ppm2=3.147

assign ( resid 88 and name HD1 or resid 88 and name HD2
  )
       ( resid 88 and name HN
  ) 2.8 1.0 0.6 volume=2.083 peak=2321 ppm1=6.810 ppm2=8.312

assign ( resid 84 and name HN
  )
       ( resid 83 and name HA
  ) 4.0 2.2 0.8 volume=0.279 peak=624 ppm1=8.214 ppm2=4.300

assign ( resid 73 and name HN
  )
       ( resid 72 and name HG12
  ) 3.8 2.0 0.8 volume=0.339 peak=165 ppm1=7.961 ppm2=0.802

assign ( resid 69 and name HE1 or resid 69 and name HE2
  )
       ( resid 78 and name HB2
  ) 3.6 1.8 0.7 volume=0.476 peak=81 ppm1=6.141 ppm2=3.191

assign ( resid 78 and name HN
  )
       ( resid 76 and name HA
  ) 3.8 2.0 0.8 volume=0.357 peak=742 ppm1=7.441 ppm2=4.171

assign ( resid 77 and name HB1
  )
       ( resid 77 and name HB2
  ) 2.5 0.7 0.5 volume=4.421 peak=1813 ppm1=1.433 ppm2=1.551

assign ( resid 88 and name HB1
  )
       ( resid 103 and name HB1
  ) 3.8 2.0 0.8 volume=0.350 peak=2354 ppm1=2.641 ppm2=1.135

assign ( resid 59 and name HD1
  )
       ( resid 59 and name HG2
  ) 3.3 1.5 0.7 volume=0.830 peak=2192 ppm1=3.400 ppm2=1.571

assign ( resid 71 and name HD1#
  )
       ( resid 71 and name HD2#
  ) 2.3 0.5 0.5 volume=7.041 peak=2262 ppm1=0.917 ppm2=0.811

assign ( resid 85 and name HG2
  )
       ( resid 87 and name HG1
  ) 3.9 2.1 0.8 volume=0.289 peak=2390 ppm1=2.075 ppm2=1.141

assign ( resid 59 and name HB2
  )
       ( resid 59 and name HG2
  ) 3.3 1.5 0.7 volume=0.761 peak=2240 ppm1=0.974 ppm2=1.561

assign ( resid 95 and name HA
  )
       ( resid 95 and name HE2
  or resid 95 and name HE1
  ) 3.9 2.1 0.8 volume=0.291 peak=1502 ppm1=3.845 ppm2=2.816

assign ( resid 64 and name HN
  )
       ( resid 65 and name HA
  ) 4.2 2.4 0.8 volume=0.198 peak=466 ppm1=8.553 ppm2=4.980

assign ( resid 100 and name HA
  )
       ( resid 88 and name HB2
  ) 4.2 2.4 0.8 volume=0.208 peak=2347 ppm1=3.211 ppm2=2.748

assign ( resid 97 and name HB2
  )
       ( resid 103 and name HD2#
  ) 3.9 2.1 0.8 volume=0.305 peak=964 ppm1=3.120 ppm2=0.859

assign ( resid 74 and name HB1
  )
       ( resid 74 and name HD2#
  ) 3.1 1.3 0.6 volume=1.171 peak=1594 ppm1=1.291 ppm2=0.757

assign ( resid 74 and name HD2#
  )
       ( resid 77 and name HN
  ) 3.9 2.1 0.8 volume=0.286 peak=2177 ppm1=0.763 ppm2=7.294

assign ( resid 91 and name HB1
  )
       ( resid 91 and name HA
  ) 3.0 1.2 0.6 volume=1.338 peak=1909 ppm1=1.890 ppm2=4.000

assign ( resid 71 and name HN
  )
       ( resid 69 and name HB1
  ) 3.6 1.8 0.7 volume=0.503 peak=517 ppm1=6.743 ppm2=2.532

assign ( resid 89 and name HN
  )
       ( resid 97 and name HN
  ) 4.1 2.3 0.8 volume=0.237 peak=569 ppm1=8.398 ppm2=8.705

assign ( resid 105 and name HN
  )
       ( resid 101 and name HA1
  or resid 101 and name HA2
  ) 3.6 1.8 0.7 volume=0.508 peak=605 ppm1=7.548 ppm2=3.666

assign ( resid 86 and name HN
  )
       ( resid 80 and name HG1
  ) 4.3 2.5 0.9 volume=0.160 peak=235 ppm1=8.213 ppm2=1.349

assign ( resid 80 and name HB2
  or resid 80 and name HB1
  )
       ( resid 80 and name HE2
  or resid 80 and name HE1
  ) 3.6 1.8 0.7 volume=0.472 peak=982 ppm1=1.717 ppm2=2.818

assign ( resid 106 and name HB1
  )
       ( resid 97 and name HZ
  ) 4.2 2.4 0.8 volume=0.204 peak=900 ppm1=2.582 ppm2=5.914

assign ( resid 96 and name HD2#
  )
       ( resid 97 and name HN
  ) 4.2 2.4 0.8 volume=0.206 peak=1166 ppm1=0.682 ppm2=8.701

assign ( resid 104 and name HA
  )
       ( resid 104 and name HG2
  ) 2.9 1.1 0.6 volume=1.872 peak=1652 ppm1=3.915 ppm2=1.343

assign ( resid 105 and name HG2
  )
       ( resid 105 and name HD2
  or resid 105 and name HD1
  ) 2.8 1.0 0.6 volume=2.366 peak=1606 ppm1=1.574 ppm2=3.047

assign ( resid 90 and name HB1
  )
       ( resid 95 and name HN
  ) 3.3 1.5 0.7 volume=0.909 peak=2042 ppm1=3.260 ppm2=7.736

assign ( resid 79 and name HA
  )
       ( resid 80 and name HN
  ) 3.9 2.1 0.8 volume=0.322 peak=1755 ppm1=3.476 ppm2=7.093

assign ( resid 74 and name HD1#
  )
       ( resid 74 and name HA
  ) 3.7 1.9 0.7 volume=0.392 peak=1878 ppm1=1.036 ppm2=3.927

assign ( resid 102 and name HN
  )
       ( resid 105 and name HN
  ) 4.2 2.4 0.8 volume=0.183 peak=521 ppm1=7.851 ppm2=7.540

assign ( resid 81 and name HN
  )
       ( resid 80 and name HB2
  or resid 80 and name HB1
  ) 3.1 1.3 0.6 volume=1.313 peak=842 ppm1=7.624 ppm2=1.708

assign ( resid 80 and name HE2
  or resid 80 and name HE1
  )
       ( resid 80 and name HD1
  ) 2.1 0.3 0.4 volume=12.342 peak=2012 ppm1=2.822 ppm2=1.526

assign ( resid 62 and name HN
  )
       ( resid 75 and name HD1#
  ) 3.6 1.8 0.7 volume=0.507 peak=500 ppm1=8.873 ppm2=0.911

assign ( resid 112 and name HA1
  )
       ( resid 109 and name HA
  ) 2.8 1.0 0.6 volume=2.257 peak=2238 ppm1=3.647 ppm2=3.766

assign ( resid 78 and name HA
  )
       ( resid 78 and name HB2
  ) 3.4 1.6 0.7 volume=0.724 peak=1575 ppm1=3.992 ppm2=3.201

assign ( resid 80 and name HA
  )
       ( resid 80 and name HN
  ) 3.0 1.2 0.6 volume=1.396 peak=1599 ppm1=3.930 ppm2=7.097

assign ( resid 65 and name HN
  )
       ( resid 62 and name HB2
  ) 3.3 1.5 0.7 volume=0.858 peak=858 ppm1=7.852 ppm2=2.690

assign ( resid 104 and name HN
  )
       ( resid 103 and name HB1
  ) 3.2 1.4 0.6 volume=1.000 peak=241 ppm1=8.130 ppm2=1.144

assign ( resid 94 and name HN
  )
       ( resid 94 and name HA2
  ) 2.7 0.9 0.5 volume=2.772 peak=445 ppm1=8.294 ppm2=4.077

assign ( resid 71 and name HN
  )
       ( resid 71 and name HD2#
  ) 3.3 1.5 0.7 volume=0.823 peak=254 ppm1=6.742 ppm2=0.830

assign ( resid 76 and name HN
  )
       ( resid 74 and name HA
  ) 3.3 1.5 0.7 volume=0.798 peak=397 ppm1=8.458 ppm2=3.951

assign ( resid 96 and name HA
  )
       ( resid 97 and name HN
  ) 4.5 2.7 0.9 volume=0.135 peak=1993 ppm1=4.762 ppm2=8.701

assign ( resid 105 and name HB2
  or resid 105 and name HB1
  )
       ( resid 105 and name HG1
  ) 2.3 0.5 0.5 volume=6.462 peak=1657 ppm1=1.667 ppm2=1.456

assign ( resid 72 and name HA
  )
       ( resid 72 and name HG11
  ) 3.5 1.7 0.7 volume=0.627 peak=1231 ppm1=3.159 ppm2=0.714

assign ( resid 108 and name HN
  )
       ( resid 106 and name HN
  ) 4.0 2.2 0.8 volume=0.269 peak=670 ppm1=6.917 ppm2=7.310

assign ( resid 107 and name HN
  )
       ( resid 108 and name HD2#
  ) 3.2 1.4 0.6 volume=1.042 peak=160 ppm1=8.021 ppm2=0.813

assign ( resid 97 and name HE1 or resid 97 and name HE2
  )
       ( resid 106 and name HB1
  ) 3.1 1.3 0.6 volume=1.182 peak=41 ppm1=6.679 ppm2=2.612

assign ( resid 102 and name HB2
  )
       ( resid 99 and name HB
  ) 4.3 2.5 0.9 volume=0.177 peak=1044 ppm1=2.729 ppm2=4.302

assign ( resid 99 and name HG2#
  )
       ( resid 101 and name HN
  ) 3.8 2.0 0.8 volume=0.374 peak=1399 ppm1=1.083 ppm2=8.338

assign ( resid 103 and name HN
  )
       ( resid 101 and name HA1
  or resid 101 and name HA2
  ) 4.0 2.2 0.8 volume=0.280 peak=271 ppm1=7.216 ppm2=3.669

assign ( resid 96 and name HB2
  )
       ( resid 96 and name HD2#
  ) 3.2 1.4 0.6 volume=1.047 peak=1784 ppm1=1.054 ppm2=0.684

assign ( resid 102 and name HN
  )
       ( resid 99 and name HG2#
  ) 3.6 1.8 0.7 volume=0.473 peak=352 ppm1=7.859 ppm2=1.093

assign ( resid 109 and name HB
  )
       ( resid 110 and name HN
  ) 3.5 1.7 0.7 volume=0.619 peak=1092 ppm1=1.784 ppm2=7.112

assign ( resid 93 and name HN
  )
       ( resid 90 and name HN
  ) 4.0 2.2 0.8 volume=0.253 peak=127 ppm1=7.745 ppm2=9.122

assign ( resid 104 and name HG1
  )
       ( resid 104 and name HE2
  or resid 104 and name HE1
  ) 3.1 1.3 0.6 volume=1.311 peak=2113 ppm1=1.264 ppm2=2.779

assign ( resid 69 and name HN
  )
       ( resid 68 and name HB1
  ) 2.9 1.1 0.6 volume=1.905 peak=206 ppm1=8.410 ppm2=3.501

assign ( resid 68 and name HB2
  )
       ( resid 69 and name HN
  ) 3.9 2.1 0.8 volume=0.300 peak=1891 ppm1=3.341 ppm2=8.413

assign ( resid 102 and name HN
  )
       ( resid 103 and name HN
  ) 3.1 1.3 0.6 volume=1.233 peak=534 ppm1=7.855 ppm2=7.220

assign ( resid 100 and name HB1
  )
       ( resid 88 and name HD1 or resid 88 and name HD2
  ) 4.5 2.7 0.9 volume=0.129 peak=1643 ppm1=3.368 ppm2=6.807

assign ( resid 66 and name HN
  )
       ( resid 62 and name HB1
  ) 3.5 1.7 0.7 volume=0.577 peak=450 ppm1=8.126 ppm2=3.232

assign ( resid 86 and name HN
  )
       ( resid 85 and name HG1
  ) 3.9 2.1 0.8 volume=0.291 peak=634 ppm1=8.203 ppm2=2.145

assign ( resid 87 and name HB2
  or resid 87 and name HB1
  )
       ( resid 87 and name HA
  ) 3.6 1.8 0.7 volume=0.524 peak=2308 ppm1=1.359 ppm2=4.179

assign ( resid 77 and name HB1
  )
       ( resid 77 and name HN
  ) 3.4 1.6 0.7 volume=0.671 peak=1430 ppm1=1.432 ppm2=7.293

assign ( resid 61 and name HA2
  )
       ( resid 61 and name HA1
  ) 4.7 2.9 0.9 volume=0.100 peak=945 ppm1=3.420 ppm2=4.534

assign ( resid 109 and name HG1#
  )
       ( resid 108 and name HB2
  ) 3.9 2.1 0.8 volume=0.300 peak=965 ppm1=0.311 ppm2=1.362

assign ( resid 72 and name HG12
  )
       ( resid 60 and name HE1 or resid 60 and name HE2
  ) 4.2 2.4 0.8 volume=0.186 peak=1679 ppm1=0.774 ppm2=6.765

assign ( resid 90 and name HB1
  )
       ( resid 106 and name HD2
  ) 3.3 1.5 0.7 volume=0.892 peak=1930 ppm1=3.257 ppm2=6.681

assign ( resid 79 and name HB2
  or resid 79 and name HB1
  )
       ( resid 79 and name HN
  ) 3.6 1.8 0.7 volume=0.515 peak=1486 ppm1=1.815 ppm2=8.422

assign ( resid 109 and name HA
  )
       ( resid 108 and name HN
  ) 4.1 2.3 0.8 volume=0.232 peak=1077 ppm1=3.771 ppm2=6.926

assign ( resid 74 and name HD1#
  )
       ( resid 69 and name HD1 or resid 69 and name HD2
  ) 3.7 1.9 0.7 volume=0.431 peak=1406 ppm1=1.042 ppm2=6.888

assign ( resid 93 and name HB2
  )
       ( resid 93 and name HA
  ) 3.3 1.5 0.7 volume=0.777 peak=2070 ppm1=2.750 ppm2=5.002

assign ( resid 102 and name HB2
  )
       ( resid 103 and name HN
  ) 3.9 2.1 0.8 volume=0.285 peak=2100 ppm1=2.723 ppm2=7.222

assign ( resid 72 and name HN
  )
       ( resid 72 and name HG12
  ) 3.2 1.4 0.6 volume=1.082 peak=296 ppm1=8.435 ppm2=0.800

assign ( resid 83 and name HN
  )
       ( resid 82 and name HN
  ) 4.0 2.2 0.8 volume=0.264 peak=157 ppm1=7.741 ppm2=7.130

assign ( resid 80 and name HN
  )
       ( resid 77 and name HD1#
  ) 3.9 2.1 0.8 volume=0.285 peak=549 ppm1=7.094 ppm2=0.737

assign ( resid 102 and name HN
  )
       ( resid 100 and name HN
  ) 4.0 2.2 0.8 volume=0.252 peak=783 ppm1=7.848 ppm2=8.335

assign ( resid 68 and name HA
  )
       ( resid 68 and name HB1
  ) 3.7 1.9 0.7 volume=0.396 peak=1740 ppm1=5.123 ppm2=3.493

assign ( resid 72 and name HB
  )
       ( resid 72 and name HD1#
  ) 2.8 1.0 0.6 volume=2.400 peak=865 ppm1=0.881 ppm2=0.580

assign ( resid 109 and name HG1#
  )
       ( resid 106 and name HA
  ) 4.1 2.3 0.8 volume=0.227 peak=1946 ppm1=0.307 ppm2=4.045

assign ( resid 91 and name HA
  )
       ( resid 92 and name HN
  ) 3.2 1.4 0.6 volume=1.045 peak=2110 ppm1=3.996 ppm2=8.367

assign ( resid 77 and name HB2
  )
       ( resid 77 and name HN
  ) 3.4 1.6 0.7 volume=0.748 peak=1455 ppm1=1.555 ppm2=7.295

assign ( resid 72 and name HN
  )
       ( resid 72 and name HD1#
  ) 3.2 1.4 0.6 volume=1.020 peak=546 ppm1=8.437 ppm2=0.568

assign ( resid 80 and name HD2
  or resid 80 and name HD1
  )
       ( resid 80 and name HB2
  or resid 80 and name HB1
  ) 2.3 0.5 0.5 volume=7.834 peak=883 ppm1=1.528 ppm2=1.702

assign ( resid 104 and name HG1
  )
       ( resid 105 and name HN
  ) 4.3 2.5 0.9 volume=0.166 peak=1987 ppm1=1.260 ppm2=7.548

assign ( resid 89 and name HA
  )
       ( resid 90 and name HN
  ) 3.8 2.0 0.8 volume=0.341 peak=2162 ppm1=4.862 ppm2=9.146

assign ( resid 66 and name HN
  )
       ( resid 64 and name HB2
  or resid 64 and name HB1
  ) 3.8 2.0 0.8 volume=0.332 peak=505 ppm1=8.116 ppm2=1.368

assign ( resid 78 and name HN
  )
       ( resid 78 and name HA
  ) 2.9 1.1 0.6 volume=1.849 peak=360 ppm1=7.445 ppm2=3.972

assign ( resid 85 and name HN
  )
       ( resid 84 and name HA2
  or resid 84 and name HA1
  ) 2.7 0.9 0.5 volume=2.586 peak=410 ppm1=7.942 ppm2=3.859

assign ( resid 87 and name HG2
  )
       ( resid 85 and name HG2
  ) 4.3 2.5 0.9 volume=0.161 peak=2320 ppm1=1.202 ppm2=2.078

assign ( resid 80 and name HN
  )
       ( resid 81 and name HN
  ) 2.9 1.1 0.6 volume=1.699 peak=123 ppm1=7.092 ppm2=7.615

assign ( resid 74 and name HD1#
  )
       ( resid 74 and name HN
  ) 3.8 2.0 0.8 volume=0.366 peak=2055 ppm1=1.040 ppm2=6.400

assign ( resid 106 and name HA
  )
       ( resid 109 and name HG1#
  ) 3.8 2.0 0.8 volume=0.341 peak=1671 ppm1=4.047 ppm2=0.320

assign ( resid 103 and name HB2
  )
       ( resid 104 and name HN
  ) 3.6 1.8 0.7 volume=0.454 peak=1349 ppm1=1.820 ppm2=8.123

assign ( resid 92 and name HN
  )
       ( resid 91 and name HA
  ) 3.0 1.2 0.6 volume=1.355 peak=478 ppm1=8.369 ppm2=3.999

assign ( resid 107 and name HN
  )
       ( resid 109 and name HN
  ) 3.9 2.1 0.8 volume=0.326 peak=375 ppm1=8.030 ppm2=7.802

assign ( resid 103 and name HD2#
  )
       ( resid 88 and name HB2
  ) 3.0 1.2 0.6 volume=1.436 peak=2375 ppm1=0.878 ppm2=2.746

assign ( resid 62 and name HB2
  )
       ( resid 75 and name HD2#
  or resid 75 and name HD1#
  ) 3.3 1.5 0.7 volume=0.785 peak=1198 ppm1=2.662 ppm2=0.880

assign ( resid 89 and name HN
  )
       ( resid 103 and name HD1#
  ) 3.1 1.3 0.6 volume=1.170 peak=650 ppm1=8.393 ppm2=0.829

assign ( resid 88 and name HD1 or resid 88 and name HD2
  )
       ( resid 100 and name HB1
  ) 3.5 1.7 0.7 volume=0.578 peak=53 ppm1=6.814 ppm2=3.356

assign ( resid 109 and name HG1#
  )
       ( resid 108 and name HA
  ) 4.2 2.4 0.8 volume=0.187 peak=1724 ppm1=0.309 ppm2=3.936

assign ( resid 92 and name HA
  )
       ( resid 92 and name HN
  ) 3.7 1.9 0.7 volume=0.453 peak=2106 ppm1=4.352 ppm2=8.364

assign ( resid 76 and name HN
  )
       ( resid 73 and name HA
  ) 3.3 1.5 0.7 volume=0.910 peak=286 ppm1=8.458 ppm2=3.904

assign ( resid 87 and name HA
  )
       ( resid 85 and name HG1
  ) 4.4 2.6 0.9 volume=0.157 peak=2358 ppm1=4.197 ppm2=2.129

assign ( resid 106 and name HN
  )
       ( resid 106 and name HB1
  ) 2.6 0.8 0.5 volume=3.108 peak=752 ppm1=7.303 ppm2=2.586

assign ( resid 103 and name HA
  )
       ( resid 103 and name HG
  ) 3.5 1.7 0.7 volume=0.543 peak=1216 ppm1=3.030 ppm2=1.304

assign ( resid 62 and name HN
  )
       ( resid 75 and name HD2#
  ) 3.5 1.7 0.7 volume=0.546 peak=839 ppm1=8.874 ppm2=0.871

assign ( resid 66 and name HN
  )
       ( resid 62 and name HN
  ) 4.1 2.3 0.8 volume=0.217 peak=859 ppm1=8.109 ppm2=8.880

assign ( resid 82 and name HN
  )
       ( resid 82 and name HB1
  ) 2.9 1.1 0.6 volume=1.870 peak=140 ppm1=7.138 ppm2=3.036

assign ( resid 90 and name HA
  )
       ( resid 91 and name HN
  ) 4.6 2.8 0.9 volume=0.110 peak=1991 ppm1=4.425 ppm2=9.403

assign ( resid 79 and name HN
  )
       ( resid 81 and name HN
  ) 3.6 1.8 0.7 volume=0.523 peak=600 ppm1=8.414 ppm2=7.641

assign ( resid 110 and name HN
  )
       ( resid 109 and name HG2#
  ) 3.3 1.5 0.7 volume=0.844 peak=854 ppm1=7.119 ppm2=0.487

assign ( resid 88 and name HD1 or resid 88 and name HD2
  )
       ( resid 100 and name HA
  ) 3.2 1.4 0.6 volume=0.912 peak=79 ppm1=6.812 ppm2=3.195

assign ( resid 80 and name HA
  )
       ( resid 80 and name HE1
  ) 3.3 1.5 0.7 volume=0.875 peak=1412 ppm1=3.929 ppm2=2.793

assign ( resid 82 and name HN
  )
       ( resid 82 and name HB2
  ) 2.9 1.1 0.6 volume=1.813 peak=613 ppm1=7.139 ppm2=3.123

assign ( resid 104 and name HN
  )
       ( resid 103 and name HA
  ) 3.5 1.7 0.7 volume=0.624 peak=246 ppm1=8.129 ppm2=3.031

assign ( resid 95 and name HB1
  )
       ( resid 95 and name HE2
  or resid 95 and name HE1
  ) 3.9 2.1 0.8 volume=0.303 peak=895 ppm1=1.261 ppm2=2.818

assign ( resid 87 and name HB2
  or resid 87 and name HB1
  )
       ( resid 87 and name HG1
  ) 2.6 0.8 0.5 volume=3.458 peak=2317 ppm1=1.359 ppm2=1.129

assign ( resid 106 and name HB2
  )
       ( resid 103 and name HA
  ) 3.4 1.6 0.7 volume=0.639 peak=1494 ppm1=2.824 ppm2=3.031

assign ( resid 78 and name HA
  )
       ( resid 78 and name HB1
  ) 3.1 1.3 0.6 volume=1.165 peak=1673 ppm1=3.990 ppm2=2.848

assign ( resid 64 and name HB2
  )
       ( resid 64 and name HG2
  ) 3.3 1.5 0.7 volume=0.804 peak=1064 ppm1=1.391 ppm2=1.762

assign ( resid 78 and name HB2
  )
       ( resid 78 and name HB1
  ) 3.5 1.7 0.7 volume=0.580 peak=1626 ppm1=3.195 ppm2=2.854

assign ( resid 103 and name HB1
  )
       ( resid 103 and name HD1#
  ) 3.3 1.5 0.7 volume=0.858 peak=2241 ppm1=1.131 ppm2=0.814

assign ( resid 60 and name HB1
  )
       ( resid 60 and name HB2
  ) 3.2 1.4 0.6 volume=1.067 peak=2213 ppm1=2.844 ppm2=2.619

assign ( resid 68 and name HN
  )
       ( resid 67 and name HB2
  or resid 67 and name HB1
  ) 2.9 1.1 0.6 volume=1.983 peak=467 ppm1=7.664 ppm2=1.214

assign ( resid 88 and name HB2
  )
       ( resid 88 and name HN
  ) 3.6 1.8 0.7 volume=0.468 peak=2380 ppm1=2.749 ppm2=8.311

assign ( resid 94 and name HA2
  )
       ( resid 94 and name HN
  ) 3.1 1.3 0.6 volume=1.162 peak=2004 ppm1=4.090 ppm2=8.296

assign ( resid 79 and name HA
  )
       ( resid 79 and name HB2
  or resid 79 and name HB1
  ) 3.2 1.4 0.6 volume=1.075 peak=2151 ppm1=3.475 ppm2=1.812

assign ( resid 80 and name HB2
  or resid 80 and name HB1
  )
       ( resid 80 and name HN
  ) 3.1 1.3 0.6 volume=1.265 peak=1569 ppm1=1.720 ppm2=7.101

assign ( resid 106 and name HB2
  )
       ( resid 97 and name HZ
  ) 4.3 2.5 0.9 volume=0.180 peak=1595 ppm1=2.808 ppm2=5.913

assign ( resid 97 and name HE1 or resid 97 and name HE2
  )
       ( resid 97 and name HD1 or resid 97 and name HD2
  ) 3.1 1.3 0.6 volume=1.223 peak=88 ppm1=6.683 ppm2=7.105

assign ( resid 100 and name HB2
  )
       ( resid 100 and name HB1
  ) 2.7 0.9 0.5 volume=2.868 peak=1867 ppm1=3.529 ppm2=3.368

assign ( resid 62 and name HN
  )
       ( resid 67 and name HB2
  or resid 67 and name HB1
  ) 4.2 2.4 0.8 volume=0.187 peak=658 ppm1=8.875 ppm2=1.217

assign ( resid 103 and name HD1#
  )
       ( resid 88 and name HD1 or resid 88 and name HD2
  ) 3.5 1.7 0.7 volume=0.591 peak=1105 ppm1=0.807 ppm2=6.834

assign ( resid 96 and name HN
  )
       ( resid 96 and name HD2#
  ) 3.2 1.4 0.6 volume=0.932 peak=603 ppm1=7.581 ppm2=0.701

assign ( resid 87 and name HA
  )
       ( resid 85 and name HG2
  ) 4.2 2.4 0.8 volume=0.202 peak=2324 ppm1=4.196 ppm2=2.082

assign ( resid 110 and name HB1
  )
       ( resid 107 and name HA
  ) 4.4 2.6 0.9 volume=0.154 peak=1434 ppm1=3.136 ppm2=3.448

assign ( resid 105 and name HN
  )
       ( resid 104 and name HN
  ) 2.8 1.0 0.6 volume=2.131 peak=322 ppm1=7.547 ppm2=8.119

assign ( resid 61 and name HA2
  )
       ( resid 61 and name HN
  ) 3.8 2.0 0.8 volume=0.386 peak=912 ppm1=3.419 ppm2=8.403

assign ( resid 104 and name HG2
  )
       ( resid 104 and name HA
  ) 3.0 1.2 0.6 volume=1.344 peak=1872 ppm1=1.343 ppm2=3.914

assign ( resid 60 and name HB1
  )
       ( resid 60 and name HN
  ) 4.1 2.3 0.8 volume=0.232 peak=1476 ppm1=2.844 ppm2=7.715

assign ( resid 108 and name HD1#
  )
       ( resid 108 and name HN
  ) 3.2 1.4 0.6 volume=1.012 peak=1459 ppm1=0.709 ppm2=6.923

assign ( resid 96 and name HD2#
  )
       ( resid 89 and name HD2
  ) 3.9 2.1 0.8 volume=0.327 peak=1505 ppm1=0.685 ppm2=2.942

assign ( resid 103 and name HB1
  )
       ( resid 103 and name HG
  ) 3.4 1.6 0.7 volume=0.637 peak=1672 ppm1=1.135 ppm2=1.298

assign ( resid 93 and name HN
  )
       ( resid 94 and name HA2
  ) 3.2 1.4 0.6 volume=0.949 peak=697 ppm1=7.743 ppm2=4.072

assign ( resid 69 and name HN
  )
       ( resid 61 and name HA2
  ) 3.0 1.2 0.6 volume=1.432 peak=430 ppm1=8.408 ppm2=3.430

assign ( resid 103 and name HB2
  )
       ( resid 97 and name HB1
  ) 3.8 2.0 0.8 volume=0.334 peak=1331 ppm1=1.824 ppm2=2.672

assign ( resid 74 and name HA
  )
       ( resid 74 and name HG
  ) 2.6 0.8 0.5 volume=3.551 peak=1390 ppm1=3.928 ppm2=1.548

assign ( resid 60 and name HB2
  )
       ( resid 60 and name HN
  ) 3.9 2.1 0.8 volume=0.294 peak=1122 ppm1=2.620 ppm2=7.710

assign ( resid 93 and name HA
  )
       ( resid 93 and name HN
  ) 3.4 1.6 0.7 volume=0.742 peak=1002 ppm1=4.999 ppm2=7.748

assign ( resid 75 and name HD1#
  )
       ( resid 69 and name HD1 or resid 69 and name HD2
  ) 3.2 1.4 0.6 volume=1.016 peak=1529 ppm1=0.890 ppm2=6.892

assign ( resid 91 and name HN
  )
       ( resid 93 and name HN
  ) 4.0 2.2 0.8 volume=0.282 peak=724 ppm1=9.400 ppm2=7.738

assign ( resid 95 and name HD1
  )
       ( resid 95 and name HN
  ) 3.6 1.8 0.7 volume=0.460 peak=1381 ppm1=1.347 ppm2=7.737

assign ( resid 104 and name HG2
  )
       ( resid 101 and name HA2
  ) 4.2 2.4 0.8 volume=0.206 peak=2057 ppm1=1.345 ppm2=3.621

assign ( resid 91 and name HG1
  )
       ( resid 91 and name HB1
  ) 2.5 0.7 0.5 volume=4.015 peak=2086 ppm1=2.260 ppm2=1.890

assign ( resid 105 and name HN
  )
       ( resid 105 and name HG2
  ) 2.5 0.7 0.5 volume=4.710 peak=593 ppm1=7.547 ppm2=1.583

assign ( resid 89 and name HB2
  )
       ( resid 89 and name HD1
  ) 3.5 1.7 0.7 volume=0.563 peak=1577 ppm1=1.288 ppm2=2.959

assign ( resid 100 and name HB1
  )
       ( resid 88 and name HB2
  ) 4.6 2.8 0.9 volume=0.109 peak=2386 ppm1=3.369 ppm2=2.782

assign ( resid 79 and name HA
  )
       ( resid 82 and name HN
  ) 3.8 2.0 0.8 volume=0.348 peak=894 ppm1=3.479 ppm2=7.129

assign ( resid 103 and name HD2#
  )
       ( resid 88 and name HN
  ) 3.7 1.9 0.7 volume=0.416 peak=2336 ppm1=0.878 ppm2=8.309

assign ( resid 103 and name HD1#
  )
       ( resid 88 and name HB2
  ) 2.8 1.0 0.6 volume=2.261 peak=2344 ppm1=0.808 ppm2=2.744

assign ( resid 89 and name HG1
  or resid 89 and name HG2
  )
       ( resid 96 and name HD1#
  ) 3.1 1.3 0.6 volume=1.149 peak=1193 ppm1=1.102 ppm2=0.565

assign ( resid 103 and name HN
  )
       ( resid 104 and name HN
  ) 2.8 1.0 0.6 volume=2.087 peak=787 ppm1=7.219 ppm2=8.131

assign ( resid 75 and name HN
  )
       ( resid 76 and name HA
  ) 4.3 2.5 0.9 volume=0.174 peak=619 ppm1=7.049 ppm2=4.202

assign ( resid 60 and name HB2
  )
       ( resid 69 and name HN
  ) 4.0 2.2 0.8 volume=0.254 peak=1292 ppm1=2.625 ppm2=8.418

assign ( resid 95 and name HB1
  )
       ( resid 95 and name HG1
  ) 2.9 1.1 0.6 volume=1.875 peak=2211 ppm1=1.282 ppm2=1.035

assign ( resid 64 and name HB2
  )
       ( resid 64 and name HN
  ) 3.7 1.9 0.7 volume=0.439 peak=1761 ppm1=1.388 ppm2=8.559

assign ( resid 108 and name HN
  )
       ( resid 106 and name HA
  ) 3.7 1.9 0.7 volume=0.434 peak=156 ppm1=6.912 ppm2=4.095

assign ( resid 62 and name HN
  )
       ( resid 62 and name HA
  ) 3.5 1.7 0.7 volume=0.540 peak=754 ppm1=8.877 ppm2=4.354

assign ( resid 97 and name HD1 or resid 97 and name HD2
  )
       ( resid 103 and name HD2#
  ) 3.2 1.4 0.6 volume=1.048 peak=42 ppm1=7.101 ppm2=0.878

assign ( resid 97 and name HD1 or resid 97 and name HD2
  )
       ( resid 102 and name HB2
  ) 3.0 1.2 0.6 volume=1.555 peak=107 ppm1=7.102 ppm2=2.721

assign ( resid 87 and name HN
  )
       ( resid 87 and name HA
  ) 3.3 1.5 0.7 volume=0.873 peak=2370 ppm1=7.710 ppm2=4.197

assign ( resid 89 and name HB1
  )
       ( resid 89 and name HN
  ) 3.6 1.8 0.7 volume=0.516 peak=2096 ppm1=1.597 ppm2=8.395

assign ( resid 97 and name HZ
  )
       ( resid 97 and name HD1 or resid 97 and name HD2
  ) 3.8 2.0 0.8 volume=0.358 peak=50 ppm1=5.905 ppm2=7.103

assign ( resid 98 and name HG2#
  )
       ( resid 87 and name HD2
  ) 3.9 2.1 0.8 volume=0.290 peak=2360 ppm1=1.132 ppm2=2.857

assign ( resid 104 and name HN
  )
       ( resid 107 and name HG2
  ) 3.5 1.7 0.7 volume=0.631 peak=291 ppm1=8.130 ppm2=2.722

assign ( resid 76 and name HB2
  or resid 76 and name HB1
  )
       ( resid 76 and name HN
  ) 3.4 1.6 0.7 volume=0.693 peak=2116 ppm1=2.568 ppm2=8.457

assign ( resid 103 and name HA
  )
       ( resid 102 and name HB2
  ) 3.4 1.6 0.7 volume=0.699 peak=1250 ppm1=3.031 ppm2=2.741

assign ( resid 60 and name HN
  )
       ( resid 69 and name HN
  ) 3.4 1.6 0.7 volume=0.647 peak=861 ppm1=7.706 ppm2=8.418

assign ( resid 80 and name HD2
  or resid 80 and name HD1
  )
       ( resid 80 and name HG2
  ) 2.2 0.4 0.4 volume=10.651 peak=1775 ppm1=1.526 ppm2=1.266

assign ( resid 107 and name HG1
  )
       ( resid 104 and name HB1
  or resid 104 and name HB2
  ) 4.2 2.4 0.8 volume=0.193 peak=1804 ppm1=2.646 ppm2=1.674

assign ( resid 71 and name HB1
  )
       ( resid 71 and name HG
  ) 3.8 2.0 0.8 volume=0.346 peak=1310 ppm1=1.344 ppm2=1.475

assign ( resid 75 and name HA
  )
       ( resid 78 and name HB1
  ) 4.0 2.2 0.8 volume=0.249 peak=994 ppm1=3.469 ppm2=2.858

assign ( resid 61 and name HN
  )
       ( resid 75 and name HD2#
  or resid 75 and name HD1#
  ) 3.4 1.6 0.7 volume=0.660 peak=453 ppm1=8.398 ppm2=0.862

assign ( resid 88 and name HD1 or resid 88 and name HD2
  )
       ( resid 88 and name HB1
  ) 2.6 0.8 0.5 volume=3.485 peak=2307 ppm1=6.812 ppm2=2.631

assign ( resid 80 and name HN
  )
       ( resid 80 and name HB2
  or resid 80 and name HB1
  ) 2.6 0.8 0.5 volume=3.184 peak=679 ppm1=7.092 ppm2=1.715

assign ( resid 68 and name HN
  )
       ( resid 68 and name HA
  ) 3.6 1.8 0.7 volume=0.500 peak=117 ppm1=7.667 ppm2=5.115

assign ( resid 75 and name HB2
  )
       ( resid 75 and name HN
  ) 4.1 2.3 0.8 volume=0.217 peak=1932 ppm1=1.250 ppm2=7.054

assign ( resid 62 and name HB1
  )
       ( resid 62 and name HN
  ) 3.8 2.0 0.8 volume=0.351 peak=1961 ppm1=3.232 ppm2=8.882

assign ( resid 64 and name HN
  )
       ( resid 64 and name HB1
  ) 2.7 0.9 0.5 volume=2.684 peak=418 ppm1=8.555 ppm2=1.368

assign ( resid 96 and name HD2#
  )
       ( resid 96 and name HN
  ) 3.5 1.7 0.7 volume=0.568 peak=1902 ppm1=0.687 ppm2=7.581

assign ( resid 107 and name HA
  )
       ( resid 107 and name HG2
  ) 3.2 1.4 0.6 volume=0.972 peak=1543 ppm1=3.453 ppm2=2.694

assign ( resid 70 and name HN
  )
       ( resid 69 and name HA
  ) 3.8 2.0 0.8 volume=0.370 peak=312 ppm1=9.265 ppm2=4.519

assign ( resid 72 and name HD1#
  )
       ( resid 60 and name HE1 or resid 60 and name HE2
  ) 3.2 1.4 0.6 volume=1.043 peak=2101 ppm1=0.551 ppm2=6.757

assign ( resid 94 and name HN
  )
       ( resid 89 and name HD1
  or resid 89 and name HD2
  ) 3.7 1.9 0.7 volume=0.407 peak=282 ppm1=8.295 ppm2=2.931

assign ( resid 96 and name HN
  )
       ( resid 95 and name HA
  ) 2.4 0.6 0.5 volume=6.081 peak=330 ppm1=7.581 ppm2=3.840

assign ( resid 103 and name HD1#
  )
       ( resid 90 and name HN
  ) 3.9 2.1 0.8 volume=0.301 peak=2121 ppm1=0.807 ppm2=9.127

assign ( resid 59 and name HD1
  )
       ( resid 59 and name HB1
  ) 4.1 2.3 0.8 volume=0.223 peak=1253 ppm1=3.390 ppm2=0.922

assign ( resid 74 and name HD2#
  )
       ( resid 76 and name HN
  ) 4.2 2.4 0.8 volume=0.201 peak=1812 ppm1=0.765 ppm2=8.431

assign ( resid 74 and name HD2#
  )
       ( resid 74 and name HB1
  ) 2.8 1.0 0.6 volume=2.089 peak=1947 ppm1=0.766 ppm2=1.292

assign ( resid 77 and name HG
  )
       ( resid 77 and name HD2#
  ) 2.5 0.7 0.5 volume=4.019 peak=999 ppm1=1.547 ppm2=0.743

assign ( resid 110 and name HB2
  )
       ( resid 110 and name HN
  ) 3.5 1.7 0.7 volume=0.556 peak=2219 ppm1=3.030 ppm2=7.120

assign ( resid 101 and name HA1
  )
       ( resid 101 and name HN
  ) 3.5 1.7 0.7 volume=0.560 peak=1876 ppm1=3.573 ppm2=8.363

assign ( resid 97 and name HD1 or resid 97 and name HD2
  )
       ( resid 103 and name HD1#
  ) 3.0 1.2 0.6 volume=1.503 peak=84 ppm1=7.099 ppm2=0.814

assign ( resid 98 and name HG2#
  )
       ( resid 98 and name HB
  ) 3.6 1.8 0.7 volume=0.509 peak=1756 ppm1=1.129 ppm2=4.343

assign ( resid 71 and name HN
  )
       ( resid 71 and name HB2
  ) 3.2 1.4 0.6 volume=0.935 peak=647 ppm1=6.746 ppm2=1.665

assign ( resid 72 and name HD1#
  )
       ( resid 60 and name HB2
  ) 3.9 2.1 0.8 volume=0.294 peak=2166 ppm1=0.551 ppm2=2.607

assign ( resid 88 and name HN
  )
       ( resid 87 and name HB2
  or resid 87 and name HB1
  ) 2.9 1.1 0.6 volume=1.683 peak=2334 ppm1=8.309 ppm2=1.355

assign ( resid 106 and name HN
  )
       ( resid 107 and name HN
  ) 2.8 1.0 0.6 volume=2.218 peak=595 ppm1=7.304 ppm2=8.023

assign ( resid 107 and name HE21
  )
       ( resid 103 and name HD2#
  ) 3.3 1.5 0.7 volume=0.826 peak=532 ppm1=7.491 ppm2=0.858

assign ( resid 80 and name HN
  )
       ( resid 80 and name HE2
  or resid 80 and name HE1
  ) 3.8 2.0 0.8 volume=0.333 peak=845 ppm1=7.094 ppm2=2.839

assign ( resid 71 and name HN
  )
       ( resid 74 and name HN
  ) 4.1 2.3 0.8 volume=0.230 peak=481 ppm1=6.745 ppm2=6.406

assign ( resid 107 and name HE21
  )
       ( resid 107 and name HB1
  ) 3.8 2.0 0.8 volume=0.365 peak=425 ppm1=7.497 ppm2=2.061

assign ( resid 110 and name HN
  )
       ( resid 111 and name HN
  ) 2.9 1.1 0.6 volume=1.769 peak=533 ppm1=7.119 ppm2=7.600

assign ( resid 86 and name HA
  )
       ( resid 96 and name HD1#
  ) 4.5 2.7 0.9 volume=0.138 peak=1850 ppm1=4.105 ppm2=0.575

assign ( resid 96 and name HD1#
  )
       ( resid 89 and name HD1
  ) 3.1 1.3 0.6 volume=1.165 peak=1617 ppm1=0.562 ppm2=2.961

assign ( resid 86 and name HA
  )
       ( resid 86 and name HB#
  ) 2.6 0.8 0.5 volume=3.276 peak=1725 ppm1=4.103 ppm2=1.071

assign ( resid 97 and name HN
  )
       ( resid 97 and name HA
  ) 2.8 1.0 0.6 volume=2.339 peak=287 ppm1=8.691 ppm2=4.685

assign ( resid 108 and name HB1
  )
       ( resid 108 and name HD2#
  ) 3.1 1.3 0.6 volume=1.222 peak=897 ppm1=1.587 ppm2=0.807

assign ( resid 77 and name HD1#
  )
       ( resid 77 and name HA
  ) 2.7 0.9 0.5 volume=2.773 peak=1218 ppm1=0.713 ppm2=3.905

assign ( resid 60 and name HB2
  )
       ( resid 60 and name HB1
  ) 3.5 1.7 0.7 volume=0.610 peak=1039 ppm1=2.619 ppm2=2.843

assign ( resid 98 and name HG2#
  )
       ( resid 87 and name HB2
  or resid 87 and name HB1
  ) 3.0 1.2 0.6 volume=1.362 peak=2147 ppm1=1.133 ppm2=1.383

assign ( resid 97 and name HN
  )
       ( resid 103 and name HD1#
  ) 3.7 1.9 0.7 volume=0.444 peak=513 ppm1=8.697 ppm2=0.838

assign ( resid 87 and name HA
  )
       ( resid 80 and name HE2
  or resid 80 and name HE1
  ) 3.9 2.1 0.8 volume=0.319 peak=2346 ppm1=4.188 ppm2=2.820

assign ( resid 87 and name HG2
  )
       ( resid 85 and name HB2
  ) 3.6 1.8 0.7 volume=0.454 peak=2329 ppm1=1.197 ppm2=1.787

assign ( resid 82 and name HN
  )
       ( resid 81 and name HA
  ) 3.1 1.3 0.6 volume=1.299 peak=566 ppm1=7.132 ppm2=3.940

assign ( resid 69 and name HN
  )
       ( resid 75 and name HD2#
  ) 3.3 1.5 0.7 volume=0.880 peak=597 ppm1=8.414 ppm2=0.867

assign ( resid 82 and name HD2
  )
       ( resid 82 and name HB1
  ) 2.9 1.1 0.6 volume=1.737 peak=83 ppm1=6.606 ppm2=3.012

assign ( resid 107 and name HN
  )
       ( resid 106 and name HN
  ) 2.9 1.1 0.6 volume=1.971 peak=749 ppm1=8.027 ppm2=7.303

assign ( resid 91 and name HB2
  )
       ( resid 91 and name HG2
  ) 2.4 0.6 0.5 volume=5.652 peak=978 ppm1=1.995 ppm2=2.223

assign ( resid 104 and name HD1
  or resid 104 and name HD2
  )
       ( resid 104 and name HG2
  ) 2.0 0.2 0.4 volume=15.229 peak=1224 ppm1=1.487 ppm2=1.342

assign ( resid 98 and name HG2#
  )
       ( resid 87 and name HD1
  ) 4.1 2.3 0.8 volume=0.243 peak=2304 ppm1=1.131 ppm2=2.918

assign ( resid 89 and name HG1
  or resid 89 and name HG2
  )
       ( resid 90 and name HN
  ) 4.0 2.2 0.8 volume=0.268 peak=1164 ppm1=1.098 ppm2=9.136

assign ( resid 60 and name HB2
  )
       ( resid 75 and name HD2#
  ) 3.2 1.4 0.6 volume=1.012 peak=1500 ppm1=2.620 ppm2=0.856

assign ( resid 108 and name HD1#
  )
       ( resid 108 and name HB2
  ) 2.4 0.6 0.5 volume=5.285 peak=1222 ppm1=0.705 ppm2=1.359

assign ( resid 96 and name HD1#
  )
       ( resid 95 and name HN
  ) 4.2 2.4 0.8 volume=0.208 peak=1079 ppm1=0.560 ppm2=7.738

assign ( resid 75 and name HD2#
  )
       ( resid 75 and name HA
  ) 3.8 2.0 0.8 volume=0.365 peak=1809 ppm1=0.846 ppm2=3.465

assign ( resid 108 and name HN
  )
       ( resid 108 and name HD1#
  ) 3.0 1.2 0.6 volume=1.431 peak=427 ppm1=6.917 ppm2=0.750

assign ( resid 95 and name HE2
  or resid 95 and name HE1
  )
       ( resid 95 and name HG1
  ) 2.8 1.0 0.6 volume=2.349 peak=1265 ppm1=2.819 ppm2=1.032

assign ( resid 109 and name HG1#
  )
       ( resid 110 and name HB2
  ) 4.6 2.8 0.9 volume=0.121 peak=2160 ppm1=0.310 ppm2=3.028

assign ( resid 103 and name HA
  )
       ( resid 102 and name HB1
  ) 3.3 1.5 0.7 volume=0.807 peak=1823 ppm1=3.034 ppm2=2.796

assign ( resid 78 and name HB1
  )
       ( resid 78 and name HN
  ) 3.5 1.7 0.7 volume=0.609 peak=2005 ppm1=2.862 ppm2=7.453

assign ( resid 60 and name HN
  )
       ( resid 69 and name HB2
  ) 3.6 1.8 0.7 volume=0.494 peak=584 ppm1=7.721 ppm2=3.065

assign ( resid 77 and name HA
  )
       ( resid 77 and name HN
  ) 3.2 1.4 0.6 volume=1.051 peak=1571 ppm1=3.901 ppm2=7.291

assign ( resid 60 and name HE1 or resid 60 and name HE2
  )
       ( resid 60 and name HB1
  ) 3.6 1.8 0.7 volume=0.476 peak=71 ppm1=6.750 ppm2=2.836

assign ( resid 65 and name HN
  )
       ( resid 64 and name HG2
  ) 3.6 1.8 0.7 volume=0.533 peak=192 ppm1=7.858 ppm2=1.759

assign ( resid 96 and name HD1#
  )
       ( resid 96 and name HA
  ) 3.8 2.0 0.8 volume=0.337 peak=1868 ppm1=0.562 ppm2=4.766

assign ( resid 111 and name HN
  )
       ( resid 110 and name HN
  ) 2.9 1.1 0.6 volume=1.766 peak=797 ppm1=7.584 ppm2=7.117

assign ( resid 103 and name HD1#
  )
       ( resid 106 and name HB2
  ) 3.2 1.4 0.6 volume=0.948 peak=1106 ppm1=0.810 ppm2=2.817

assign ( resid 74 and name HN
  )
       ( resid 73 and name HN
  ) 3.8 2.0 0.8 volume=0.383 peak=576 ppm1=6.398 ppm2=8.002

assign ( resid 76 and name HA
  )
       ( resid 76 and name HB2
  or resid 76 and name HB1
  ) 3.2 1.4 0.6 volume=1.035 peak=1189 ppm1=4.202 ppm2=2.569

assign ( resid 110 and name HD2
  )
       ( resid 107 and name HA
  ) 2.7 0.9 0.5 volume=2.653 peak=10 ppm1=6.614 ppm2=3.454

assign ( resid 78 and name HA
  )
       ( resid 81 and name HB1
  ) 3.3 1.5 0.7 volume=0.797 peak=1288 ppm1=3.991 ppm2=1.361

assign ( resid 106 and name HB1
  )
       ( resid 106 and name HD2
  ) 3.6 1.8 0.7 volume=0.520 peak=1460 ppm1=2.584 ppm2=6.677

assign ( resid 89 and name HG1
  or resid 89 and name HG2
  )
       ( resid 89 and name HD1
  ) 2.9 1.1 0.6 volume=1.743 peak=1532 ppm1=1.101 ppm2=2.960

assign ( resid 107 and name HG2
  )
       ( resid 107 and name HA
  ) 3.4 1.6 0.7 volume=0.687 peak=1181 ppm1=2.698 ppm2=3.449

assign ( resid 75 and name HN
  )
       ( resid 75 and name HA
  ) 3.4 1.6 0.7 volume=0.639 peak=725 ppm1=7.049 ppm2=3.458

assign ( resid 94 and name HA2
  )
       ( resid 89 and name HG1
  or resid 89 and name HG2
  ) 3.5 1.7 0.7 volume=0.592 peak=1985 ppm1=4.087 ppm2=1.090

assign ( resid 105 and name HG2
  )
       ( resid 105 and name HG1
  ) 2.0 0.2 0.4 volume=14.482 peak=2087 ppm1=1.569 ppm2=1.443

assign ( resid 62 and name HN
  )
       ( resid 61 and name HA1
  ) 3.2 1.4 0.6 volume=1.096 peak=266 ppm1=8.872 ppm2=4.529

assign ( resid 63 and name HB2
  )
       ( resid 63 and name HA
  ) 3.0 1.2 0.6 volume=1.338 peak=1103 ppm1=1.943 ppm2=4.010

assign ( resid 65 and name HB1
  )
       ( resid 65 and name HN
  ) 3.0 1.2 0.6 volume=1.629 peak=2244 ppm1=2.749 ppm2=7.857

assign ( resid 108 and name HB1
  )
       ( resid 108 and name HN
  ) 3.3 1.5 0.7 volume=0.814 peak=2026 ppm1=1.587 ppm2=6.922

assign ( resid 96 and name HD1#
  )
       ( resid 96 and name HD2#
  ) 2.2 0.4 0.4 volume=10.853 peak=2178 ppm1=0.564 ppm2=0.686

assign ( resid 107 and name HB1
  )
       ( resid 103 and name HD1#
  ) 4.1 2.3 0.8 volume=0.239 peak=1317 ppm1=2.060 ppm2=0.824

assign ( resid 104 and name HG2
  )
       ( resid 104 and name HN
  ) 3.6 1.8 0.7 volume=0.500 peak=988 ppm1=1.345 ppm2=8.129

assign ( resid 78 and name HB1
  )
       ( resid 79 and name HN
  ) 4.1 2.3 0.8 volume=0.214 peak=1709 ppm1=2.854 ppm2=8.416

assign ( resid 97 and name HN
  )
       ( resid 96 and name HD2#
  ) 3.7 1.9 0.7 volume=0.401 peak=631 ppm1=8.693 ppm2=0.708

assign ( resid 102 and name HB1
  )
       ( resid 99 and name HB
  ) 4.3 2.5 0.9 volume=0.159 peak=1293 ppm1=2.819 ppm2=4.310

assign ( resid 66 and name HN
  )
       ( resid 66 and name HA2
  ) 3.0 1.2 0.6 volume=1.468 peak=458 ppm1=8.121 ppm2=3.681

assign ( resid 90 and name HB2
  )
       ( resid 103 and name HD1#
  ) 3.1 1.3 0.6 volume=1.136 peak=2195 ppm1=2.728 ppm2=0.820

assign ( resid 87 and name HG1
  )
       ( resid 88 and name HN
  ) 4.0 2.2 0.8 volume=0.260 peak=2371 ppm1=1.129 ppm2=8.301

assign ( resid 107 and name HG1
  )
       ( resid 107 and name HB1
  ) 3.3 1.5 0.7 volume=0.765 peak=2289 ppm1=2.641 ppm2=2.059

assign ( resid 66 and name HN
  )
       ( resid 62 and name HB2
  ) 3.7 1.9 0.7 volume=0.425 peak=706 ppm1=8.124 ppm2=2.684

assign ( resid 103 and name HD1#
  )
       ( resid 103 and name HB1
  ) 2.8 1.0 0.6 volume=2.264 peak=1335 ppm1=0.810 ppm2=1.130

assign ( resid 109 and name HG1#
  )
       ( resid 108 and name HB1
  ) 3.8 2.0 0.8 volume=0.368 peak=1485 ppm1=0.309 ppm2=1.621

assign ( resid 87 and name HA
  )
       ( resid 88 and name HN
  ) 3.1 1.3 0.6 volume=1.142 peak=2297 ppm1=4.187 ppm2=8.299

assign ( resid 100 and name HA
  )
       ( resid 103 and name HN
  ) 3.8 2.0 0.8 volume=0.372 peak=1357 ppm1=3.214 ppm2=7.224

assign ( resid 59 and name HD1
  )
       ( resid 59 and name HB2
  ) 3.9 2.1 0.8 volume=0.315 peak=1383 ppm1=3.391 ppm2=0.981

assign ( resid 85 and name HB1
  )
       ( resid 85 and name HN
  ) 3.8 2.0 0.8 volume=0.364 peak=2097 ppm1=1.858 ppm2=7.938

assign ( resid 59 and name HD2
  )
       ( resid 59 and name HG1
  ) 3.4 1.6 0.7 volume=0.696 peak=1046 ppm1=3.433 ppm2=1.805

assign ( resid 106 and name HD2
  )
       ( resid 90 and name HB2
  ) 2.7 0.9 0.5 volume=2.748 peak=15 ppm1=6.681 ppm2=2.727

assign ( resid 62 and name HN
  )
       ( resid 67 and name HN
  ) 3.8 2.0 0.8 volume=0.338 peak=780 ppm1=8.874 ppm2=7.834

assign ( resid 75 and name HN
  )
       ( resid 69 and name HB2
  ) 3.6 1.8 0.7 volume=0.504 peak=692 ppm1=7.048 ppm2=3.081

assign ( resid 59 and name HB1
  )
       ( resid 59 and name HA
  ) 4.0 2.2 0.8 volume=0.255 peak=1454 ppm1=0.915 ppm2=4.065

assign ( resid 102 and name HN
  )
       ( resid 102 and name HB2
  ) 3.0 1.2 0.6 volume=1.453 peak=862 ppm1=7.855 ppm2=2.737

assign ( resid 62 and name HN
  )
       ( resid 61 and name HN
  ) 3.6 1.8 0.7 volume=0.485 peak=172 ppm1=8.882 ppm2=8.408

assign ( resid 91 and name HA
  )
       ( resid 91 and name HB2
  ) 2.5 0.7 0.5 volume=4.041 peak=1452 ppm1=3.998 ppm2=1.998

assign ( resid 102 and name HN
  )
       ( resid 102 and name HB1
  ) 3.2 1.4 0.6 volume=1.022 peak=815 ppm1=7.853 ppm2=2.825

assign ( resid 97 and name HN
  )
       ( resid 96 and name HD1#
  ) 3.3 1.5 0.7 volume=0.852 peak=636 ppm1=8.695 ppm2=0.567

assign ( resid 77 and name HB1
  )
       ( resid 78 and name HN
  ) 3.9 2.1 0.8 volume=0.292 peak=1524 ppm1=1.433 ppm2=7.448

assign ( resid 109 and name HG1#
  )
       ( resid 109 and name HN
  ) 2.8 1.0 0.6 volume=2.269 peak=1270 ppm1=0.307 ppm2=7.818

assign ( resid 106 and name HB1
  )
       ( resid 97 and name HD1 or resid 97 and name HD2
  ) 4.5 2.7 0.9 volume=0.136 peak=1034 ppm1=2.582 ppm2=7.127

assign ( resid 69 and name HB1
  )
       ( resid 74 and name HB2
  ) 4.3 2.5 0.9 volume=0.181 peak=1081 ppm1=2.521 ppm2=1.762

assign ( resid 107 and name HA
  )
       ( resid 107 and name HB1
  ) 3.2 1.4 0.6 volume=1.069 peak=1450 ppm1=3.453 ppm2=2.059

assign ( resid 95 and name HN
  )
       ( resid 89 and name HB1
  ) 3.7 1.9 0.7 volume=0.411 peak=720 ppm1=7.734 ppm2=1.599

assign ( resid 85 and name HN
  )
       ( resid 85 and name HA
  ) 3.0 1.2 0.6 volume=1.416 peak=767 ppm1=7.944 ppm2=4.068

assign ( resid 89 and name HN
  )
       ( resid 88 and name HB1
  ) 3.4 1.6 0.7 volume=0.670 peak=547 ppm1=8.391 ppm2=2.655

assign ( resid 97 and name HN
  )
       ( resid 88 and name HA
  ) 3.8 2.0 0.8 volume=0.343 peak=331 ppm1=8.694 ppm2=4.466

assign ( resid 95 and name HB1
  )
       ( resid 95 and name HB2
  ) 2.5 0.7 0.5 volume=4.506 peak=1633 ppm1=1.267 ppm2=1.194

assign ( resid 95 and name HA
  )
       ( resid 96 and name HN
  ) 2.5 0.7 0.5 volume=4.317 peak=868 ppm1=3.841 ppm2=7.579

assign ( resid 78 and name HD2
  )
       ( resid 78 and name HB1
  ) 3.4 1.6 0.7 volume=0.740 peak=32 ppm1=6.723 ppm2=2.841

assign ( resid 107 and name HE21
  )
       ( resid 91 and name HN
  ) 4.0 2.2 0.8 volume=0.273 peak=177 ppm1=7.494 ppm2=9.408

assign ( resid 75 and name HD1#
  )
       ( resid 62 and name HA
  ) 4.4 2.6 0.9 volume=0.155 peak=880 ppm1=0.890 ppm2=4.335

assign ( resid 71 and name HD2#
  )
       ( resid 73 and name HN
  ) 4.3 2.5 0.9 volume=0.182 peak=1705 ppm1=0.806 ppm2=7.987

assign ( resid 105 and name HN
  )
       ( resid 106 and name HN
  ) 2.8 1.0 0.6 volume=2.355 peak=648 ppm1=7.548 ppm2=7.304

assign ( resid 104 and name HB1
  or resid 104 and name HB2
  )
       ( resid 104 and name HE2
  or resid 104 and name HE1
  ) 3.5 1.7 0.7 volume=0.610 peak=1139 ppm1=1.678 ppm2=2.786

assign ( resid 97 and name HB1
  )
       ( resid 103 and name HN
  ) 3.8 2.0 0.8 volume=0.331 peak=1773 ppm1=2.660 ppm2=7.201

assign ( resid 104 and name HN
  )
       ( resid 103 and name HB2
  ) 2.9 1.1 0.6 volume=1.756 peak=556 ppm1=8.127 ppm2=1.829

assign ( resid 77 and name HN
  )
       ( resid 74 and name HA
  ) 2.8 1.0 0.6 volume=2.205 peak=594 ppm1=7.293 ppm2=3.942

assign ( resid 81 and name HN
  )
       ( resid 79 and name HA
  ) 3.6 1.8 0.7 volume=0.482 peak=457 ppm1=7.634 ppm2=3.481

assign ( resid 104 and name HN
  )
       ( resid 101 and name HN
  ) 3.7 1.9 0.7 volume=0.404 peak=401 ppm1=8.122 ppm2=8.374

assign ( resid 104 and name HG1
  )
       ( resid 104 and name HA
  ) 3.5 1.7 0.7 volume=0.566 peak=1197 ppm1=1.265 ppm2=3.914

assign ( resid 69 and name HE1 or resid 69 and name HE2
  )
       ( resid 74 and name HD2#
  ) 3.5 1.7 0.7 volume=0.564 peak=56 ppm1=6.140 ppm2=0.778

assign ( resid 94 and name HA1
  )
       ( resid 95 and name HN
  ) 3.4 1.6 0.7 volume=0.639 peak=1396 ppm1=3.574 ppm2=7.744

assign ( resid 103 and name HB1
  )
       ( resid 88 and name HB2
  ) 4.0 2.2 0.8 volume=0.261 peak=2363 ppm1=1.132 ppm2=2.749

assign ( resid 95 and name HB1
  )
       ( resid 95 and name HD1
  ) 2.7 0.9 0.5 volume=3.002 peak=1841 ppm1=1.272 ppm2=1.344

assign ( resid 109 and name HN
  )
       ( resid 110 and name HB2
  ) 3.8 2.0 0.8 volume=0.351 peak=772 ppm1=7.807 ppm2=2.997

assign ( resid 94 and name HA1
  )
       ( resid 89 and name HD1
  ) 3.8 2.0 0.8 volume=0.372 peak=1441 ppm1=3.576 ppm2=2.957

assign ( resid 100 and name HB2
  )
       ( resid 100 and name HN
  ) 4.0 2.2 0.8 volume=0.259 peak=1674 ppm1=3.527 ppm2=8.329

assign ( resid 107 and name HG1
  )
       ( resid 103 and name HG
  ) 3.8 2.0 0.8 volume=0.375 peak=1371 ppm1=2.640 ppm2=1.297

assign ( resid 91 and name HG2
  )
       ( resid 91 and name HB1
  ) 2.7 0.9 0.5 volume=3.008 peak=1951 ppm1=2.219 ppm2=1.890

assign ( resid 88 and name HN
  )
       ( resid 87 and name HG1
  ) 3.1 1.3 0.6 volume=1.157 peak=2338 ppm1=8.307 ppm2=1.134

assign ( resid 64 and name HA
  )
       ( resid 65 and name HN
  ) 4.4 2.6 0.9 volume=0.140 peak=2225 ppm1=4.113 ppm2=7.844

assign ( resid 82 and name HE1
  )
       ( resid 65 and name HB2
  ) 3.2 1.4 0.6 volume=1.068 peak=109 ppm1=7.871 ppm2=3.274

assign ( resid 89 and name HD1
  )
       ( resid 96 and name HD2#
  ) 3.7 1.9 0.7 volume=0.415 peak=1638 ppm1=2.961 ppm2=0.685

assign ( resid 107 and name HE21
  )
       ( resid 90 and name HA
  ) 3.7 1.9 0.7 volume=0.387 peak=514 ppm1=7.494 ppm2=4.428

assign ( resid 88 and name HN
  )
       ( resid 97 and name HN
  ) 3.3 1.5 0.7 volume=0.885 peak=2332 ppm1=8.307 ppm2=8.698

assign ( resid 100 and name HA
  )
       ( resid 103 and name HB1
  ) 3.7 1.9 0.7 volume=0.446 peak=1305 ppm1=3.216 ppm2=1.134

assign ( resid 108 and name HB2
  )
       ( resid 108 and name HN
  ) 3.5 1.7 0.7 volume=0.598 peak=2027 ppm1=1.349 ppm2=6.921

assign ( resid 107 and name HE21
  )
       ( resid 107 and name HB2
  ) 3.8 2.0 0.8 volume=0.338 peak=747 ppm1=7.494 ppm2=2.122

assign ( resid 72 and name HG11
  )
       ( resid 72 and name HN
  ) 4.3 2.5 0.9 volume=0.162 peak=1696 ppm1=0.712 ppm2=8.450

assign ( resid 103 and name HB1
  )
       ( resid 104 and name HN
  ) 4.0 2.2 0.8 volume=0.244 peak=899 ppm1=1.139 ppm2=8.123

assign ( resid 107 and name HG2
  )
       ( resid 104 and name HA
  ) 3.9 2.1 0.8 volume=0.289 peak=1604 ppm1=2.694 ppm2=3.904

assign ( resid 107 and name HB2
  )
       ( resid 107 and name HG2
  ) 3.3 1.5 0.7 volume=0.879 peak=2274 ppm1=2.128 ppm2=2.694

assign ( resid 80 and name HE2
  or resid 80 and name HE1
  )
       ( resid 80 and name HG2
  ) 2.5 0.7 0.5 volume=4.836 peak=1223 ppm1=2.821 ppm2=1.265

assign ( resid 100 and name HA
  )
       ( resid 88 and name HD1 or resid 88 and name HD2
  ) 3.9 2.1 0.8 volume=0.324 peak=926 ppm1=3.214 ppm2=6.811

assign ( resid 74 and name HD2#
  )
       ( resid 74 and name HG
  ) 2.7 0.9 0.5 volume=3.100 peak=957 ppm1=0.763 ppm2=1.551

assign ( resid 82 and name HB1
  )
       ( resid 82 and name HN
  ) 3.3 1.5 0.7 volume=0.823 peak=1021 ppm1=3.013 ppm2=7.139

assign ( resid 63 and name HB1
  )
       ( resid 63 and name HN
  ) 4.3 2.5 0.9 volume=0.159 peak=937 ppm1=2.003 ppm2=9.632

assign ( resid 89 and name HN
  )
       ( resid 89 and name HA
  ) 3.1 1.3 0.6 volume=1.115 peak=740 ppm1=8.393 ppm2=4.850

assign ( resid 90 and name HB2
  )
       ( resid 95 and name HN
  ) 3.4 1.6 0.7 volume=0.660 peak=1149 ppm1=2.730 ppm2=7.736

assign ( resid 96 and name HD1#
  )
       ( resid 90 and name HN
  ) 3.9 2.1 0.8 volume=0.299 peak=1866 ppm1=0.563 ppm2=9.130

assign ( resid 74 and name HA
  )
       ( resid 74 and name HB2
  ) 2.9 1.1 0.6 volume=1.676 peak=2183 ppm1=3.928 ppm2=1.740

assign ( resid 102 and name HA
  )
       ( resid 105 and name HD2
  or resid 105 and name HD1
  ) 4.1 2.3 0.8 volume=0.230 peak=1795 ppm1=4.336 ppm2=3.059

assign ( resid 106 and name HB2
  )
       ( resid 106 and name HA
  ) 3.6 1.8 0.7 volume=0.497 peak=1136 ppm1=2.821 ppm2=4.050

assign ( resid 102 and name HN
  )
       ( resid 104 and name HN
  ) 4.0 2.2 0.8 volume=0.266 peak=578 ppm1=7.854 ppm2=8.120

assign ( resid 96 and name HN
  )
       ( resid 90 and name HN
  ) 4.4 2.6 0.9 volume=0.148 peak=488 ppm1=7.589 ppm2=9.115

assign ( resid 99 and name HG2#
  )
       ( resid 99 and name HN
  ) 3.6 1.8 0.7 volume=0.503 peak=1313 ppm1=1.080 ppm2=7.059

assign ( resid 71 and name HD1#
  )
       ( resid 71 and name HG
  ) 2.7 0.9 0.5 volume=3.043 peak=983 ppm1=0.918 ppm2=1.471

assign ( resid 67 and name HB2
  or resid 67 and name HB1
  )
       ( resid 67 and name HA
  ) 3.5 1.7 0.7 volume=0.577 peak=902 ppm1=1.216 ppm2=3.938

assign ( resid 76 and name HA
  )
       ( resid 77 and name HN
  ) 3.9 2.1 0.8 volume=0.289 peak=1682 ppm1=4.203 ppm2=7.291

assign ( resid 95 and name HB1
  )
       ( resid 95 and name HG2
  ) 2.8 1.0 0.6 volume=2.216 peak=935 ppm1=1.270 ppm2=1.405

assign ( resid 109 and name HG1#
  )
       ( resid 107 and name HA
  ) 4.2 2.4 0.8 volume=0.185 peak=1759 ppm1=0.307 ppm2=3.463

assign ( resid 78 and name HN
  )
       ( resid 80 and name HN
  ) 3.6 1.8 0.7 volume=0.502 peak=429 ppm1=7.447 ppm2=7.092

assign ( resid 102 and name HB2
  )
       ( resid 97 and name HB2
  ) 4.1 2.3 0.8 volume=0.229 peak=1325 ppm1=2.719 ppm2=3.100

assign ( resid 112 and name HN
  )
       ( resid 109 and name HA
  ) 3.1 1.3 0.6 volume=1.164 peak=222 ppm1=7.867 ppm2=3.768

assign ( resid 69 and name HD1 or resid 69 and name HD2
  )
       ( resid 69 and name HB2
  ) 3.3 1.5 0.7 volume=0.889 peak=38 ppm1=6.904 ppm2=3.056

assign ( resid 99 and name HB
  )
       ( resid 99 and name HG2#
  ) 3.3 1.5 0.7 volume=0.813 peak=1042 ppm1=4.300 ppm2=1.080

assign ( resid 75 and name HN
  )
       ( resid 75 and name HD2#
  ) 3.2 1.4 0.6 volume=1.092 peak=642 ppm1=7.049 ppm2=0.869

assign ( resid 87 and name HB2
  or resid 87 and name HB1
  )
       ( resid 88 and name HN
  ) 3.7 1.9 0.7 volume=0.414 peak=2382 ppm1=1.358 ppm2=8.301

assign ( resid 96 and name HD1#
  )
       ( resid 95 and name HA
  ) 4.2 2.4 0.8 volume=0.196 peak=2189 ppm1=0.560 ppm2=3.853

assign ( resid 75 and name HN
  )
       ( resid 74 and name HD1#
  ) 3.7 1.9 0.7 volume=0.403 peak=372 ppm1=7.048 ppm2=1.060

assign ( resid 107 and name HG2
  )
       ( resid 107 and name HG1
  ) 2.4 0.6 0.5 volume=5.958 peak=1585 ppm1=2.696 ppm2=2.639

assign ( resid 105 and name HB2
  or resid 105 and name HB1
  )
       ( resid 106 and name HN
  ) 3.3 1.5 0.7 volume=0.861 peak=1380 ppm1=1.670 ppm2=7.308

assign ( resid 98 and name HG2#
  )
       ( resid 85 and name HB1
  ) 4.1 2.3 0.8 volume=0.242 peak=1114 ppm1=1.136 ppm2=1.851

assign ( resid 72 and name HA
  )
       ( resid 72 and name HN
  ) 3.6 1.8 0.7 volume=0.460 peak=1447 ppm1=3.155 ppm2=8.441

assign ( resid 75 and name HD2#
  )
       ( resid 60 and name HN
  ) 4.1 2.3 0.8 volume=0.226 peak=1890 ppm1=0.846 ppm2=7.708

assign ( resid 69 and name HB2
  )
       ( resid 74 and name HD1#
  ) 4.9 3.1 1.0 volume=0.080 peak=991 ppm1=3.057 ppm2=1.048

assign ( resid 95 and name HN
  )
       ( resid 90 and name HB2
  ) 3.0 1.2 0.6 volume=1.384 peak=449 ppm1=7.735 ppm2=2.744

assign ( resid 92 and name HN
  )
       ( resid 92 and name HA
  ) 2.6 0.8 0.5 volume=3.506 peak=633 ppm1=8.368 ppm2=4.356

assign ( resid 109 and name HG2#
  )
       ( resid 109 and name HB
  ) 2.6 0.8 0.5 volume=3.878 peak=1296 ppm1=0.486 ppm2=1.785

assign ( resid 103 and name HD1#
  )
       ( resid 97 and name HN
  ) 4.7 2.9 0.9 volume=0.096 peak=2290 ppm1=0.807 ppm2=8.706

assign ( resid 95 and name HG1
  )
       ( resid 95 and name HG2
  ) 2.5 0.7 0.5 volume=4.749 peak=1749 ppm1=1.028 ppm2=1.416

assign ( resid 105 and name HA
  )
       ( resid 106 and name HN
  ) 3.7 1.9 0.7 volume=0.446 peak=1429 ppm1=3.847 ppm2=7.309

assign ( resid 75 and name HD2#
  )
       ( resid 60 and name HB1
  ) 3.3 1.5 0.7 volume=0.873 peak=1031 ppm1=0.845 ppm2=2.842

assign ( resid 75 and name HA
  )
       ( resid 75 and name HD1#
  ) 3.3 1.5 0.7 volume=0.778 peak=970 ppm1=3.466 ppm2=0.891

assign ( resid 109 and name HA
  )
       ( resid 110 and name HN
  ) 3.7 1.9 0.7 volume=0.391 peak=1341 ppm1=3.774 ppm2=7.118

assign ( resid 77 and name HD1#
  )
       ( resid 77 and name HN
  ) 3.4 1.6 0.7 volume=0.724 peak=1957 ppm1=0.715 ppm2=7.290

assign ( resid 78 and name HN
  )
       ( resid 77 and name HB1
  ) 3.0 1.2 0.6 volume=1.393 peak=415 ppm1=7.444 ppm2=1.420

assign ( resid 95 and name HA
  )
       ( resid 96 and name HD1#
  ) 4.0 2.2 0.8 volume=0.248 peak=1009 ppm1=3.849 ppm2=0.573

assign ( resid 76 and name HD22
  )
       ( resid 76 and name HD21
  ) 2.6 0.8 0.5 volume=3.602 peak=758 ppm1=6.586 ppm2=7.305

assign ( resid 107 and name HG1
  )
       ( resid 104 and name HA
  ) 3.9 2.1 0.8 volume=0.303 peak=1404 ppm1=2.638 ppm2=3.902

assign ( resid 69 and name HN
  )
       ( resid 69 and name HB2
  ) 3.4 1.6 0.7 volume=0.652 peak=307 ppm1=8.415 ppm2=3.055

assign ( resid 75 and name HA
  )
       ( resid 74 and name HB2
  ) 4.1 2.3 0.8 volume=0.227 peak=2017 ppm1=3.468 ppm2=1.732

assign ( resid 88 and name HB1
  )
       ( resid 103 and name HB2
  ) 4.0 2.2 0.8 volume=0.247 peak=2367 ppm1=2.630 ppm2=1.827

assign ( resid 75 and name HD2#
  )
       ( resid 79 and name HE2
  ) 3.5 1.7 0.7 volume=0.634 peak=1554 ppm1=0.848 ppm2=2.950

assign ( resid 89 and name HB1
  )
       ( resid 89 and name HA
  ) 4.4 2.6 0.9 volume=0.140 peak=1829 ppm1=1.598 ppm2=4.848

assign ( resid 91 and name HB2
  )
       ( resid 91 and name HA
  ) 2.9 1.1 0.6 volume=1.800 peak=1098 ppm1=1.994 ppm2=4.002

assign ( resid 104 and name HN
  )
       ( resid 101 and name HA2
  ) 3.6 1.8 0.7 volume=0.460 peak=129 ppm1=8.129 ppm2=3.641

assign ( resid 93 and name HA
  )
       ( resid 92 and name HN
  ) 3.8 2.0 0.8 volume=0.354 peak=1249 ppm1=5.002 ppm2=8.369

assign ( resid 90 and name HN
  )
       ( resid 95 and name HN
  ) 3.6 1.8 0.7 volume=0.521 peak=863 ppm1=9.129 ppm2=7.731

assign ( resid 102 and name HB1
  )
       ( resid 102 and name HD22
  ) 3.7 1.9 0.7 volume=0.438 peak=1778 ppm1=2.821 ppm2=7.017

assign ( resid 97 and name HN
  )
       ( resid 103 and name HD2#
  ) 3.7 1.9 0.7 volume=0.444 peak=362 ppm1=8.698 ppm2=0.888

assign ( resid 96 and name HB2
  )
       ( resid 96 and name HB1
  ) 2.7 0.9 0.5 volume=2.993 peak=1135 ppm1=1.056 ppm2=1.317

assign ( resid 104 and name HN
  )
       ( resid 100 and name HA
  ) 3.5 1.7 0.7 volume=0.545 peak=243 ppm1=8.130 ppm2=3.209

assign ( resid 104 and name HG2
  )
       ( resid 105 and name HN
  ) 3.9 2.1 0.8 volume=0.327 peak=2109 ppm1=1.346 ppm2=7.554

assign ( resid 71 and name HD1#
  )
       ( resid 74 and name HN
  ) 4.2 2.4 0.8 volume=0.193 peak=1453 ppm1=0.918 ppm2=6.399

assign ( resid 103 and name HB1
  )
       ( resid 103 and name HA
  ) 3.8 2.0 0.8 volume=0.362 peak=1767 ppm1=1.131 ppm2=3.037

assign ( resid 103 and name HN
  )
       ( resid 102 and name HB1
  ) 3.2 1.4 0.6 volume=1.074 peak=128 ppm1=7.218 ppm2=2.828

assign ( resid 104 and name HA
  )
       ( resid 104 and name HB1
  or resid 104 and name HB2
  ) 2.5 0.7 0.5 volume=4.781 peak=1045 ppm1=3.914 ppm2=1.678

assign ( resid 88 and name HN
  )
       ( resid 87 and name HA
  ) 2.7 0.9 0.5 volume=2.736 peak=2315 ppm1=8.307 ppm2=4.177

assign ( resid 91 and name HN
  )
       ( resid 91 and name HB2
  ) 3.3 1.5 0.7 volume=0.854 peak=748 ppm1=9.395 ppm2=2.013

assign ( resid 82 and name HB1
  )
       ( resid 79 and name HA
  ) 3.7 1.9 0.7 volume=0.413 peak=1244 ppm1=3.015 ppm2=3.452

assign ( resid 103 and name HD2#
  )
       ( resid 103 and name HA
  ) 3.5 1.7 0.7 volume=0.584 peak=1090 ppm1=0.874 ppm2=3.035

assign ( resid 63 and name HG2
  or resid 63 and name HG1
  )
       ( resid 64 and name HN
  ) 4.1 2.3 0.8 volume=0.215 peak=2083 ppm1=2.260 ppm2=8.558

assign ( resid 110 and name HB2
  )
       ( resid 107 and name HA
  ) 4.0 2.2 0.8 volume=0.270 peak=1935 ppm1=3.032 ppm2=3.448

assign ( resid 87 and name HB2
  or resid 87 and name HB1
  )
       ( resid 87 and name HD2
  ) 3.4 1.6 0.7 volume=0.678 peak=2378 ppm1=1.356 ppm2=2.846

assign ( resid 86 and name HA
  )
       ( resid 87 and name HN
  ) 2.9 1.1 0.6 volume=1.833 peak=2364 ppm1=4.103 ppm2=7.710

assign ( resid 65 and name HN
  )
       ( resid 64 and name HG1
  ) 3.5 1.7 0.7 volume=0.580 peak=285 ppm1=7.856 ppm2=1.627

assign ( resid 96 and name HD2#
  )
       ( resid 96 and name HA
  ) 4.7 2.9 0.9 volume=0.099 peak=1259 ppm1=0.686 ppm2=4.769

assign ( resid 93 and name HN
  )
       ( resid 92 and name HN
  ) 2.5 0.7 0.5 volume=4.858 peak=139 ppm1=7.748 ppm2=8.372

assign ( resid 85 and name HA
  )
       ( resid 85 and name HB1
  ) 2.7 0.9 0.5 volume=2.642 peak=1975 ppm1=4.089 ppm2=1.863

assign ( resid 85 and name HG1
  )
       ( resid 85 and name HG2
  ) 1.8 0.0 0.4 volume=26.980 peak=1990 ppm1=2.129 ppm2=2.078

assign ( resid 109 and name HG1#
  )
       ( resid 111 and name HN
  ) 4.5 2.7 0.9 volume=0.123 peak=2168 ppm1=0.306 ppm2=7.584

assign ( resid 107 and name HB2
  )
       ( resid 107 and name HG1
  ) 3.3 1.5 0.7 volume=0.864 peak=1553 ppm1=2.125 ppm2=2.638

assign ( resid 78 and name HN
  )
       ( resid 75 and name HN
  ) 3.6 1.8 0.7 volume=0.503 peak=203 ppm1=7.446 ppm2=7.051

assign ( resid 104 and name HB2
  )
       ( resid 101 and name HA1
  ) 3.3 1.5 0.7 volume=0.792 peak=1691 ppm1=1.675 ppm2=3.576

assign ( resid 69 and name HD1 or resid 69 and name HD2
  )
       ( resid 74 and name HB1
  ) 3.0 1.2 0.6 volume=1.395 peak=91 ppm1=6.909 ppm2=1.274

assign ( resid 65 and name HB2
  )
       ( resid 65 and name HB1
  ) 2.6 0.8 0.5 volume=3.684 peak=1477 ppm1=3.286 ppm2=2.748

assign ( resid 64 and name HG1
  )
       ( resid 64 and name HB2
  ) 3.0 1.2 0.6 volume=1.475 peak=1374 ppm1=1.608 ppm2=1.389

assign ( resid 85 and name HB2
  )
       ( resid 85 and name HA
  ) 3.1 1.3 0.6 volume=1.198 peak=1397 ppm1=1.796 ppm2=4.087

assign ( resid 87 and name HG1
  )
       ( resid 87 and name HD1
  ) 3.0 1.2 0.6 volume=1.400 peak=2350 ppm1=1.128 ppm2=2.933

assign ( resid 64 and name HG1
  )
       ( resid 64 and name HA
  ) 4.6 2.8 0.9 volume=0.114 peak=2032 ppm1=1.608 ppm2=4.116

assign ( resid 69 and name HB2
  )
       ( resid 69 and name HB1
  ) 3.7 1.9 0.7 volume=0.400 peak=2239 ppm1=3.061 ppm2=2.514

assign ( resid 95 and name HN
  )
       ( resid 90 and name HN
  ) 3.5 1.7 0.7 volume=0.609 peak=344 ppm1=7.734 ppm2=9.122

assign ( resid 107 and name HG1
  )
       ( resid 107 and name HA
  ) 3.4 1.6 0.7 volume=0.661 peak=1819 ppm1=2.638 ppm2=3.448

assign ( resid 71 and name HN
  )
       ( resid 71 and name HA
  ) 3.7 1.9 0.7 volume=0.439 peak=471 ppm1=6.741 ppm2=4.867

assign ( resid 64 and name HG1
  )
       ( resid 64 and name HB1
  ) 2.9 1.1 0.6 volume=1.857 peak=2149 ppm1=1.609 ppm2=1.347

assign ( resid 72 and name HG2#
  )
       ( resid 72 and name HA
  ) 3.4 1.6 0.7 volume=0.755 peak=1568 ppm1=0.583 ppm2=3.155

assign ( resid 110 and name HB2
  )
       ( resid 110 and name HD2
  ) 3.3 1.5 0.7 volume=0.784 peak=1306 ppm1=3.031 ppm2=6.606

assign ( resid 63 and name HB2
  )
       ( resid 64 and name HN
  ) 4.4 2.6 0.9 volume=0.157 peak=2033 ppm1=1.948 ppm2=8.558

assign ( resid 89 and name HN
  )
       ( resid 103 and name HD2#
  ) 3.2 1.4 0.6 volume=0.994 peak=438 ppm1=8.393 ppm2=0.897

assign ( resid 96 and name HD2#
  )
       ( resid 89 and name HD1
  ) 3.9 2.1 0.8 volume=0.327 peak=1677 ppm1=0.686 ppm2=2.966

assign ( resid 64 and name HA
  )
       ( resid 64 and name HN
  ) 3.4 1.6 0.7 volume=0.665 peak=929 ppm1=4.124 ppm2=8.556

assign ( resid 109 and name HG1#
  )
       ( resid 109 and name HG2#
  ) 2.3 0.5 0.5 volume=7.045 peak=875 ppm1=0.309 ppm2=0.482

assign ( resid 89 and name HG1
  or resid 89 and name HG2
  )
       ( resid 89 and name HN
  ) 4.0 2.2 0.8 volume=0.277 peak=1000 ppm1=1.096 ppm2=8.384

assign ( resid 66 and name HA1
  )
       ( resid 67 and name HN
  ) 3.5 1.7 0.7 volume=0.543 peak=1376 ppm1=4.096 ppm2=7.831

assign ( resid 107 and name HE22
  )
       ( resid 107 and name HG1
  ) 3.3 1.5 0.7 volume=0.854 peak=197 ppm1=6.929 ppm2=2.640

assign ( resid 106 and name HB1
  )
       ( resid 107 and name HN
  ) 4.0 2.2 0.8 volume=0.252 peak=2236 ppm1=2.587 ppm2=8.027

assign ( resid 60 and name HE1 or resid 60 and name HE2
  )
       ( resid 60 and name HB2
  ) 3.6 1.8 0.7 volume=0.497 peak=4 ppm1=6.758 ppm2=2.625

assign ( resid 74 and name HD1#
  )
       ( resid 74 and name HB1
  ) 2.5 0.7 0.5 volume=4.028 peak=2127 ppm1=1.038 ppm2=1.292

assign ( resid 86 and name HB#
  )
       ( resid 86 and name HN
  ) 3.4 1.6 0.7 volume=0.684 peak=2179 ppm1=1.065 ppm2=8.208

assign ( resid 103 and name HA
  )
       ( resid 103 and name HB2
  ) 3.5 1.7 0.7 volume=0.539 peak=1914 ppm1=3.031 ppm2=1.821

assign ( resid 80 and name HN
  )
       ( resid 78 and name HN
  ) 3.9 2.1 0.8 volume=0.329 peak=573 ppm1=7.090 ppm2=7.439

assign ( resid 103 and name HD2#
  )
       ( resid 104 and name HN
  ) 3.9 2.1 0.8 volume=0.328 peak=1152 ppm1=0.875 ppm2=8.126

assign ( resid 76 and name HB2
  or resid 76 and name HB1
  )
       ( resid 77 and name HN
  ) 3.5 1.7 0.7 volume=0.578 peak=1847 ppm1=2.573 ppm2=7.289

assign ( resid 86 and name HB#
  )
       ( resid 80 and name HE2
  or resid 80 and name HE1
  ) 4.0 2.2 0.8 volume=0.280 peak=986 ppm1=1.069 ppm2=2.819

assign ( resid 69 and name HB1
  )
       ( resid 71 and name HN
  ) 4.0 2.2 0.8 volume=0.253 peak=919 ppm1=2.507 ppm2=6.763

assign ( resid 81 and name HN
  )
       ( resid 78 and name HN
  ) 3.8 2.0 0.8 volume=0.384 peak=629 ppm1=7.618 ppm2=7.450

assign ( resid 103 and name HB2
  )
       ( resid 100 and name HA
  ) 3.6 1.8 0.7 volume=0.479 peak=1172 ppm1=1.821 ppm2=3.204

assign ( resid 77 and name HG
  )
       ( resid 77 and name HD1#
  ) 2.6 0.8 0.5 volume=3.448 peak=1685 ppm1=1.548 ppm2=0.711

assign ( resid 72 and name HG11
  )
       ( resid 72 and name HD1#
  ) 2.6 0.8 0.5 volume=3.101 peak=1680 ppm1=0.707 ppm2=0.552

assign ( resid 71 and name HB1
  )
       ( resid 71 and name HD2#
  ) 3.5 1.7 0.7 volume=0.562 peak=2068 ppm1=1.341 ppm2=0.811

assign ( resid 75 and name HD1#
  )
       ( resid 79 and name HE2
  ) 3.6 1.8 0.7 volume=0.455 peak=1004 ppm1=0.889 ppm2=2.953

assign ( resid 75 and name HN
  )
       ( resid 74 and name HB1
  ) 3.1 1.3 0.6 volume=1.150 peak=456 ppm1=7.048 ppm2=1.301

assign ( resid 92 and name HN
  )
       ( resid 93 and name HA
  ) 3.9 2.1 0.8 volume=0.322 peak=223 ppm1=8.371 ppm2=4.987

assign ( resid 104 and name HB1
  or resid 104 and name HB2
  )
       ( resid 104 and name HA
  ) 2.8 1.0 0.6 volume=2.477 peak=2015 ppm1=1.677 ppm2=3.914

assign ( resid 95 and name HG1
  )
       ( resid 95 and name HN
  ) 3.6 1.8 0.7 volume=0.532 peak=2062 ppm1=1.028 ppm2=7.738

assign ( resid 82 and name HB2
  )
       ( resid 82 and name HE1
  ) 4.2 2.4 0.8 volume=0.190 peak=2092 ppm1=3.155 ppm2=7.854

assign ( resid 72 and name HG12
  )
       ( resid 72 and name HA
  ) 3.9 2.1 0.8 volume=0.284 peak=2190 ppm1=0.778 ppm2=3.154

assign ( resid 76 and name HN
  )
       ( resid 76 and name HB2
  or resid 76 and name HB1
  ) 2.7 0.9 0.5 volume=2.881 peak=520 ppm1=8.459 ppm2=2.563

assign ( resid 73 and name HN
  )
       ( resid 73 and name HA
  ) 3.6 1.8 0.7 volume=0.461 peak=288 ppm1=7.962 ppm2=3.910

assign ( resid 88 and name HB2
  )
       ( resid 103 and name HB2
  ) 4.3 2.5 0.9 volume=0.174 peak=2388 ppm1=2.748 ppm2=1.834

assign ( resid 76 and name HB2
  or resid 76 and name HB1
  )
       ( resid 76 and name HA
  ) 3.9 2.1 0.8 volume=0.310 peak=1731 ppm1=2.566 ppm2=4.201

assign ( resid 72 and name HN
  )
       ( resid 72 and name HA
  ) 3.6 1.8 0.7 volume=0.534 peak=399 ppm1=8.434 ppm2=3.159

assign ( resid 109 and name HN
  )
       ( resid 108 and name HN
  ) 2.9 1.1 0.6 volume=1.914 peak=821 ppm1=7.803 ppm2=6.923

assign ( resid 108 and name HN
  )
       ( resid 107 and name HG2
  ) 3.8 2.0 0.8 volume=0.362 peak=405 ppm1=6.920 ppm2=2.721

assign ( resid 96 and name HD2#
  )
       ( resid 95 and name HN
  ) 4.1 2.3 0.8 volume=0.227 peak=1771 ppm1=0.688 ppm2=7.724

assign ( resid 108 and name HD1#
  )
       ( resid 112 and name HA1
  or resid 112 and name HA2
  ) 3.8 2.0 0.8 volume=0.331 peak=1581 ppm1=0.707 ppm2=3.673

assign ( resid 103 and name HD1#
  )
       ( resid 89 and name HN
  ) 3.8 2.0 0.8 volume=0.338 peak=1520 ppm1=0.808 ppm2=8.395

assign ( resid 109 and name HG1#
  )
       ( resid 109 and name HA
  ) 3.1 1.3 0.6 volume=1.176 peak=2046 ppm1=0.308 ppm2=3.772

assign ( resid 69 and name HN
  )
       ( resid 69 and name HA
  ) 3.2 1.4 0.6 volume=1.076 peak=115 ppm1=8.409 ppm2=4.536

assign ( resid 109 and name HG2#
  )
       ( resid 108 and name HA
  ) 4.0 2.2 0.8 volume=0.278 peak=1157 ppm1=0.487 ppm2=3.936

assign ( resid 78 and name HN
  )
       ( resid 77 and name HA
  ) 3.2 1.4 0.6 volume=1.036 peak=417 ppm1=7.446 ppm2=3.916

assign ( resid 62 and name HN
  )
       ( resid 62 and name HB2
  ) 3.3 1.5 0.7 volume=0.800 peak=162 ppm1=8.874 ppm2=2.661

assign ( resid 85 and name HG2
  )
       ( resid 85 and name HA
  ) 3.5 1.7 0.7 volume=0.568 peak=1361 ppm1=2.076 ppm2=4.070

assign ( resid 71 and name HB2
  )
       ( resid 74 and name HD1#
  ) 4.1 2.3 0.8 volume=0.215 peak=1382 ppm1=1.647 ppm2=1.065

assign ( resid 104 and name HA
  )
       ( resid 107 and name HB1
  ) 3.2 1.4 0.6 volume=0.980 peak=2069 ppm1=3.914 ppm2=2.072

assign ( resid 106 and name HN
  )
       ( resid 105 and name HA
  ) 3.1 1.3 0.6 volume=1.177 peak=279 ppm1=7.303 ppm2=3.869

assign ( resid 86 and name HN
  )
       ( resid 87 and name HN
  ) 3.5 1.7 0.7 volume=0.546 peak=2368 ppm1=8.195 ppm2=7.737

assign ( resid 76 and name HA
  )
       ( resid 79 and name HB2
  or resid 79 and name HB1
  ) 3.2 1.4 0.6 volume=1.026 peak=1405 ppm1=4.198 ppm2=1.819

assign ( resid 107 and name HG2
  )
       ( resid 103 and name HG
  ) 3.7 1.9 0.7 volume=0.407 peak=1831 ppm1=2.697 ppm2=1.306

assign ( resid 100 and name HB2
  )
       ( resid 88 and name HD1 or resid 88 and name HD2
  ) 4.4 2.6 0.9 volume=0.151 peak=1099 ppm1=3.531 ppm2=6.803

assign ( resid 67 and name HN
  )
       ( resid 67 and name HA
  ) 3.1 1.3 0.6 volume=1.310 peak=713 ppm1=7.832 ppm2=3.898

assign ( resid 77 and name HD2#
  )
       ( resid 77 and name HN
  ) 3.5 1.7 0.7 volume=0.573 peak=1938 ppm1=0.735 ppm2=7.291

assign ( resid 102 and name HA
  )
       ( resid 102 and name HN
  ) 4.8 3.0 1.0 volume=0.090 peak=1631 ppm1=4.332 ppm2=7.871

assign ( resid 60 and name HB1
  )
       ( resid 75 and name HB1
  ) 3.8 2.0 0.8 volume=0.372 peak=1035 ppm1=2.851 ppm2=1.852

assign ( resid 96 and name HN
  )
       ( resid 96 and name HA
  ) 3.2 1.4 0.6 volume=0.946 peak=644 ppm1=7.584 ppm2=4.744

assign ( resid 106 and name HB2
  )
       ( resid 103 and name HD1#
  ) 3.6 1.8 0.7 volume=0.481 peak=1536 ppm1=2.813 ppm2=0.817

assign ( resid 80 and name HN
  )
       ( resid 80 and name HA
  ) 2.8 1.0 0.6 volume=2.157 peak=829 ppm1=7.094 ppm2=3.943

assign ( resid 103 and name HD1#
  )
       ( resid 107 and name HB2
  ) 3.9 2.1 0.8 volume=0.322 peak=1936 ppm1=0.807 ppm2=2.148

assign ( resid 93 and name HB2
  )
       ( resid 93 and name HN
  ) 3.5 1.7 0.7 volume=0.553 peak=1964 ppm1=2.750 ppm2=7.746

assign ( resid 99 and name HG2#
  )
       ( resid 99 and name HB
  ) 3.3 1.5 0.7 volume=0.763 peak=1083 ppm1=1.080 ppm2=4.306

assign ( resid 104 and name HG1
  )
       ( resid 104 and name HG2
  ) 2.0 0.2 0.4 volume=18.646 peak=1686 ppm1=1.264 ppm2=1.342

assign ( resid 89 and name HB2
  )
       ( resid 89 and name HA
  ) 4.6 2.8 0.9 volume=0.109 peak=1549 ppm1=1.300 ppm2=4.852

assign ( resid 107 and name HB1
  )
       ( resid 107 and name HE21
  ) 4.5 2.7 0.9 volume=0.130 peak=1423 ppm1=2.050 ppm2=7.507

assign ( resid 78 and name HB2
  )
       ( resid 75 and name HD2#
  or resid 75 and name HD1#
  ) 3.9 2.1 0.8 volume=0.286 peak=1351 ppm1=3.214 ppm2=0.884

assign ( resid 61 and name HA2
  )
       ( resid 75 and name HD2#
  or resid 75 and name HD1#
  ) 4.2 2.4 0.8 volume=0.187 peak=2126 ppm1=3.417 ppm2=0.871

assign ( resid 109 and name HN
  )
       ( resid 108 and name HA
  ) 3.2 1.4 0.6 volume=1.081 peak=730 ppm1=7.805 ppm2=3.946

assign ( resid 95 and name HB2
  )
       ( resid 90 and name HB1
  ) 4.0 2.2 0.8 volume=0.268 peak=1780 ppm1=1.186 ppm2=3.260

assign ( resid 108 and name HD1#
  )
       ( resid 107 and name HG1
  ) 3.6 1.8 0.7 volume=0.465 peak=1815 ppm1=0.707 ppm2=2.634

assign ( resid 103 and name HD2#
  )
       ( resid 100 and name HA
  ) 3.6 1.8 0.7 volume=0.503 peak=1954 ppm1=0.877 ppm2=3.209

assign ( resid 64 and name HG1
  )
       ( resid 64 and name HN
  ) 3.8 2.0 0.8 volume=0.340 peak=1849 ppm1=1.601 ppm2=8.557

assign ( resid 69 and name HE1 or resid 69 and name HE2
  )
       ( resid 74 and name HA
  ) 4.0 2.2 0.8 volume=0.278 peak=62 ppm1=6.134 ppm2=3.943

assign ( resid 98 and name HG2#
  )
       ( resid 85 and name HB2
  ) 4.1 2.3 0.8 volume=0.241 peak=1854 ppm1=1.134 ppm2=1.791

assign ( resid 68 and name HN
  )
       ( resid 67 and name HA
  ) 2.6 0.8 0.5 volume=3.548 peak=651 ppm1=7.667 ppm2=3.942

assign ( resid 59 and name HB2
  )
       ( resid 59 and name HD2
  ) 3.9 2.1 0.8 volume=0.294 peak=1138 ppm1=0.976 ppm2=3.430

assign ( resid 77 and name HN
  )
       ( resid 76 and name HA
  ) 3.5 1.7 0.7 volume=0.616 peak=512 ppm1=7.293 ppm2=4.195

assign ( resid 105 and name HA
  )
       ( resid 105 and name HN
  ) 2.8 1.0 0.6 volume=2.429 peak=1901 ppm1=3.844 ppm2=7.553

assign ( resid 66 and name HN
  )
       ( resid 64 and name HN
  ) 4.0 2.2 0.8 volume=0.271 peak=402 ppm1=8.123 ppm2=8.562

assign ( resid 105 and name HA
  )
       ( resid 105 and name HB2
  or resid 105 and name HB1
  ) 2.5 0.7 0.5 volume=3.947 peak=1303 ppm1=3.846 ppm2=1.672

assign ( resid 110 and name HD2
  )
       ( resid 109 and name HG2#
  ) 3.5 1.7 0.7 volume=0.551 peak=74 ppm1=6.609 ppm2=0.485

assign ( resid 103 and name HD1#
  )
       ( resid 103 and name HN
  ) 3.6 1.8 0.7 volume=0.464 peak=1480 ppm1=0.808 ppm2=7.255

assign ( resid 103 and name HB2
  )
       ( resid 103 and name HG
  ) 3.1 1.3 0.6 volume=1.166 peak=1579 ppm1=1.823 ppm2=1.299

assign ( resid 107 and name HB2
  )
       ( resid 103 and name HD1#
  ) 4.1 2.3 0.8 volume=0.228 peak=1727 ppm1=2.125 ppm2=0.823

assign ( resid 74 and name HD2#
  )
       ( resid 69 and name HD1 or resid 69 and name HD2
  ) 3.7 1.9 0.7 volume=0.392 peak=1647 ppm1=0.769 ppm2=6.892

assign ( resid 74 and name HD1#
  )
       ( resid 69 and name HB2
  ) 4.1 2.3 0.8 volume=0.228 peak=2193 ppm1=1.043 ppm2=3.062

assign ( resid 102 and name HA
  )
       ( resid 105 and name HB2
  or resid 105 and name HB1
  ) 3.6 1.8 0.7 volume=0.491 peak=1678 ppm1=4.335 ppm2=1.666

assign ( resid 67 and name HA
  )
       ( resid 68 and name HN
  ) 2.9 1.1 0.6 volume=1.922 peak=1842 ppm1=3.951 ppm2=7.668

assign ( resid 64 and name HA
  )
       ( resid 64 and name HB2
  ) 3.5 1.7 0.7 volume=0.542 peak=1796 ppm1=4.122 ppm2=1.388

assign ( resid 62 and name HN
  )
       ( resid 62 and name HB1
  ) 3.2 1.4 0.6 volume=0.913 peak=820 ppm1=8.875 ppm2=3.239

assign ( resid 105 and name HG1
  )
       ( resid 105 and name HB2
  ) 2.2 0.4 0.4 volume=9.846 peak=2231 ppm1=1.446 ppm2=1.658

assign ( resid 86 and name HN
  )
       ( resid 85 and name HB1
  ) 3.5 1.7 0.7 volume=0.571 peak=167 ppm1=8.204 ppm2=1.876

assign ( resid 91 and name HG2
  )
       ( resid 91 and name HN
  ) 4.2 2.4 0.8 volume=0.201 peak=1145 ppm1=2.214 ppm2=9.402

assign ( resid 61 and name HN
  )
       ( resid 60 and name HB1
  ) 3.7 1.9 0.7 volume=0.454 peak=439 ppm1=8.403 ppm2=2.836

assign ( resid 76 and name HN
  )
       ( resid 75 and name HD2#
  or resid 75 and name HD1#
  ) 3.1 1.3 0.6 volume=1.157 peak=622 ppm1=8.456 ppm2=0.871

assign ( resid 80 and name HB2
  or resid 80 and name HB1
  )
       ( resid 80 and name HD2
  or resid 80 and name HD1
  ) 2.4 0.6 0.5 volume=6.244 peak=2108 ppm1=1.720 ppm2=1.526

assign ( resid 71 and name HB1
  )
       ( resid 71 and name HD1#
  ) 3.7 1.9 0.7 volume=0.446 peak=1602 ppm1=1.341 ppm2=0.917

assign ( resid 107 and name HA
  )
       ( resid 107 and name HN
  ) 3.4 1.6 0.7 volume=0.713 peak=925 ppm1=3.454 ppm2=8.030

assign ( resid 106 and name HN
  )
       ( resid 102 and name HA
  ) 3.7 1.9 0.7 volume=0.431 peak=392 ppm1=7.305 ppm2=4.325

assign ( resid 74 and name HN
  )
       ( resid 74 and name HB1
  ) 3.0 1.2 0.6 volume=1.401 peak=155 ppm1=6.394 ppm2=1.319

assign ( resid 78 and name HB2
  )
       ( resid 78 and name HA
  ) 3.9 2.1 0.8 volume=0.295 peak=1375 ppm1=3.198 ppm2=3.991

assign ( resid 109 and name HA
  )
       ( resid 109 and name HG2#
  ) 2.6 0.8 0.5 volume=3.326 peak=1038 ppm1=3.775 ppm2=0.495

assign ( resid 102 and name HB2
  )
       ( resid 102 and name HN
  ) 4.7 2.9 0.9 volume=0.098 peak=1501 ppm1=2.707 ppm2=7.859

assign ( resid 84 and name HA2
  or resid 84 and name HA1
  )
       ( resid 85 and name HN
  ) 3.5 1.7 0.7 volume=0.588 peak=1066 ppm1=3.856 ppm2=7.941

assign ( resid 85 and name HN
  )
       ( resid 86 and name HN
  ) 3.4 1.6 0.7 volume=0.725 peak=113 ppm1=7.945 ppm2=8.201

assign ( resid 94 and name HN
  )
       ( resid 91 and name HN
  ) 4.3 2.5 0.9 volume=0.167 peak=168 ppm1=8.290 ppm2=9.393

assign ( resid 81 and name HN
  )
       ( resid 80 and name HN
  ) 2.8 1.0 0.6 volume=2.316 peak=395 ppm1=7.623 ppm2=7.092

assign ( resid 75 and name HD2#
  )
       ( resid 79 and name HE1
  ) 3.6 1.8 0.7 volume=0.500 peak=2230 ppm1=0.848 ppm2=3.088

assign ( resid 100 and name HB1
  )
       ( resid 100 and name HA
  ) 3.3 1.5 0.7 volume=0.891 peak=1111 ppm1=3.372 ppm2=3.217

assign ( resid 87 and name HG1
  )
       ( resid 87 and name HN
  ) 3.5 1.7 0.7 volume=0.573 peak=2325 ppm1=1.133 ppm2=7.709

assign ( resid 70 and name HN
  )
       ( resid 70 and name HA
  ) 4.3 2.5 0.9 volume=0.165 peak=580 ppm1=9.254 ppm2=4.332

assign ( resid 108 and name HD2#
  )
       ( resid 108 and name HN
  ) 3.5 1.7 0.7 volume=0.607 peak=1886 ppm1=0.795 ppm2=6.924

assign ( resid 111 and name HN
  )
       ( resid 112 and name HN
  ) 3.1 1.3 0.6 volume=1.316 peak=355 ppm1=7.587 ppm2=7.850

assign ( resid 72 and name HN
  )
       ( resid 72 and name HG11
  ) 3.4 1.6 0.7 volume=0.706 peak=630 ppm1=8.442 ppm2=0.742

assign ( resid 77 and name HD2#
  )
       ( resid 80 and name HE2
  or resid 80 and name HE1
  ) 3.5 1.7 0.7 volume=0.605 peak=1465 ppm1=0.735 ppm2=2.824

assign ( resid 70 and name HN
  )
       ( resid 70 and name HB2
  ) 3.7 1.9 0.7 volume=0.393 peak=805 ppm1=9.256 ppm2=1.818

assign ( resid 69 and name HN
  )
       ( resid 75 and name HD1#
  ) 3.3 1.5 0.7 volume=0.770 peak=672 ppm1=8.414 ppm2=0.909

assign ( resid 105 and name HG1
  )
       ( resid 105 and name HN
  ) 3.3 1.5 0.7 volume=0.876 peak=954 ppm1=1.442 ppm2=7.550

assign ( resid 96 and name HB1
  )
       ( resid 96 and name HD2#
  ) 3.1 1.3 0.6 volume=1.115 peak=1339 ppm1=1.315 ppm2=0.686

assign ( resid 107 and name HG1
  )
       ( resid 107 and name HB2
  ) 3.3 1.5 0.7 volume=0.823 peak=1609 ppm1=2.641 ppm2=2.125

assign ( resid 76 and name HN
  )
       ( resid 77 and name HN
  ) 3.0 1.2 0.6 volume=1.407 peak=359 ppm1=8.458 ppm2=7.295

assign ( resid 107 and name HG1
  )
       ( resid 107 and name HG2
  ) 2.4 0.6 0.5 volume=5.798 peak=2018 ppm1=2.640 ppm2=2.695

assign ( resid 72 and name HG12
  )
       ( resid 60 and name HD1 or resid 60 and name HD2
  ) 4.3 2.5 0.9 volume=0.180 peak=1538 ppm1=0.775 ppm2=6.824

assign ( resid 91 and name HN
  )
       ( resid 91 and name HG2
  ) 3.2 1.4 0.6 volume=1.032 peak=304 ppm1=9.400 ppm2=2.217

assign ( resid 107 and name HA
  )
       ( resid 110 and name HN
  ) 3.7 1.9 0.7 volume=0.401 peak=2094 ppm1=3.460 ppm2=7.119

assign ( resid 74 and name HN
  )
       ( resid 74 and name HD1#
  ) 3.3 1.5 0.7 volume=0.909 peak=489 ppm1=6.393 ppm2=1.043

assign ( resid 88 and name HB1
  )
       ( resid 88 and name HD1 or resid 88 and name HD2
  ) 3.1 1.3 0.6 volume=1.175 peak=2359 ppm1=2.630 ppm2=6.817

assign ( resid 76 and name HN
  )
       ( resid 78 and name HN
  ) 4.0 2.2 0.8 volume=0.273 peak=541 ppm1=8.457 ppm2=7.476

assign ( resid 107 and name HA
  )
       ( resid 108 and name HN
  ) 3.9 2.1 0.8 volume=0.290 peak=1028 ppm1=3.456 ppm2=6.922

assign ( resid 77 and name HN
  )
       ( resid 78 and name HN
  ) 2.9 1.1 0.6 volume=1.665 peak=777 ppm1=7.291 ppm2=7.447

assign ( resid 105 and name HN
  )
       ( resid 102 and name HA
  ) 3.1 1.3 0.6 volume=1.297 peak=823 ppm1=7.547 ppm2=4.329

assign ( resid 109 and name HN
  )
       ( resid 108 and name HB1
  ) 3.1 1.3 0.6 volume=1.244 peak=440 ppm1=7.808 ppm2=1.598

assign ( resid 68 and name HN
  )
       ( resid 68 and name HB2
  ) 3.3 1.5 0.7 volume=0.771 peak=490 ppm1=7.670 ppm2=3.324

assign ( resid 64 and name HN
  )
       ( resid 65 and name HN
  ) 2.8 1.0 0.6 volume=2.024 peak=792 ppm1=8.555 ppm2=7.847

assign ( resid 81 and name HN
  )
       ( resid 81 and name HA
  ) 2.8 1.0 0.6 volume=2.440 peak=816 ppm1=7.624 ppm2=3.938

assign ( resid 108 and name HB2
  )
       ( resid 108 and name HB1
  ) 2.6 0.8 0.5 volume=3.442 peak=1473 ppm1=1.353 ppm2=1.590

assign ( resid 68 and name HB2
  )
       ( resid 68 and name HN
  ) 3.9 2.1 0.8 volume=0.313 peak=1117 ppm1=3.338 ppm2=7.669

assign ( resid 108 and name HN
  )
       ( resid 108 and name HA
  ) 2.8 1.0 0.6 volume=2.434 peak=714 ppm1=6.917 ppm2=3.963

assign ( resid 70 and name HG2
  or resid 70 and name HG1
  )
       ( resid 71 and name HD1#
  ) 3.4 1.6 0.7 volume=0.665 peak=1666 ppm1=1.671 ppm2=0.930

assign ( resid 109 and name HG2#
  )
       ( resid 106 and name HB2
  ) 4.5 2.7 0.9 volume=0.130 peak=1965 ppm1=0.487 ppm2=2.788

assign ( resid 77 and name HD2#
  )
       ( resid 77 and name HB2
  ) 2.4 0.6 0.5 volume=5.966 peak=1822 ppm1=0.735 ppm2=1.561

assign ( resid 93 and name HN
  )
       ( resid 91 and name HN
  ) 3.8 2.0 0.8 volume=0.342 peak=525 ppm1=7.739 ppm2=9.403

assign ( resid 82 and name HD2
  )
       ( resid 82 and name HB2
  ) 3.1 1.3 0.6 volume=1.289 peak=48 ppm1=6.605 ppm2=3.153

assign ( resid 79 and name HE2
  )
       ( resid 79 and name HN
  ) 4.4 2.6 0.9 volume=0.138 peak=1053 ppm1=2.960 ppm2=8.416

assign ( resid 97 and name HN
  )
       ( resid 96 and name HB1
  ) 3.2 1.4 0.6 volume=0.964 peak=297 ppm1=8.696 ppm2=1.343

assign ( resid 105 and name HB2
  or resid 105 and name HB1
  )
       ( resid 105 and name HA
  ) 2.9 1.1 0.6 volume=1.768 peak=1825 ppm1=1.669 ppm2=3.845

assign ( resid 89 and name HB2
  )
       ( resid 89 and name HG1
  or resid 89 and name HG2
  ) 2.7 0.9 0.5 volume=2.613 peak=1832 ppm1=1.284 ppm2=1.095

assign ( resid 64 and name HB1
  )
       ( resid 64 and name HA
  ) 3.7 1.9 0.7 volume=0.391 peak=1618 ppm1=1.349 ppm2=4.113

assign ( resid 64 and name HG2
  )
       ( resid 65 and name HN
  ) 4.1 2.3 0.8 volume=0.225 peak=1212 ppm1=1.757 ppm2=7.875

assign ( resid 71 and name HD2#
  )
       ( resid 74 and name HD1#
  ) 2.8 1.0 0.6 volume=2.283 peak=1937 ppm1=0.807 ppm2=1.053

assign ( resid 61 and name HN
  )
       ( resid 61 and name HA2
  ) 2.9 1.1 0.6 volume=1.842 peak=176 ppm1=8.397 ppm2=3.422

assign ( resid 79 and name HB2
  or resid 79 and name HB1
  )
       ( resid 76 and name HA
  ) 3.8 2.0 0.8 volume=0.377 peak=1016 ppm1=1.816 ppm2=4.180

assign ( resid 97 and name HB2
  )
       ( resid 99 and name HG2#
  ) 3.8 2.0 0.8 volume=0.363 peak=1895 ppm1=3.112 ppm2=1.091

assign ( resid 78 and name HN
  )
       ( resid 78 and name HB1
  ) 3.0 1.2 0.6 volume=1.578 peak=558 ppm1=7.446 ppm2=2.848

assign ( resid 109 and name HA
  )
       ( resid 109 and name HN
  ) 3.1 1.3 0.6 volume=1.330 peak=1424 ppm1=3.774 ppm2=7.809

assign ( resid 75 and name HD1#
  )
       ( resid 69 and name HB2
  ) 3.5 1.7 0.7 volume=0.568 peak=920 ppm1=0.889 ppm2=3.076

assign ( resid 64 and name HN
  )
       ( resid 64 and name HA
  ) 3.0 1.2 0.6 volume=1.595 peak=265 ppm1=8.555 ppm2=4.128

assign ( resid 69 and name HB1
  )
       ( resid 69 and name HN
  ) 4.4 2.6 0.9 volume=0.157 peak=1497 ppm1=2.508 ppm2=8.426

assign ( resid 108 and name HD2#
  )
       ( resid 108 and name HB2
  ) 2.7 0.9 0.5 volume=2.569 peak=2194 ppm1=0.800 ppm2=1.367

assign ( resid 71 and name HD2#
  )
       ( resid 72 and name HN
  ) 4.1 2.3 0.8 volume=0.240 peak=1084 ppm1=0.808 ppm2=8.463

assign ( resid 79 and name HN
  )
       ( resid 80 and name HN
  ) 3.2 1.4 0.6 volume=1.098 peak=762 ppm1=8.418 ppm2=7.095

assign ( resid 62 and name HN
  )
       ( resid 61 and name HA2
  ) 3.1 1.3 0.6 volume=1.233 peak=239 ppm1=8.876 ppm2=3.420

assign ( resid 107 and name HA
  )
       ( resid 106 and name HD2
  ) 3.2 1.4 0.6 volume=1.019 peak=1550 ppm1=3.455 ppm2=6.680

assign ( resid 103 and name HD2#
  )
       ( resid 103 and name HN
  ) 3.7 1.9 0.7 volume=0.394 peak=2079 ppm1=0.880 ppm2=7.222

assign ( resid 87 and name HN
  )
       ( resid 97 and name HN
  ) 4.2 2.4 0.8 volume=0.195 peak=2357 ppm1=7.708 ppm2=8.700

assign ( resid 109 and name HB
  )
       ( resid 109 and name HG2#
  ) 2.6 0.8 0.5 volume=3.356 peak=870 ppm1=1.783 ppm2=0.481

assign ( resid 96 and name HD1#
  )
       ( resid 89 and name HA
  ) 3.8 2.0 0.8 volume=0.337 peak=1433 ppm1=0.562 ppm2=4.852

assign ( resid 90 and name HB2
  )
       ( resid 90 and name HN
  ) 3.7 1.9 0.7 volume=0.431 peak=1263 ppm1=2.731 ppm2=9.133

assign ( resid 107 and name HA
  )
       ( resid 109 and name HN
  ) 4.0 2.2 0.8 volume=0.253 peak=1791 ppm1=3.455 ppm2=7.815

assign ( resid 65 and name HA
  )
       ( resid 65 and name HN
  ) 3.3 1.5 0.7 volume=0.853 peak=995 ppm1=4.999 ppm2=7.858

assign ( resid 70 and name HN
  )
       ( resid 70 and name HG1
  ) 4.0 2.2 0.8 volume=0.282 peak=183 ppm1=9.257 ppm2=1.671

assign ( resid 103 and name HB2
  )
       ( resid 103 and name HA
  ) 4.0 2.2 0.8 volume=0.259 peak=1766 ppm1=1.826 ppm2=3.034

assign ( resid 75 and name HB1
  )
       ( resid 72 and name HA
  ) 3.7 1.9 0.7 volume=0.393 peak=1591 ppm1=1.858 ppm2=3.174

assign ( resid 88 and name HD1 or resid 88 and name HD2
  )
       ( resid 103 and name HD2#
  ) 2.6 0.8 0.5 volume=3.187 peak=90 ppm1=6.815 ppm2=0.875

assign ( resid 108 and name HN
  )
       ( resid 107 and name HG1
  ) 3.7 1.9 0.7 volume=0.426 peak=652 ppm1=6.917 ppm2=2.653

assign ( resid 108 and name HB1
  )
       ( resid 108 and name HG
  ) 2.9 1.1 0.6 volume=1.760 peak=1141 ppm1=1.578 ppm2=1.696

assign ( resid 87 and name HB2
  or resid 87 and name HB1
  )
       ( resid 87 and name HD1
  ) 3.4 1.6 0.7 volume=0.660 peak=2335 ppm1=1.358 ppm2=2.933

assign ( resid 75 and name HA
  )
       ( resid 79 and name HN
  ) 4.0 2.2 0.8 volume=0.257 peak=1245 ppm1=3.467 ppm2=8.433

assign ( resid 68 and name HB1
  )
       ( resid 68 and name HN
  ) 3.8 2.0 0.8 volume=0.365 peak=2072 ppm1=3.494 ppm2=7.673

assign ( resid 78 and name HD2
  )
       ( resid 62 and name HB1
  ) 3.4 1.6 0.7 volume=0.747 peak=105 ppm1=6.723 ppm2=3.221

assign ( resid 71 and name HD1#
  )
       ( resid 71 and name HB1
  ) 2.9 1.1 0.6 volume=1.825 peak=1183 ppm1=0.917 ppm2=1.331

assign ( resid 71 and name HB2
  )
       ( resid 71 and name HD1#
  ) 3.4 1.6 0.7 volume=0.732 peak=1693 ppm1=1.651 ppm2=0.916

assign ( resid 97 and name HE1 or resid 97 and name HE2
  )
       ( resid 90 and name HB2
  ) 2.9 1.1 0.6 volume=1.927 peak=51 ppm1=6.678 ppm2=2.731

assign ( resid 70 and name HG2
  or resid 70 and name HG1
  )
       ( resid 70 and name HA
  ) 4.1 2.3 0.8 volume=0.216 peak=1578 ppm1=1.663 ppm2=4.325

assign ( resid 71 and name HN
  )
       ( resid 74 and name HB1
  ) 3.3 1.5 0.7 volume=0.862 peak=245 ppm1=6.742 ppm2=1.300

assign ( resid 89 and name HG1
  or resid 89 and name HG2
  )
       ( resid 89 and name HD2
  ) 2.9 1.1 0.6 volume=1.803 peak=1162 ppm1=1.099 ppm2=2.928

assign ( resid 64 and name HG2
  )
       ( resid 64 and name HA
  ) 4.3 2.5 0.9 volume=0.166 peak=1498 ppm1=1.758 ppm2=4.126

assign ( resid 66 and name HA1
  )
       ( resid 66 and name HA2
  ) 3.1 1.3 0.6 volume=1.252 peak=1221 ppm1=4.096 ppm2=3.676

assign ( resid 71 and name HB2
  )
       ( resid 71 and name HG
  ) 3.8 2.0 0.8 volume=0.381 peak=921 ppm1=1.648 ppm2=1.471

assign ( resid 88 and name HN
  )
       ( resid 96 and name HD1#
  ) 4.1 2.3 0.8 volume=0.231 peak=536 ppm1=8.309 ppm2=0.580

assign ( resid 75 and name HD1#
  )
       ( resid 69 and name HB1
  ) 4.0 2.2 0.8 volume=0.263 peak=955 ppm1=0.891 ppm2=2.515

assign ( resid 95 and name HG2
  )
       ( resid 95 and name HN
  ) 3.4 1.6 0.7 volume=0.706 peak=893 ppm1=1.426 ppm2=7.739

assign ( resid 109 and name HG2#
  )
       ( resid 109 and name HA
  ) 2.8 1.0 0.6 volume=2.053 peak=1268 ppm1=0.487 ppm2=3.770

assign ( resid 107 and name HN
  )
       ( resid 108 and name HN
  ) 2.9 1.1 0.6 volume=1.652 peak=148 ppm1=8.028 ppm2=6.919

assign ( resid 104 and name HN
  )
       ( resid 105 and name HN
  ) 2.9 1.1 0.6 volume=1.657 peak=496 ppm1=8.128 ppm2=7.544

assign ( resid 76 and name HD21
  )
       ( resid 76 and name HA
  ) 4.1 2.3 0.8 volume=0.216 peak=190 ppm1=7.308 ppm2=4.196

assign ( resid 97 and name HZ
  )
       ( resid 106 and name HB2
  ) 4.0 2.2 0.8 volume=0.278 peak=96 ppm1=5.921 ppm2=2.828

assign ( resid 97 and name HN
  )
       ( resid 88 and name HB2
  ) 3.4 1.6 0.7 volume=0.672 peak=387 ppm1=8.697 ppm2=2.768

assign ( resid 71 and name HD2#
  )
       ( resid 71 and name HD1#
  ) 2.1 0.3 0.4 volume=12.174 peak=1032 ppm1=0.806 ppm2=0.917

assign ( resid 74 and name HD2#
  )
       ( resid 69 and name HB1
  ) 4.0 2.2 0.8 volume=0.267 peak=1146 ppm1=0.764 ppm2=2.519

assign ( resid 105 and name HA
  )
       ( resid 108 and name HD2#
  ) 3.0 1.2 0.6 volume=1.337 peak=1507 ppm1=3.844 ppm2=0.793

assign ( resid 103 and name HD1#
  )
       ( resid 103 and name HG
  ) 2.7 0.9 0.5 volume=2.709 peak=1877 ppm1=0.808 ppm2=1.303

assign ( resid 86 and name HB#
  )
       ( resid 80 and name HB2
  or resid 80 and name HB1
  ) 3.9 2.1 0.8 volume=0.307 peak=1168 ppm1=1.068 ppm2=1.713

assign ( resid 76 and name HA
  )
       ( resid 76 and name HN
  ) 3.4 1.6 0.7 volume=0.719 peak=2280 ppm1=4.200 ppm2=8.438

assign ( resid 96 and name HD2#
  )
       ( resid 95 and name HA
  ) 4.0 2.2 0.8 volume=0.264 peak=1227 ppm1=0.686 ppm2=3.830

assign ( resid 74 and name HB1
  )
       ( resid 74 and name HA
  ) 3.8 2.0 0.8 volume=0.337 peak=1758 ppm1=1.287 ppm2=3.932

assign ( resid 109 and name HN
  )
       ( resid 107 and name HA
  ) 3.4 1.6 0.7 volume=0.683 peak=435 ppm1=7.807 ppm2=3.453

assign ( resid 95 and name HG1
  )
       ( resid 95 and name HE2
  or resid 95 and name HE1
  ) 3.3 1.5 0.7 volume=0.839 peak=1391 ppm1=1.028 ppm2=2.830

assign ( resid 110 and name HE1
  )
       ( resid 93 and name HB2
  ) 2.9 1.1 0.6 volume=1.975 peak=34 ppm1=7.857 ppm2=2.753

assign ( resid 97 and name HD1 or resid 97 and name HD2
  )
       ( resid 97 and name HN
  ) 3.2 1.4 0.6 volume=0.987 peak=63 ppm1=7.102 ppm2=8.705

assign ( resid 105 and name HN
  )
       ( resid 105 and name HD2
  or resid 105 and name HD1
  ) 3.3 1.5 0.7 volume=0.816 peak=147 ppm1=7.546 ppm2=3.041

assign ( resid 69 and name HD1 or resid 69 and name HD2
  )
       ( resid 69 and name HB1
  ) 3.1 1.3 0.6 volume=1.131 peak=73 ppm1=6.906 ppm2=2.517

assign ( resid 103 and name HN
  )
       ( resid 104 and name HB1
  or resid 104 and name HB2
  ) 3.3 1.5 0.7 volume=0.826 peak=200 ppm1=7.218 ppm2=1.663

assign ( resid 91 and name HB2
  )
       ( resid 91 and name HN
  ) 3.9 2.1 0.8 volume=0.287 peak=1874 ppm1=1.993 ppm2=9.400

assign ( resid 100 and name HA
  )
       ( resid 88 and name HE1 or resid 88 and name HE2
  ) 4.1 2.3 0.8 volume=0.242 peak=1915 ppm1=3.210 ppm2=6.668

assign ( resid 63 and name HB1
  )
       ( resid 64 and name HN
  ) 4.3 2.5 0.9 volume=0.169 peak=1113 ppm1=1.998 ppm2=8.552

assign ( resid 71 and name HD1#
  )
       ( resid 71 and name HB2
  ) 2.8 1.0 0.6 volume=2.128 peak=1131 ppm1=0.919 ppm2=1.648

assign ( resid 95 and name HB2
  )
       ( resid 95 and name HN
  ) 3.2 1.4 0.6 volume=1.036 peak=1155 ppm1=1.183 ppm2=7.742

assign ( resid 87 and name HN
  )
       ( resid 86 and name HA
  ) 2.5 0.7 0.5 volume=4.817 peak=2376 ppm1=7.708 ppm2=4.107

assign ( resid 78 and name HN
  )
       ( resid 81 and name HN
  ) 3.5 1.7 0.7 volume=0.577 peak=813 ppm1=7.443 ppm2=7.623

assign ( resid 110 and name HN
  )
       ( resid 107 and name HA
  ) 3.3 1.5 0.7 volume=0.875 peak=677 ppm1=7.114 ppm2=3.449

assign ( resid 85 and name HG1
  )
       ( resid 85 and name HB2
  ) 2.5 0.7 0.5 volume=4.330 peak=1515 ppm1=2.123 ppm2=1.791

assign ( resid 105 and name HD2
  or resid 105 and name HD1
  )
       ( resid 105 and name HN
  ) 3.9 2.1 0.8 volume=0.313 peak=1468 ppm1=3.053 ppm2=7.548

assign ( resid 64 and name HG2
  )
       ( resid 64 and name HG1
  ) 2.7 0.9 0.5 volume=2.665 peak=1235 ppm1=1.760 ppm2=1.605

assign ( resid 74 and name HB2
  )
       ( resid 74 and name HB1
  ) 3.5 1.7 0.7 volume=0.629 peak=938 ppm1=1.751 ppm2=1.286

assign ( resid 91 and name HG1
  )
       ( resid 91 and name HB2
  ) 2.3 0.5 0.5 volume=8.101 peak=1764 ppm1=2.259 ppm2=1.998

assign ( resid 109 and name HN
  )
       ( resid 106 and name HN
  ) 4.1 2.3 0.8 volume=0.223 peak=741 ppm1=7.802 ppm2=7.332

assign ( resid 72 and name HG2#
  )
       ( resid 73 and name HA
  ) 3.9 2.1 0.8 volume=0.311 peak=1661 ppm1=0.581 ppm2=3.916

assign ( resid 92 and name HN
  )
       ( resid 90 and name HB2
  ) 3.4 1.6 0.7 volume=0.759 peak=413 ppm1=8.364 ppm2=2.733

assign ( resid 106 and name HB1
  )
       ( resid 106 and name HN
  ) 3.3 1.5 0.7 volume=0.819 peak=2014 ppm1=2.583 ppm2=7.306

assign ( resid 84 and name HA2
  or resid 84 and name HA1
  )
       ( resid 85 and name HG2
  or resid 85 and name HG1
  ) 4.0 2.2 0.8 volume=0.264 peak=1539 ppm1=3.846 ppm2=2.105

assign ( resid 95 and name HN
  )
       ( resid 95 and name HB2
  ) 2.6 0.8 0.5 volume=3.259 peak=306 ppm1=7.737 ppm2=1.214

assign ( resid 69 and name HN
  )
       ( resid 60 and name HB1
  ) 3.5 1.7 0.7 volume=0.615 peak=272 ppm1=8.409 ppm2=2.840

assign ( resid 60 and name HB1
  )
       ( resid 60 and name HD1 or resid 60 and name HD2
  ) 3.5 1.7 0.7 volume=0.546 peak=1800 ppm1=2.839 ppm2=6.824

assign ( resid 108 and name HA
  )
       ( resid 108 and name HG
  ) 2.6 0.8 0.5 volume=3.510 peak=1999 ppm1=3.946 ppm2=1.695

assign ( resid 72 and name HD1#
  )
       ( resid 72 and name HG12
  ) 2.2 0.4 0.4 volume=8.706 peak=1094 ppm1=0.550 ppm2=0.780

assign ( resid 104 and name HN
  )
       ( resid 103 and name HD2#
  ) 3.4 1.6 0.7 volume=0.699 peak=778 ppm1=8.126 ppm2=0.897

assign ( resid 68 and name HA
  )
       ( resid 62 and name HN
  ) 4.2 2.4 0.8 volume=0.190 peak=1546 ppm1=5.127 ppm2=8.883

assign ( resid 71 and name HA
  )
       ( resid 71 and name HD2#
  ) 4.6 2.8 0.9 volume=0.117 peak=2120 ppm1=4.872 ppm2=0.824

assign ( resid 93 and name HN
  )
       ( resid 94 and name HN
  ) 2.4 0.6 0.5 volume=6.077 peak=259 ppm1=7.742 ppm2=8.302

assign ( resid 72 and name HA
  )
       ( resid 75 and name HB1
  ) 3.6 1.8 0.7 volume=0.462 peak=2130 ppm1=3.161 ppm2=1.861

assign ( resid 81 and name HN
  )
       ( resid 82 and name HN
  ) 2.8 1.0 0.6 volume=2.316 peak=452 ppm1=7.621 ppm2=7.138

assign ( resid 104 and name HG1
  )
       ( resid 104 and name HB1
  or resid 104 and name HB2
  ) 2.6 0.8 0.5 volume=3.386 peak=1008 ppm1=1.262 ppm2=1.673

assign ( resid 71 and name HA
  )
       ( resid 72 and name HD1#
  ) 4.3 2.5 0.9 volume=0.164 peak=1176 ppm1=4.870 ppm2=0.569

assign ( resid 98 and name HG2#
  )
       ( resid 87 and name HN
  ) 3.9 2.1 0.8 volume=0.295 peak=2301 ppm1=1.129 ppm2=7.711

assign ( resid 75 and name HB2
  )
       ( resid 75 and name HD2#
  ) 3.4 1.6 0.7 volume=0.676 peak=1474 ppm1=1.250 ppm2=0.847

assign ( resid 106 and name HA
  )
       ( resid 106 and name HN
  ) 3.1 1.3 0.6 volume=1.186 peak=2294 ppm1=4.051 ppm2=7.310

assign ( resid 65 and name HB1
  )
       ( resid 65 and name HA
  ) 3.3 1.5 0.7 volume=0.767 peak=974 ppm1=2.749 ppm2=4.983

assign ( resid 104 and name HA
  )
       ( resid 107 and name HN
  ) 3.3 1.5 0.7 volume=0.881 peak=2082 ppm1=3.915 ppm2=8.031

assign ( resid 78 and name HN
  )
       ( resid 75 and name HA
  ) 3.3 1.5 0.7 volume=0.790 peak=475 ppm1=7.445 ppm2=3.462

assign ( resid 72 and name HG2#
  )
       ( resid 72 and name HN
  ) 3.3 1.5 0.7 volume=0.865 peak=1492 ppm1=0.583 ppm2=8.428

assign ( resid 67 and name HN
  )
       ( resid 62 and name HB2
  ) 3.4 1.6 0.7 volume=0.668 peak=421 ppm1=7.827 ppm2=2.652

assign ( resid 75 and name HN
  )
       ( resid 77 and name HN
  ) 4.0 2.2 0.8 volume=0.272 peak=527 ppm1=7.045 ppm2=7.262

assign ( resid 72 and name HG11
  )
       ( resid 72 and name HG2#
  ) 2.7 0.9 0.5 volume=2.695 peak=1056 ppm1=0.707 ppm2=0.578

assign ( resid 102 and name HB1
  )
       ( resid 102 and name HA
  ) 4.2 2.4 0.8 volume=0.183 peak=1364 ppm1=2.814 ppm2=4.340

assign ( resid 87 and name HG2
  )
       ( resid 87 and name HG1
  ) 2.3 0.5 0.5 volume=7.376 peak=2352 ppm1=1.200 ppm2=1.137

assign ( resid 59 and name HD2
  )
       ( resid 59 and name HB2
  ) 3.8 2.0 0.8 volume=0.335 peak=1054 ppm1=3.436 ppm2=0.977

assign ( resid 78 and name HD2
  )
       ( resid 79 and name HA
  ) 3.4 1.6 0.7 volume=0.747 peak=21 ppm1=6.725 ppm2=3.473

assign ( resid 75 and name HD1#
  )
       ( resid 79 and name HE1
  ) 3.5 1.7 0.7 volume=0.568 peak=1834 ppm1=0.889 ppm2=3.086

assign ( resid 72 and name HN
  )
       ( resid 71 and name HB1
  ) 3.8 2.0 0.8 volume=0.343 peak=134 ppm1=8.436 ppm2=1.363

assign ( resid 68 and name HB2
  )
       ( resid 68 and name HB1
  ) 3.1 1.3 0.6 volume=1.201 peak=908 ppm1=3.335 ppm2=3.482

assign ( resid 97 and name HE1 or resid 97 and name HE2
  )
       ( resid 106 and name HB2
  ) 2.9 1.1 0.6 volume=1.753 peak=99 ppm1=6.680 ppm2=2.823

assign ( resid 109 and name HG2#
  )
       ( resid 108 and name HN
  ) 4.0 2.2 0.8 volume=0.247 peak=2181 ppm1=0.486 ppm2=6.927

assign ( resid 69 and name HB2
  )
       ( resid 74 and name HB1
  ) 4.0 2.2 0.8 volume=0.254 peak=2138 ppm1=3.061 ppm2=1.282

assign ( resid 102 and name HB2
  )
       ( resid 102 and name HD22
  ) 3.8 2.0 0.8 volume=0.370 peak=1134 ppm1=2.704 ppm2=7.020

assign ( resid 109 and name HG2#
  )
       ( resid 107 and name HA
  ) 4.1 2.3 0.8 volume=0.230 peak=1120 ppm1=0.484 ppm2=3.464

assign ( resid 61 and name HN
  )
       ( resid 61 and name HA1
  ) 2.7 0.9 0.5 volume=2.848 peak=186 ppm1=8.404 ppm2=4.529

assign ( resid 74 and name HN
  )
       ( resid 74 and name HG
  ) 3.0 1.2 0.6 volume=1.561 peak=506 ppm1=6.395 ppm2=1.556

assign ( resid 67 and name HB2
  or resid 67 and name HB1
  )
       ( resid 62 and name HB1
  ) 4.1 2.3 0.8 volume=0.218 peak=1896 ppm1=1.219 ppm2=3.251

assign ( resid 80 and name HA
  )
       ( resid 83 and name HN
  ) 3.3 1.5 0.7 volume=0.855 peak=1177 ppm1=3.931 ppm2=7.739

assign ( resid 88 and name HN
  )
       ( resid 87 and name HN
  ) 2.9 1.1 0.6 volume=1.979 peak=2327 ppm1=8.310 ppm2=7.713

assign ( resid 94 and name HN
  )
       ( resid 93 and name HN
  ) 2.4 0.6 0.5 volume=5.826 peak=843 ppm1=8.295 ppm2=7.747

assign ( resid 95 and name HB1
  )
       ( resid 95 and name HA
  ) 3.7 1.9 0.7 volume=0.448 peak=2030 ppm1=1.274 ppm2=3.841

assign ( resid 69 and name HD1 or resid 69 and name HD2
  )
       ( resid 74 and name HD2#
  ) 3.1 1.3 0.6 volume=1.184 peak=108 ppm1=6.902 ppm2=0.778

assign ( resid 94 and name HN
  )
       ( resid 89 and name HB1
  ) 3.5 1.7 0.7 volume=0.561 peak=743 ppm1=8.297 ppm2=1.622

assign ( resid 108 and name HA
  )
       ( resid 109 and name HN
  ) 3.2 1.4 0.6 volume=1.070 peak=1020 ppm1=3.960 ppm2=7.812

assign ( resid 72 and name HB
  )
       ( resid 72 and name HA
  ) 3.5 1.7 0.7 volume=0.610 peak=1082 ppm1=0.880 ppm2=3.162

assign ( resid 82 and name HN
  )
       ( resid 81 and name HG2
  or resid 81 and name HG1
  ) 3.3 1.5 0.7 volume=0.907 peak=771 ppm1=7.140 ppm2=1.341

assign ( resid 60 and name HN
  )
       ( resid 59 and name HA
  ) 2.9 1.1 0.6 volume=1.725 peak=371 ppm1=7.709 ppm2=4.077

assign ( resid 100 and name HA
  )
       ( resid 103 and name HB2
  ) 3.5 1.7 0.7 volume=0.594 peak=1551 ppm1=3.212 ppm2=1.830

assign ( resid 75 and name HD2#
  )
       ( resid 69 and name HN
  ) 3.6 1.8 0.7 volume=0.504 peak=1061 ppm1=0.848 ppm2=8.416

assign ( resid 69 and name HE1 or resid 69 and name HE2
  )
       ( resid 69 and name HB1
  ) 3.7 1.9 0.7 volume=0.424 peak=28 ppm1=6.133 ppm2=2.512

assign ( resid 91 and name HG2
  )
       ( resid 92 and name HN
  ) 3.9 2.1 0.8 volume=0.291 peak=1251 ppm1=2.209 ppm2=8.367

assign ( resid 109 and name HG1#
  )
       ( resid 106 and name HB2
  ) 4.3 2.5 0.9 volume=0.166 peak=2235 ppm1=0.308 ppm2=2.787

assign ( resid 82 and name HN
  )
       ( resid 81 and name HN
  ) 2.9 1.1 0.6 volume=1.798 peak=340 ppm1=7.135 ppm2=7.620

assign ( resid 96 and name HD1#
  )
       ( resid 96 and name HG
  ) 2.6 0.8 0.5 volume=3.667 peak=1037 ppm1=0.563 ppm2=1.425

assign ( resid 97 and name HN
  )
       ( resid 97 and name HB2
  ) 3.4 1.6 0.7 volume=0.638 peak=734 ppm1=8.697 ppm2=3.110

assign ( resid 103 and name HD1#
  )
       ( resid 90 and name HB1
  ) 3.3 1.5 0.7 volume=0.814 peak=1151 ppm1=0.808 ppm2=3.246

assign ( resid 76 and name HD21
  )
       ( resid 76 and name HD22
  ) 2.6 0.8 0.5 volume=3.774 peak=143 ppm1=7.305 ppm2=6.584

assign ( resid 79 and name HN
  )
       ( resid 78 and name HA
  ) 3.4 1.6 0.7 volume=0.714 peak=184 ppm1=8.416 ppm2=3.988

assign ( resid 75 and name HD1#
  )
       ( resid 69 and name HN
  ) 3.4 1.6 0.7 volume=0.706 peak=1592 ppm1=0.892 ppm2=8.428

assign ( resid 67 and name HA
  )
       ( resid 67 and name HB2
  or resid 67 and name HB1
  ) 2.8 1.0 0.6 volume=2.279 peak=1864 ppm1=3.945 ppm2=1.226

assign ( resid 60 and name HB1
  )
       ( resid 75 and name HD2#
  ) 3.5 1.7 0.7 volume=0.603 peak=1127 ppm1=2.845 ppm2=0.856

assign ( resid 95 and name HB1
  )
       ( resid 95 and name HN
  ) 3.3 1.5 0.7 volume=0.862 peak=2173 ppm1=1.276 ppm2=7.740

assign ( resid 96 and name HD1#
  )
       ( resid 96 and name HN
  ) 3.5 1.7 0.7 volume=0.557 peak=1907 ppm1=0.562 ppm2=7.583

assign ( resid 105 and name HG1
  )
       ( resid 106 and name HN
  ) 4.0 2.2 0.8 volume=0.276 peak=1893 ppm1=1.442 ppm2=7.298

assign ( resid 111 and name HN
  )
       ( resid 110 and name HB2
  ) 3.9 2.1 0.8 volume=0.313 peak=567 ppm1=7.582 ppm2=3.012

assign ( resid 95 and name HN
  )
       ( resid 94 and name HN
  ) 2.9 1.1 0.6 volume=1.752 peak=320 ppm1=7.735 ppm2=8.303

assign ( resid 71 and name HN
  )
       ( resid 69 and name HA
  ) 3.8 2.0 0.8 volume=0.341 peak=857 ppm1=6.740 ppm2=4.542

assign ( resid 107 and name HG2
  )
       ( resid 103 and name HD1#
  ) 3.4 1.6 0.7 volume=0.743 peak=2035 ppm1=2.696 ppm2=0.814

assign ( resid 74 and name HN
  )
       ( resid 74 and name HB2
  ) 3.1 1.3 0.6 volume=1.192 peak=207 ppm1=6.396 ppm2=1.747

assign ( resid 96 and name HB1
  )
       ( resid 96 and name HB2
  ) 2.7 0.9 0.5 volume=2.811 peak=980 ppm1=1.317 ppm2=1.060

assign ( resid 103 and name HA
  )
       ( resid 104 and name HN
  ) 3.9 2.1 0.8 volume=0.298 peak=1694 ppm1=3.027 ppm2=8.111

assign ( resid 93 and name HB1
  )
       ( resid 93 and name HB2
  ) 2.6 0.8 0.5 volume=3.684 peak=1701 ppm1=3.284 ppm2=2.752

assign ( resid 108 and name HN
  )
       ( resid 107 and name HA
  ) 3.6 1.8 0.7 volume=0.530 peak=248 ppm1=6.919 ppm2=3.452

assign ( resid 69 and name HE1 or resid 69 and name HE2
  )
       ( resid 69 and name HD1 or resid 69 and name HD2
  ) 2.6 0.8 0.5 volume=3.799 peak=66 ppm1=6.139 ppm2=6.906

assign ( resid 61 and name HA2
  )
       ( resid 68 and name HA
  ) 4.4 2.6 0.9 volume=0.148 peak=1278 ppm1=3.421 ppm2=5.106

assign ( resid 100 and name HN
  )
       ( resid 102 and name HN
  ) 3.9 2.1 0.8 volume=0.295 peak=796 ppm1=8.334 ppm2=7.853

assign ( resid 59 and name HD2
  )
       ( resid 59 and name HG2
  ) 3.3 1.5 0.7 volume=0.813 peak=1308 ppm1=3.441 ppm2=1.573

assign ( resid 72 and name HN
  )
       ( resid 72 and name HB
  ) 2.9 1.1 0.6 volume=1.742 peak=472 ppm1=8.437 ppm2=0.884

assign ( resid 108 and name HD1#
  )
       ( resid 109 and name HN
  ) 3.9 2.1 0.8 volume=0.300 peak=1837 ppm1=0.708 ppm2=7.820

assign ( resid 89 and name HB2
  )
       ( resid 89 and name HB1
  ) 3.0 1.2 0.6 volume=1.600 peak=2154 ppm1=1.289 ppm2=1.604

assign ( resid 104 and name HN
  )
       ( resid 103 and name HN
  ) 2.9 1.1 0.6 volume=1.974 peak=589 ppm1=8.129 ppm2=7.229

assign ( resid 86 and name HN
  )
       ( resid 85 and name HB2
  ) 3.4 1.6 0.7 volume=0.734 peak=196 ppm1=8.203 ppm2=1.811

assign ( resid 94 and name HN
  )
       ( resid 94 and name HA1
  ) 2.6 0.8 0.5 volume=3.258 peak=262 ppm1=8.294 ppm2=3.572

assign ( resid 76 and name HN
  )
       ( resid 75 and name HB1
  ) 3.1 1.3 0.6 volume=1.133 peak=391 ppm1=8.458 ppm2=1.867

assign ( resid 110 and name HN
  )
       ( resid 109 and name HA
  ) 3.2 1.4 0.6 volume=1.082 peak=334 ppm1=7.116 ppm2=3.769

assign ( resid 68 and name HB1
  )
       ( resid 68 and name HA
  ) 4.1 2.3 0.8 volume=0.218 peak=1191 ppm1=3.489 ppm2=5.138

assign ( resid 75 and name HN
  )
       ( resid 74 and name HB2
  ) 3.1 1.3 0.6 volume=1.197 peak=442 ppm1=7.049 ppm2=1.770

assign ( resid 90 and name HN
  )
       ( resid 90 and name HA
  ) 3.3 1.5 0.7 volume=0.844 peak=626 ppm1=9.126 ppm2=4.431

assign ( resid 59 and name HB1
  )
       ( resid 59 and name HG2
  ) 3.5 1.7 0.7 volume=0.613 peak=1286 ppm1=0.915 ppm2=1.559

assign ( resid 69 and name HB1
  )
       ( resid 74 and name HB1
  ) 4.1 2.3 0.8 volume=0.211 peak=2278 ppm1=2.521 ppm2=1.280

assign ( resid 107 and name HE21
  )
       ( resid 107 and name HG2
  ) 3.0 1.2 0.6 volume=1.579 peak=801 ppm1=7.496 ppm2=2.700

assign ( resid 77 and name HB2
  )
       ( resid 78 and name HN
  ) 3.9 2.1 0.8 volume=0.322 peak=2047 ppm1=1.552 ppm2=7.450

assign ( resid 108 and name HN
  )
       ( resid 105 and name HA
  ) 3.2 1.4 0.6 volume=0.958 peak=700 ppm1=6.917 ppm2=3.828

assign ( resid 80 and name HA
  )
       ( resid 80 and name HB2
  or resid 80 and name HB1
  ) 2.4 0.6 0.5 volume=5.511 peak=1752 ppm1=3.926 ppm2=1.698

assign ( resid 71 and name HD1#
  )
       ( resid 72 and name HN
  ) 3.3 1.5 0.7 volume=0.763 peak=1648 ppm1=0.915 ppm2=8.429

assign ( resid 95 and name HD1
  )
       ( resid 95 and name HB2
  ) 2.6 0.8 0.5 volume=3.840 peak=1334 ppm1=1.344 ppm2=1.194

assign ( resid 86 and name HA
  )
       ( resid 85 and name HG2
  or resid 85 and name HG1
  ) 4.2 2.4 0.8 volume=0.193 peak=952 ppm1=4.104 ppm2=2.105

assign ( resid 76 and name HN
  )
       ( resid 75 and name HA
  ) 3.3 1.5 0.7 volume=0.781 peak=357 ppm1=8.458 ppm2=3.464

assign ( resid 76 and name HB2
  or resid 76 and name HB1
  )
       ( resid 77 and name HG
  ) 3.8 2.0 0.8 volume=0.363 peak=2156 ppm1=2.566 ppm2=1.529

assign ( resid 96 and name HD1#
  )
       ( resid 97 and name HN
  ) 3.6 1.8 0.7 volume=0.507 peak=985 ppm1=0.563 ppm2=8.699

assign ( resid 103 and name HD2#
  )
       ( resid 103 and name HB1
  ) 2.8 1.0 0.6 volume=2.275 peak=1070 ppm1=0.877 ppm2=1.149

assign ( resid 97 and name HN
  )
       ( resid 89 and name HA
  ) 3.2 1.4 0.6 volume=1.065 peak=365 ppm1=8.693 ppm2=4.866

assign ( resid 93 and name HA
  )
       ( resid 93 and name HB2
  ) 2.9 1.1 0.6 volume=1.895 peak=2132 ppm1=5.000 ppm2=2.754

assign ( resid 75 and name HN
  )
       ( resid 71 and name HN
  ) 3.9 2.1 0.8 volume=0.327 peak=268 ppm1=7.044 ppm2=6.753

assign ( resid 85 and name HA
  )
       ( resid 85 and name HB2
  ) 2.8 1.0 0.6 volume=2.238 peak=2243 ppm1=4.089 ppm2=1.795

assign ( resid 93 and name HN
  )
       ( resid 90 and name HB2
  ) 3.0 1.2 0.6 volume=1.544 peak=350 ppm1=7.743 ppm2=2.740

assign ( resid 69 and name HN
  )
       ( resid 61 and name HA1
  ) 3.2 1.4 0.6 volume=1.076 peak=537 ppm1=8.408 ppm2=4.531

assign ( resid 74 and name HD2#
  )
       ( resid 75 and name HN
  ) 3.6 1.8 0.7 volume=0.505 peak=1723 ppm1=0.765 ppm2=7.069

assign ( resid 100 and name HA
  )
       ( resid 104 and name HN
  ) 4.2 2.4 0.8 volume=0.197 peak=1918 ppm1=3.210 ppm2=8.133

assign ( resid 103 and name HB1
  )
       ( resid 97 and name HB1
  ) 3.8 2.0 0.8 volume=0.358 peak=1760 ppm1=1.132 ppm2=2.672

assign ( resid 97 and name HD1 or resid 97 and name HD2
  )
       ( resid 103 and name HA
  ) 3.2 1.4 0.6 volume=1.094 peak=97 ppm1=7.101 ppm2=3.034

assign ( resid 65 and name HN
  )
       ( resid 64 and name HA
  ) 3.2 1.4 0.6 volume=1.045 peak=447 ppm1=7.858 ppm2=4.134

assign ( resid 77 and name HN
  )
       ( resid 77 and name HB2
  ) 2.7 0.9 0.5 volume=2.749 peak=169 ppm1=7.293 ppm2=1.580

assign ( resid 94 and name HA2
  )
       ( resid 95 and name HN
  ) 3.3 1.5 0.7 volume=0.859 peak=1414 ppm1=4.088 ppm2=7.742

assign ( resid 94 and name HA2
  )
       ( resid 89 and name HD1
  ) 3.5 1.7 0.7 volume=0.568 peak=1641 ppm1=4.093 ppm2=2.956

assign ( resid 95 and name HB1
  )
       ( resid 90 and name HB1
  ) 4.2 2.4 0.8 volume=0.206 peak=1518 ppm1=1.261 ppm2=3.262

assign ( resid 109 and name HA
  )
       ( resid 111 and name HN
  ) 3.8 2.0 0.8 volume=0.352 peak=1290 ppm1=3.774 ppm2=7.596

assign ( resid 97 and name HB1
  )
       ( resid 103 and name HD1#
  ) 4.2 2.4 0.8 volume=0.200 peak=1321 ppm1=2.667 ppm2=0.820

assign ( resid 64 and name HN
  )
       ( resid 63 and name HB2
  ) 3.4 1.6 0.7 volume=0.727 peak=112 ppm1=8.554 ppm2=1.944

assign ( resid 62 and name HB2
  )
       ( resid 62 and name HN
  ) 4.0 2.2 0.8 volume=0.273 peak=1484 ppm1=2.658 ppm2=8.884

assign ( resid 103 and name HB2
  )
       ( resid 103 and name HD2#
  ) 2.9 1.1 0.6 volume=1.629 peak=1243 ppm1=1.831 ppm2=0.878

assign ( resid 64 and name HN
  )
       ( resid 66 and name HN
  ) 3.6 1.8 0.7 volume=0.536 peak=227 ppm1=8.554 ppm2=8.136

assign ( resid 95 and name HN
  )
       ( resid 94 and name HA2
  ) 3.2 1.4 0.6 volume=0.941 peak=369 ppm1=7.733 ppm2=4.077

assign ( resid 103 and name HA
  )
       ( resid 103 and name HD1#
  ) 2.9 1.1 0.6 volume=1.666 peak=1386 ppm1=3.030 ppm2=0.815

assign ( resid 69 and name HE1 or resid 69 and name HE2
  )
       ( resid 69 and name HB2
  ) 3.6 1.8 0.7 volume=0.512 peak=12 ppm1=6.136 ppm2=3.062

assign ( resid 76 and name HA
  )
       ( resid 76 and name HD21
  ) 4.0 2.2 0.8 volume=0.265 peak=1603 ppm1=4.201 ppm2=7.307

assign ( resid 75 and name HN
  )
       ( resid 73 and name HA
  ) 3.7 1.9 0.7 volume=0.395 peak=292 ppm1=7.051 ppm2=3.913

assign ( resid 107 and name HG2
  )
       ( resid 104 and name HB1
  or resid 104 and name HB2
  ) 4.0 2.2 0.8 volume=0.252 peak=2001 ppm1=2.700 ppm2=1.683

assign ( resid 75 and name HA
  )
       ( resid 75 and name HB1
  ) 3.7 1.9 0.7 volume=0.438 peak=1096 ppm1=3.467 ppm2=1.852

assign ( resid 93 and name HN
  )
       ( resid 93 and name HB2
  ) 3.0 1.2 0.6 volume=1.402 peak=323 ppm1=7.743 ppm2=2.767

assign ( resid 108 and name HB1
  )
       ( resid 109 and name HN
  ) 4.1 2.3 0.8 volume=0.230 peak=2118 ppm1=1.597 ppm2=7.813

assign ( resid 99 and name HG2#
  )
       ( resid 102 and name HB2
  ) 3.8 2.0 0.8 volume=0.369 peak=2115 ppm1=1.081 ppm2=2.711

assign ( resid 112 and name HN
  )
       ( resid 111 and name HN
  ) 3.3 1.5 0.7 volume=0.825 peak=329 ppm1=7.867 ppm2=7.584

assign ( resid 72 and name HG11
  )
       ( resid 72 and name HA
  ) 3.9 2.1 0.8 volume=0.301 peak=1945 ppm1=0.710 ppm2=3.156

assign ( resid 82 and name HB1
  )
       ( resid 82 and name HE1
  ) 4.2 2.4 0.8 volume=0.195 peak=2003 ppm1=3.015 ppm2=7.846

assign ( resid 91 and name HA
  )
       ( resid 91 and name HG2
  ) 2.8 1.0 0.6 volume=2.398 peak=1557 ppm1=3.998 ppm2=2.220

assign ( resid 108 and name HD1#
  )
       ( resid 107 and name HB1
  ) 3.6 1.8 0.7 volume=0.467 peak=1852 ppm1=0.707 ppm2=2.066

assign ( resid 77 and name HD2#
  )
       ( resid 80 and name HD2
  or resid 80 and name HD1
  ) 2.3 0.5 0.5 volume=6.415 peak=2295 ppm1=0.736 ppm2=1.528

assign ( resid 88 and name HB1
  )
       ( resid 88 and name HN
  ) 3.6 1.8 0.7 volume=0.501 peak=2374 ppm1=2.631 ppm2=8.313

assign ( resid 74 and name HA
  )
       ( resid 74 and name HD1#
  ) 3.3 1.5 0.7 volume=0.878 peak=975 ppm1=3.933 ppm2=1.037

assign ( resid 91 and name HG1
  )
       ( resid 91 and name HA
  ) 3.1 1.3 0.6 volume=1.265 peak=2054 ppm1=2.259 ppm2=3.999

assign ( resid 81 and name HA
  )
       ( resid 81 and name HN
  ) 2.9 1.1 0.6 volume=1.953 peak=1668 ppm1=3.941 ppm2=7.631

assign ( resid 75 and name HN
  )
       ( resid 75 and name HB1
  ) 3.1 1.3 0.6 volume=1.144 peak=476 ppm1=7.048 ppm2=1.873

assign ( resid 60 and name HB1
  )
       ( resid 69 and name HN
  ) 4.2 2.4 0.8 volume=0.207 peak=1493 ppm1=2.841 ppm2=8.426

assign ( resid 95 and name HN
  )
       ( resid 90 and name HB1
  ) 2.9 1.1 0.6 volume=1.939 peak=422 ppm1=7.738 ppm2=3.255

assign ( resid 71 and name HN
  )
       ( resid 74 and name HG
  ) 3.5 1.7 0.7 volume=0.629 peak=529 ppm1=6.745 ppm2=1.568

assign ( resid 65 and name HA
  )
       ( resid 65 and name HB2
  ) 2.8 1.0 0.6 volume=2.343 peak=2218 ppm1=5.000 ppm2=3.288

assign ( resid 94 and name HN
  )
       ( resid 93 and name HA
  ) 3.4 1.6 0.7 volume=0.706 peak=765 ppm1=8.295 ppm2=4.989

assign ( resid 103 and name HD1#
  )
       ( resid 95 and name HN
  ) 4.2 2.4 0.8 volume=0.205 peak=1566 ppm1=0.809 ppm2=7.734

assign ( resid 104 and name HA
  )
       ( resid 105 and name HN
  ) 3.4 1.6 0.7 volume=0.711 peak=1055 ppm1=3.917 ppm2=7.544

assign ( resid 110 and name HD2
  )
       ( resid 110 and name HB1
  ) 3.0 1.2 0.6 volume=1.366 peak=23 ppm1=6.610 ppm2=3.153

assign ( resid 64 and name HB1
  )
       ( resid 64 and name HG2
  ) 3.4 1.6 0.7 volume=0.710 peak=2107 ppm1=1.337 ppm2=1.762

assign ( resid 72 and name HG2#
  )
       ( resid 73 and name HN
  ) 3.7 1.9 0.7 volume=0.418 peak=1743 ppm1=0.582 ppm2=7.993

assign ( resid 69 and name HN
  )
       ( resid 69 and name HD1 or resid 69 and name HD2
  ) 3.3 1.5 0.7 volume=0.810 peak=838 ppm1=8.414 ppm2=6.889

assign ( resid 72 and name HA
  )
       ( resid 72 and name HD1#
  ) 3.2 1.4 0.6 volume=0.914 peak=1194 ppm1=3.160 ppm2=0.556

assign ( resid 85 and name HG1
  )
       ( resid 80 and name HE2
  or resid 80 and name HE1
  ) 4.0 2.2 0.8 volume=0.245 peak=1785 ppm1=2.131 ppm2=2.827

assign ( resid 107 and name HB2
  )
       ( resid 107 and name HE21
  ) 4.5 2.7 0.9 volume=0.134 peak=1949 ppm1=2.107 ppm2=7.500

assign ( resid 100 and name HN
  )
       ( resid 100 and name HB2
  ) 3.1 1.3 0.6 volume=1.230 peak=181 ppm1=8.334 ppm2=3.518

assign ( resid 93 and name HA
  )
       ( resid 93 and name HB1
  ) 2.8 1.0 0.6 volume=2.343 peak=2140 ppm1=5.000 ppm2=3.285

assign ( resid 75 and name HB1
  )
       ( resid 75 and name HA
  ) 4.1 2.3 0.8 volume=0.216 peak=885 ppm1=1.851 ppm2=3.468

assign ( resid 89 and name HD2
  )
       ( resid 96 and name HD2#
  ) 3.7 1.9 0.7 volume=0.410 peak=1291 ppm1=2.929 ppm2=0.686

assign ( resid 65 and name HN
  )
       ( resid 65 and name HB1
  ) 3.5 1.7 0.7 volume=0.547 peak=847 ppm1=7.855 ppm2=2.759

assign ( resid 105 and name HG1
  )
       ( resid 105 and name HD2
  or resid 105 and name HD1
  ) 2.7 0.9 0.5 volume=2.691 peak=1129 ppm1=1.440 ppm2=3.045

assign ( resid 75 and name HD2#
  )
       ( resid 75 and name HB1
  ) 3.0 1.2 0.6 volume=1.351 peak=1299 ppm1=0.848 ppm2=1.853

assign ( resid 92 and name HN
  )
       ( resid 90 and name HB1
  ) 3.5 1.7 0.7 volume=0.591 peak=454 ppm1=8.365 ppm2=3.256

assign ( resid 96 and name HB1
  )
       ( resid 96 and name HD1#
  ) 3.5 1.7 0.7 volume=0.614 peak=1256 ppm1=1.315 ppm2=0.566

assign ( resid 106 and name HB1
  )
       ( resid 106 and name HA
  ) 3.6 1.8 0.7 volume=0.525 peak=1179 ppm1=2.589 ppm2=4.048

assign ( resid 74 and name HD1#
  )
       ( resid 74 and name HB2
  ) 3.1 1.3 0.6 volume=1.315 peak=936 ppm1=1.042 ppm2=1.750

assign ( resid 108 and name HB2
  )
       ( resid 108 and name HD2#
  ) 3.0 1.2 0.6 volume=1.551 peak=1619 ppm1=1.351 ppm2=0.805

assign ( resid 96 and name HN
  )
       ( resid 96 and name HD1#
  ) 3.3 1.5 0.7 volume=0.862 peak=553 ppm1=7.581 ppm2=0.568

assign ( resid 76 and name HB2
  or resid 76 and name HB1
  )
       ( resid 75 and name HD2#
  ) 3.8 2.0 0.8 volume=0.343 peak=1063 ppm1=2.578 ppm2=0.871

assign ( resid 88 and name HN
  )
       ( resid 87 and name HG2
  ) 3.2 1.4 0.6 volume=0.922 peak=2372 ppm1=8.307 ppm2=1.207

assign ( resid 97 and name HB1
  )
       ( resid 99 and name HN
  ) 3.5 1.7 0.7 volume=0.537 peak=1624 ppm1=2.659 ppm2=7.058

assign ( resid 84 and name HA2
  or resid 84 and name HA1
  )
       ( resid 98 and name HG2#
  ) 3.8 2.0 0.8 volume=0.332 peak=990 ppm1=3.857 ppm2=1.129

assign ( resid 65 and name HN
  )
       ( resid 64 and name HN
  ) 3.0 1.2 0.6 volume=1.498 peak=141 ppm1=7.855 ppm2=8.557

assign ( resid 108 and name HB2
  )
       ( resid 108 and name HG
  ) 3.1 1.3 0.6 volume=1.262 peak=2188 ppm1=1.349 ppm2=1.696

assign ( resid 106 and name HN
  )
       ( resid 106 and name HA
  ) 2.8 1.0 0.6 volume=2.328 peak=380 ppm1=7.304 ppm2=4.044

assign ( resid 101 and name HA2
  )
       ( resid 104 and name HD1
  or resid 104 and name HD2
  ) 3.7 1.9 0.7 volume=0.442 peak=2145 ppm1=3.657 ppm2=1.496

assign ( resid 65 and name HA
  )
       ( resid 65 and name HB1
  ) 2.9 1.1 0.6 volume=1.895 peak=1593 ppm1=4.999 ppm2=2.749

assign ( resid 97 and name HE1 or resid 97 and name HE2
  )
       ( resid 90 and name HB1
  ) 3.3 1.5 0.7 volume=0.781 peak=89 ppm1=6.682 ppm2=3.251

assign ( resid 64 and name HN
  )
       ( resid 64 and name HG1
  ) 3.2 1.4 0.6 volume=1.009 peak=654 ppm1=8.554 ppm2=1.591

assign ( resid 71 and name HD1#
  )
       ( resid 70 and name HB1
  or resid 70 and name HB2
  ) 3.2 1.4 0.6 volume=1.016 peak=2037 ppm1=0.913 ppm2=1.812

assign ( resid 66 and name HA2
  )
       ( resid 66 and name HN
  ) 3.2 1.4 0.6 volume=0.945 peak=1411 ppm1=3.676 ppm2=8.127

assign ( resid 107 and name HN
  )
       ( resid 104 and name HA
  ) 3.0 1.2 0.6 volume=1.467 peak=249 ppm1=8.024 ppm2=3.908

assign ( resid 94 and name HA1
  )
       ( resid 94 and name HA2
  ) 2.9 1.1 0.6 volume=1.686 peak=1165 ppm1=3.575 ppm2=4.091

assign ( resid 102 and name HB2
  )
       ( resid 102 and name HA
  ) 4.2 2.4 0.8 volume=0.183 peak=1215 ppm1=2.729 ppm2=4.339

assign ( resid 107 and name HE22
  )
       ( resid 103 and name HD1#
  ) 3.5 1.7 0.7 volume=0.582 peak=694 ppm1=6.926 ppm2=0.805

assign ( resid 71 and name HN
  )
       ( resid 71 and name HB1
  ) 3.4 1.6 0.7 volume=0.743 peak=153 ppm1=6.744 ppm2=1.352

assign ( resid 104 and name HG1
  )
       ( resid 104 and name HN
  ) 3.6 1.8 0.7 volume=0.456 peak=1516 ppm1=1.265 ppm2=8.128

assign ( resid 77 and name HD1#
  )
       ( resid 77 and name HB2
  ) 2.3 0.5 0.5 volume=6.845 peak=1528 ppm1=0.713 ppm2=1.562

assign ( resid 79 and name HA
  )
       ( resid 78 and name HD2
  ) 3.6 1.8 0.7 volume=0.513 peak=1971 ppm1=3.469 ppm2=6.722

assign ( resid 62 and name HB1
  )
       ( resid 75 and name HD2#
  or resid 75 and name HD1#
  ) 3.6 1.8 0.7 volume=0.504 peak=1983 ppm1=3.225 ppm2=0.871

assign ( resid 108 and name HD1#
  )
       ( resid 108 and name HB1
  ) 2.4 0.6 0.5 volume=5.325 peak=2010 ppm1=0.709 ppm2=1.581

assign ( resid 104 and name HN
  )
       ( resid 103 and name HD1#
  ) 3.3 1.5 0.7 volume=0.873 peak=349 ppm1=8.127 ppm2=0.827

assign ( resid 77 and name HA
  )
       ( resid 77 and name HB2
  ) 2.5 0.7 0.5 volume=4.596 peak=1871 ppm1=3.907 ppm2=1.569

assign ( resid 103 and name HB2
  )
       ( resid 88 and name HB1
  ) 3.7 1.9 0.7 volume=0.397 peak=2326 ppm1=1.825 ppm2=2.646

assign ( resid 109 and name HG2#
  )
       ( resid 109 and name HG1#
  ) 2.4 0.6 0.5 volume=4.997 peak=1051 ppm1=0.487 ppm2=0.320

assign ( resid 108 and name HD2#
  )
       ( resid 108 and name HG
  ) 2.6 0.8 0.5 volume=3.900 peak=2075 ppm1=0.798 ppm2=1.689

assign ( resid 74 and name HB2
  )
       ( resid 74 and name HA
  ) 4.4 2.6 0.9 volume=0.150 peak=1464 ppm1=1.753 ppm2=3.950

assign ( resid 72 and name HA
  )
       ( resid 72 and name HG2#
  ) 3.2 1.4 0.6 volume=1.066 peak=1512 ppm1=3.160 ppm2=0.579

assign ( resid 88 and name HE1 or resid 88 and name HE2
  )
       ( resid 88 and name HN
  ) 3.3 1.5 0.7 volume=0.812 peak=2366 ppm1=6.671 ppm2=8.315

assign ( resid 86 and name HB#
  )
       ( resid 96 and name HD2#
  ) 3.3 1.5 0.7 volume=0.776 peak=1814 ppm1=1.068 ppm2=0.688

assign ( resid 104 and name HN
  )
       ( resid 104 and name HA
  ) 2.8 1.0 0.6 volume=2.143 peak=487 ppm1=8.127 ppm2=3.906

assign ( resid 65 and name HB1
  )
       ( resid 65 and name HB2
  ) 2.6 0.8 0.5 volume=3.791 peak=2248 ppm1=2.748 ppm2=3.283

assign ( resid 67 and name HN
  )
       ( resid 62 and name HN
  ) 4.2 2.4 0.8 volume=0.186 peak=538 ppm1=7.826 ppm2=8.865

assign ( resid 108 and name HB2
  )
       ( resid 109 and name HN
  ) 4.0 2.2 0.8 volume=0.244 peak=1824 ppm1=1.355 ppm2=7.814

assign ( resid 87 and name HA
  )
       ( resid 96 and name HD1#
  ) 3.9 2.1 0.8 volume=0.326 peak=1587 ppm1=4.191 ppm2=0.550

assign ( resid 91 and name HN
  )
       ( resid 103 and name HD1#
  ) 3.5 1.7 0.7 volume=0.623 peak=688 ppm1=9.399 ppm2=0.826

assign ( resid 78 and name HA
  )
       ( resid 78 and name HN
  ) 3.3 1.5 0.7 volume=0.837 peak=2049 ppm1=3.989 ppm2=7.449

assign ( resid 87 and name HN
  )
       ( resid 87 and name HG2
  ) 2.7 0.9 0.5 volume=3.070 peak=2328 ppm1=7.710 ppm2=1.206

assign ( resid 87 and name HA
  )
       ( resid 87 and name HD1
  ) 3.5 1.7 0.7 volume=0.601 peak=2302 ppm1=4.187 ppm2=2.930

assign ( resid 77 and name HD1#
  )
       ( resid 80 and name HN
  ) 3.8 2.0 0.8 volume=0.340 peak=1471 ppm1=0.713 ppm2=7.095

assign ( resid 110 and name HB1
  )
       ( resid 110 and name HE1
  ) 4.2 2.4 0.8 volume=0.183 peak=1238 ppm1=3.144 ppm2=7.844

assign ( resid 66 and name HN
  )
       ( resid 65 and name HN
  ) 3.0 1.2 0.6 volume=1.595 peak=669 ppm1=8.125 ppm2=7.876

assign ( resid 96 and name HD2#
  )
       ( resid 89 and name HA
  ) 4.7 2.9 0.9 volume=0.105 peak=1664 ppm1=0.684 ppm2=4.851

assign ( resid 70 and name HG2
  or resid 70 and name HG1
  )
       ( resid 70 and name HN
  ) 4.6 2.8 0.9 volume=0.112 peak=1487 ppm1=1.664 ppm2=9.268

assign ( resid 96 and name HB2
  )
       ( resid 96 and name HD1#
  ) 3.3 1.5 0.7 volume=0.844 peak=1012 ppm1=1.054 ppm2=0.565

assign ( resid 71 and name HN
  )
       ( resid 70 and name HA
  ) 3.8 2.0 0.8 volume=0.380 peak=228 ppm1=6.742 ppm2=4.333

assign ( resid 107 and name HG1
  )
       ( resid 107 and name HN
  ) 3.5 1.7 0.7 volume=0.561 peak=2021 ppm1=2.640 ppm2=8.023

assign ( resid 88 and name HB2
  )
       ( resid 103 and name HD2#
  ) 3.2 1.4 0.6 volume=1.069 peak=2300 ppm1=2.754 ppm2=0.880

assign ( resid 103 and name HN
  )
       ( resid 100 and name HN
  ) 3.7 1.9 0.7 volume=0.406 peak=309 ppm1=7.220 ppm2=8.337

assign ( resid 71 and name HN
  )
       ( resid 74 and name HA
  ) 4.5 2.7 0.9 volume=0.135 peak=295 ppm1=6.738 ppm2=3.941

assign ( resid 74 and name HD2#
  )
       ( resid 74 and name HN
  ) 3.5 1.7 0.7 volume=0.576 peak=1738 ppm1=0.763 ppm2=6.400

assign ( resid 100 and name HA
  )
       ( resid 100 and name HN
  ) 4.0 2.2 0.8 volume=0.282 peak=1810 ppm1=3.215 ppm2=8.335

assign ( resid 106 and name HB1
  )
       ( resid 106 and name HB2
  ) 3.1 1.3 0.6 volume=1.333 peak=2011 ppm1=2.588 ppm2=2.813

assign ( resid 107 and name HB2
  )
       ( resid 107 and name HB1
  ) 2.5 0.7 0.5 volume=4.936 peak=2034 ppm1=2.125 ppm2=2.057

assign ( resid 78 and name HN
  )
       ( resid 75 and name HD2#
  or resid 75 and name HD1#
  ) 3.6 1.8 0.7 volume=0.487 peak=604 ppm1=7.446 ppm2=0.896

assign ( resid 103 and name HD2#
  )
       ( resid 103 and name HG
  ) 2.6 0.8 0.5 volume=3.195 peak=2217 ppm1=0.879 ppm2=1.300

assign ( resid 97 and name HB2
  )
       ( resid 97 and name HB1
  ) 3.1 1.3 0.6 volume=1.207 peak=1970 ppm1=3.114 ppm2=2.659

assign ( resid 85 and name HG1
  )
       ( resid 85 and name HB1
  ) 2.4 0.6 0.5 volume=5.686 peak=1986 ppm1=2.124 ppm2=1.856

assign ( resid 99 and name HN
  )
       ( resid 97 and name HB2
  ) 2.9 1.1 0.6 volume=1.862 peak=278 ppm1=7.047 ppm2=3.107

assign ( resid 72 and name HB
  )
       ( resid 60 and name HD1 or resid 60 and name HD2
  ) 4.1 2.3 0.8 volume=0.228 peak=1650 ppm1=0.882 ppm2=6.827

assign ( resid 103 and name HN
  )
       ( resid 102 and name HB2
  ) 2.9 1.1 0.6 volume=1.885 peak=122 ppm1=7.219 ppm2=2.742

assign ( resid 65 and name HN
  )
       ( resid 65 and name HB2
  ) 3.3 1.5 0.7 volume=0.892 peak=420 ppm1=7.857 ppm2=3.300

assign ( resid 95 and name HB2
  )
       ( resid 95 and name HD1
  ) 2.5 0.7 0.5 volume=4.235 peak=2255 ppm1=1.193 ppm2=1.344

assign ( resid 67 and name HN
  )
       ( resid 62 and name HB1
  ) 3.5 1.7 0.7 volume=0.609 peak=766 ppm1=7.825 ppm2=3.238

assign ( resid 106 and name HB2
  )
       ( resid 106 and name HN
  ) 3.2 1.4 0.6 volume=1.037 peak=1614 ppm1=2.816 ppm2=7.303

assign ( resid 91 and name HB1
  )
       ( resid 91 and name HN
  ) 3.9 2.1 0.8 volume=0.317 peak=1367 ppm1=1.891 ppm2=9.399

assign ( resid 75 and name HD1#
  )
       ( resid 78 and name HN
  ) 4.2 2.4 0.8 volume=0.203 peak=2076 ppm1=0.893 ppm2=7.451

assign ( resid 103 and name HA
  )
       ( resid 106 and name HB1
  ) 3.5 1.7 0.7 volume=0.620 peak=1057 ppm1=3.029 ppm2=2.588

assign ( resid 94 and name HA2
  )
       ( resid 94 and name HA1
  ) 2.7 0.9 0.5 volume=2.760 peak=1741 ppm1=4.088 ppm2=3.569

assign ( resid 99 and name HG2#
  )
       ( resid 102 and name HD22
  ) 3.6 1.8 0.7 volume=0.485 peak=1124 ppm1=1.080 ppm2=7.013

assign ( resid 69 and name HB2
  )
       ( resid 71 and name HN
  ) 4.1 2.3 0.8 volume=0.217 peak=1859 ppm1=3.060 ppm2=6.752

assign ( resid 96 and name HN
  )
       ( resid 97 and name HN
  ) 3.9 2.1 0.8 volume=0.305 peak=853 ppm1=7.576 ppm2=8.703

assign ( resid 77 and name HG
  )
       ( resid 77 and name HA
  ) 3.2 1.4 0.6 volume=1.055 peak=1300 ppm1=1.547 ppm2=3.904

assign ( resid 102 and name HB1
  )
       ( resid 102 and name HN
  ) 4.2 2.4 0.8 volume=0.188 peak=1337 ppm1=2.824 ppm2=7.862

assign ( resid 91 and name HB1
  )
       ( resid 91 and name HB2
  ) 2.2 0.4 0.4 volume=8.800 peak=1180 ppm1=1.891 ppm2=1.997

assign ( resid 108 and name HD1#
  )
       ( resid 108 and name HG
  ) 2.5 0.7 0.5 volume=4.640 peak=905 ppm1=0.707 ppm2=1.684

assign ( resid 75 and name HD1#
  )
       ( resid 60 and name HB1
  ) 3.6 1.8 0.7 volume=0.463 peak=1109 ppm1=0.888 ppm2=2.831

assign ( resid 87 and name HN
  )
       ( resid 96 and name HB1
  ) 2.7 0.9 0.5 volume=2.820 peak=2305 ppm1=7.708 ppm2=1.329

assign ( resid 78 and name HD2
  )
       ( resid 75 and name HD2#
  or resid 75 and name HD1#
  ) 3.0 1.2 0.6 volume=1.549 peak=27 ppm1=6.723 ppm2=0.883

assign ( resid 109 and name HB
  )
       ( resid 109 and name HN
  ) 3.1 1.3 0.6 volume=1.296 peak=1625 ppm1=1.784 ppm2=7.807

assign ( resid 94 and name HN
  )
       ( resid 90 and name HB1
  ) 3.1 1.3 0.6 volume=1.244 peak=494 ppm1=8.295 ppm2=3.258

assign ( resid 80 and name HN
  )
       ( resid 79 and name HA
  ) 3.4 1.6 0.7 volume=0.727 peak=187 ppm1=7.096 ppm2=3.477

assign ( resid 105 and name HG2
  )
       ( resid 105 and name HA
  ) 3.3 1.5 0.7 volume=0.784 peak=2150 ppm1=1.571 ppm2=3.845

assign ( resid 91 and name HB2
  )
       ( resid 92 and name HN
  ) 3.7 1.9 0.7 volume=0.411 peak=1806 ppm1=1.991 ppm2=8.362

assign ( resid 97 and name HE1 or resid 97 and name HE2
  )
       ( resid 95 and name HG1
  ) 3.5 1.7 0.7 volume=0.614 peak=67 ppm1=6.685 ppm2=1.014

assign ( resid 69 and name HN
  )
       ( resid 70 and name HN
  ) 4.5 2.7 0.9 volume=0.136 peak=384 ppm1=8.412 ppm2=9.269

assign ( resid 66 and name HN
  )
       ( resid 66 and name HA1
  ) 2.9 1.1 0.6 volume=1.801 peak=655 ppm1=8.123 ppm2=4.111

assign ( resid 95 and name HA
  )
       ( resid 95 and name HB2
  ) 3.1 1.3 0.6 volume=1.321 peak=1906 ppm1=3.838 ppm2=1.193

assign ( resid 108 and name HN
  )
       ( resid 107 and name HB2
  ) 3.4 1.6 0.7 volume=0.706 peak=518 ppm1=6.920 ppm2=2.144

assign ( resid 107 and name HB2
  )
       ( resid 107 and name HN
  ) 3.4 1.6 0.7 volume=0.653 peak=1881 ppm1=2.125 ppm2=8.028

assign ( resid 65 and name HN
  )
       ( resid 62 and name HB1
  ) 3.2 1.4 0.6 volume=1.082 peak=236 ppm1=7.854 ppm2=3.242

assign ( resid 71 and name HN
  )
       ( resid 70 and name HB1
  or resid 70 and name HB2
  ) 3.2 1.4 0.6 volume=1.031 peak=250 ppm1=6.744 ppm2=1.823

assign ( resid 90 and name HB2
  )
       ( resid 106 and name HD2
  ) 3.1 1.3 0.6 volume=1.239 peak=901 ppm1=2.730 ppm2=6.682

assign ( resid 77 and name HN
  )
       ( resid 76 and name HB2
  or resid 76 and name HB1
  ) 3.0 1.2 0.6 volume=1.376 peak=659 ppm1=7.292 ppm2=2.575

assign ( resid 87 and name HN
  )
       ( resid 87 and name HG1
  ) 2.8 1.0 0.6 volume=2.305 peak=2310 ppm1=7.710 ppm2=1.132

assign ( resid 104 and name HB2
  )
       ( resid 104 and name HN
  ) 2.8 1.0 0.6 volume=2.219 peak=1503 ppm1=1.677 ppm2=8.128

assign ( resid 95 and name HA
  )
       ( resid 95 and name HB1
  ) 3.0 1.2 0.6 volume=1.548 peak=2043 ppm1=3.840 ppm2=1.269

assign ( resid 74 and name HN
  )
       ( resid 72 and name HA
  ) 4.0 2.2 0.8 volume=0.279 peak=696 ppm1=6.394 ppm2=3.131

assign ( resid 97 and name HB2
  )
       ( resid 99 and name HN
  ) 3.4 1.6 0.7 volume=0.714 peak=1007 ppm1=3.114 ppm2=7.057

assign ( resid 72 and name HG2#
  )
       ( resid 76 and name HB2
  or resid 76 and name HB1
  ) 4.0 2.2 0.8 volume=0.279 peak=2197 ppm1=0.583 ppm2=2.577

assign ( resid 93 and name HN
  )
       ( resid 93 and name HA
  ) 3.0 1.2 0.6 volume=1.470 peak=219 ppm1=7.744 ppm2=4.990

assign ( resid 72 and name HD1#
  )
       ( resid 60 and name HB1
  ) 3.9 2.1 0.8 volume=0.314 peak=1555 ppm1=0.555 ppm2=2.825

assign ( resid 85 and name HN
  )
       ( resid 85 and name HG1
  ) 3.2 1.4 0.6 volume=1.033 peak=194 ppm1=7.943 ppm2=2.111

assign ( resid 103 and name HN
  )
       ( resid 103 and name HB1
  ) 2.8 1.0 0.6 volume=2.012 peak=841 ppm1=7.219 ppm2=1.137

assign ( resid 90 and name HN
  )
       ( resid 89 and name HG1
  or resid 89 and name HG2
  ) 3.1 1.3 0.6 volume=1.272 peak=559 ppm1=9.130 ppm2=1.112

assign ( resid 71 and name HD2#
  )
       ( resid 70 and name HB1
  or resid 70 and name HB2
  ) 3.3 1.5 0.7 volume=0.899 peak=1154 ppm1=0.809 ppm2=1.812

assign ( resid 110 and name HN
  )
       ( resid 110 and name HB1
  ) 2.9 1.1 0.6 volume=1.742 peak=132 ppm1=7.117 ppm2=3.138

assign ( resid 65 and name HN
  )
       ( resid 65 and name HA
  ) 3.3 1.5 0.7 volume=0.805 peak=441 ppm1=7.854 ppm2=4.982

assign ( resid 95 and name HA
  )
       ( resid 95 and name HN
  ) 3.1 1.3 0.6 volume=1.180 peak=1283 ppm1=3.838 ppm2=7.737

assign ( resid 97 and name HB1
  )
       ( resid 98 and name HG2#
  ) 4.3 2.5 0.9 volume=0.161 peak=1514 ppm1=2.660 ppm2=1.128

assign ( resid 107 and name HA
  )
       ( resid 110 and name HD2
  ) 3.0 1.2 0.6 volume=1.406 peak=2285 ppm1=3.455 ppm2=6.613

assign ( resid 102 and name HA
  )
       ( resid 102 and name HB1
  ) 4.1 2.3 0.8 volume=0.230 peak=1233 ppm1=4.338 ppm2=2.807

assign ( resid 109 and name HB
  )
       ( resid 109 and name HA
  ) 2.8 1.0 0.6 volume=2.279 peak=1025 ppm1=1.782 ppm2=3.773

assign ( resid 95 and name HN
  )
       ( resid 95 and name HG1
  ) 3.0 1.2 0.6 volume=1.401 peak=275 ppm1=7.734 ppm2=1.045

assign ( resid 76 and name HD22
  )
       ( resid 76 and name HB2
  or resid 76 and name HB1
  ) 3.3 1.5 0.7 volume=0.880 peak=159 ppm1=6.589 ppm2=2.569

assign ( resid 75 and name HD2#
  )
       ( resid 76 and name HN
  ) 3.6 1.8 0.7 volume=0.504 peak=2205 ppm1=0.847 ppm2=8.462

assign ( resid 75 and name HA
  )
       ( resid 75 and name HD2#
  ) 3.4 1.6 0.7 volume=0.739 peak=1073 ppm1=3.465 ppm2=0.847

assign ( resid 62 and name HB2
  )
       ( resid 67 and name HN
  ) 3.8 2.0 0.8 volume=0.352 peak=2061 ppm1=2.664 ppm2=7.828

assign ( resid 65 and name HB2
  )
       ( resid 65 and name HN
  ) 3.0 1.2 0.6 volume=1.396 peak=2249 ppm1=3.283 ppm2=7.856

assign ( resid 69 and name HD1 or resid 69 and name HD2
  )
       ( resid 69 and name HN
  ) 3.2 1.4 0.6 volume=0.988 peak=58 ppm1=6.904 ppm2=8.422

assign ( resid 98 and name HG2#
  )
       ( resid 85 and name HG2
  ) 4.3 2.5 0.9 volume=0.175 peak=1093 ppm1=1.129 ppm2=2.086

assign ( resid 97 and name HN
  )
       ( resid 88 and name HB1
  ) 3.0 1.2 0.6 volume=1.586 peak=690 ppm1=8.695 ppm2=2.651

assign ( resid 74 and name HD1#
  )
       ( resid 74 and name HD2#
  ) 2.5 0.7 0.5 volume=4.048 peak=1802 ppm1=1.041 ppm2=0.770

assign ( resid 72 and name HB
  )
       ( resid 72 and name HG12
  ) 3.0 1.2 0.6 volume=1.508 peak=1774 ppm1=0.883 ppm2=0.785

assign ( resid 103 and name HD2#
  )
       ( resid 104 and name HA
  ) 4.2 2.4 0.8 volume=0.208 peak=886 ppm1=0.878 ppm2=3.901

assign ( resid 108 and name HA
  )
       ( resid 108 and name HB1
  ) 2.5 0.7 0.5 volume=3.977 peak=1772 ppm1=3.946 ppm2=1.594

assign ( resid 108 and name HG
  )
       ( resid 108 and name HD2#
  ) 3.1 1.3 0.6 volume=1.167 peak=1640 ppm1=1.684 ppm2=0.800

assign ( resid 75 and name HN
  )
       ( resid 75 and name HB2
  ) 3.1 1.3 0.6 volume=1.224 peak=809 ppm1=7.047 ppm2=1.272

assign ( resid 86 and name HN
  )
       ( resid 85 and name HN
  ) 3.9 2.1 0.8 volume=0.323 peak=635 ppm1=8.204 ppm2=7.931

assign ( resid 75 and name HD1#
  )
       ( resid 62 and name HB1
  ) 3.4 1.6 0.7 volume=0.721 peak=2224 ppm1=0.890 ppm2=3.216

assign ( resid 108 and name HB1
  )
       ( resid 108 and name HB2
  ) 2.6 0.8 0.5 volume=3.204 peak=1472 ppm1=1.584 ppm2=1.358

assign ( resid 65 and name HB2
  )
       ( resid 65 and name HA
  ) 3.3 1.5 0.7 volume=0.884 peak=2292 ppm1=3.283 ppm2=4.988

assign ( resid 75 and name HD1#
  )
       ( resid 75 and name HN
  ) 3.7 1.9 0.7 volume=0.414 peak=1239 ppm1=0.891 ppm2=7.052

assign ( resid 64 and name HG2
  )
       ( resid 64 and name HN
  ) 3.9 2.1 0.8 volume=0.284 peak=946 ppm1=1.756 ppm2=8.559

assign ( resid 99 and name HG2#
  )
       ( resid 102 and name HN
  ) 3.9 2.1 0.8 volume=0.314 peak=1665 ppm1=1.081 ppm2=7.839

assign ( resid 107 and name HA
  )
       ( resid 109 and name HG2#
  ) 4.5 2.7 0.9 volume=0.125 peak=1634 ppm1=3.451 ppm2=0.483

assign ( resid 83 and name HN
  )
       ( resid 83 and name HA
  ) 3.3 1.5 0.7 volume=0.877 peak=229 ppm1=7.742 ppm2=4.320

assign ( resid 82 and name HB2
  )
       ( resid 82 and name HD2
  ) 3.5 1.7 0.7 volume=0.576 peak=2019 ppm1=3.136 ppm2=6.607

assign ( resid 108 and name HA
  )
       ( resid 108 and name HB2
  ) 2.4 0.6 0.5 volume=5.793 peak=1540 ppm1=3.944 ppm2=1.366

assign ( resid 102 and name HN
  )
       ( resid 102 and name HA
  ) 3.0 1.2 0.6 volume=1.516 peak=310 ppm1=7.854 ppm2=4.324

assign ( resid 100 and name HA
  )
       ( resid 103 and name HG
  ) 3.8 2.0 0.8 volume=0.332 peak=2134 ppm1=3.211 ppm2=1.308

assign ( resid 110 and name HD2
  )
       ( resid 109 and name HG1#
  ) 3.6 1.8 0.7 volume=0.500 peak=20 ppm1=6.609 ppm2=0.323

assign ( resid 90 and name HN
  )
       ( resid 90 and name HB2
  ) 3.0 1.2 0.6 volume=1.589 peak=831 ppm1=9.126 ppm2=2.733

assign ( resid 94 and name HA1
  )
       ( resid 89 and name HB2
  ) 4.2 2.4 0.8 volume=0.199 peak=866 ppm1=3.579 ppm2=1.281

assign ( resid 77 and name HB1
  )
       ( resid 77 and name HD2#
  ) 2.7 0.9 0.5 volume=2.988 peak=1779 ppm1=1.430 ppm2=0.744

assign ( resid 77 and name HD2#
  )
       ( resid 77 and name HB1
  ) 2.4 0.6 0.5 volume=5.621 peak=1219 ppm1=0.741 ppm2=1.428

assign ( resid 104 and name HD1
  or resid 104 and name HD2
  )
       ( resid 104 and name HN
  ) 3.7 1.9 0.7 volume=0.445 peak=2111 ppm1=1.482 ppm2=8.125

assign ( resid 75 and name HA
  )
       ( resid 78 and name HB2
  ) 3.7 1.9 0.7 volume=0.390 peak=1851 ppm1=3.463 ppm2=3.186

assign ( resid 60 and name HN
  )
       ( resid 60 and name HD1 or resid 60 and name HD2
  ) 3.4 1.6 0.7 volume=0.751 peak=726 ppm1=7.702 ppm2=6.821

assign ( resid 103 and name HB1
  )
       ( resid 100 and name HA
  ) 4.2 2.4 0.8 volume=0.205 peak=1860 ppm1=1.131 ppm2=3.208

assign ( resid 100 and name HN
  )
       ( resid 99 and name HN
  ) 4.0 2.2 0.8 volume=0.275 peak=646 ppm1=8.336 ppm2=7.048

assign ( resid 77 and name HA
  )
       ( resid 80 and name HN
  ) 3.2 1.4 0.6 volume=1.046 peak=2165 ppm1=3.908 ppm2=7.092

assign ( resid 65 and name HN
  )
       ( resid 66 and name HA1
  ) 3.1 1.3 0.6 volume=1.170 peak=315 ppm1=7.855 ppm2=4.102

assign ( resid 64 and name HG2
  )
       ( resid 64 and name HB2
  ) 3.1 1.3 0.6 volume=1.161 peak=2024 ppm1=1.761 ppm2=1.388

assign ( resid 94 and name HN
  )
       ( resid 89 and name HG1
  or resid 89 and name HG2
  ) 3.5 1.7 0.7 volume=0.634 peak=436 ppm1=8.294 ppm2=1.106

assign ( resid 107 and name HB1
  )
       ( resid 107 and name HB2
  ) 2.3 0.5 0.5 volume=6.394 peak=1353 ppm1=2.050 ppm2=2.123

assign ( resid 65 and name HN
  )
       ( resid 66 and name HN
  ) 2.8 1.0 0.6 volume=2.084 peak=424 ppm1=7.855 ppm2=8.114

assign ( resid 82 and name HD2
  )
       ( resid 79 and name HA
  ) 2.8 1.0 0.6 volume=2.291 peak=54 ppm1=6.609 ppm2=3.480

assign ( resid 85 and name HA
  )
       ( resid 86 and name HN
  ) 3.3 1.5 0.7 volume=0.872 peak=1370 ppm1=4.090 ppm2=8.187

assign ( resid 104 and name HB1
  )
       ( resid 103 and name HN
  ) 3.9 2.1 0.8 volume=0.306 peak=1394 ppm1=1.675 ppm2=7.237

assign ( resid 87 and name HB2
  or resid 87 and name HB1
  )
       ( resid 87 and name HN
  ) 3.6 1.8 0.7 volume=0.534 peak=2337 ppm1=1.359 ppm2=7.709

assign ( resid 100 and name HA
  )
       ( resid 100 and name HB1
  ) 3.1 1.3 0.6 volume=1.151 peak=1059 ppm1=3.213 ppm2=3.357

assign ( resid 104 and name HA
  )
       ( resid 104 and name HN
  ) 3.0 1.2 0.6 volume=1.447 peak=2264 ppm1=3.914 ppm2=8.131

assign ( resid 106 and name HB2
  )
       ( resid 107 and name HN
  ) 3.8 2.0 0.8 volume=0.350 peak=1838 ppm1=2.818 ppm2=8.025

assign ( resid 103 and name HN
  )
       ( resid 102 and name HA
  ) 3.4 1.6 0.7 volume=0.733 peak=781 ppm1=7.219 ppm2=4.327

assign ( resid 70 and name HN
  )
       ( resid 69 and name HB1
  ) 4.3 2.5 0.9 volume=0.165 peak=335 ppm1=9.262 ppm2=2.529

assign ( resid 109 and name HB
  )
       ( resid 109 and name HG1#
  ) 2.7 0.9 0.5 volume=3.032 peak=2223 ppm1=1.780 ppm2=0.320

assign ( resid 108 and name HD2#
  )
       ( resid 108 and name HB1
  ) 2.5 0.7 0.5 volume=3.977 peak=1977 ppm1=0.798 ppm2=1.600

assign ( resid 103 and name HB1
  )
       ( resid 103 and name HN
  ) 3.7 1.9 0.7 volume=0.396 peak=1861 ppm1=1.131 ppm2=7.220

assign ( resid 81 and name HA
  )
       ( resid 81 and name HD2
  ) 3.4 1.6 0.7 volume=0.681 peak=1627 ppm1=3.936 ppm2=2.956

assign ( resid 96 and name HB2
  )
       ( resid 96 and name HG
  ) 3.2 1.4 0.6 volume=1.095 peak=1431 ppm1=1.054 ppm2=1.428

assign ( resid 73 and name HN
  )
       ( resid 72 and name HN
  ) 3.8 2.0 0.8 volume=0.372 peak=602 ppm1=7.961 ppm2=8.419

assign ( resid 92 and name HN
  )
       ( resid 91 and name HN
  ) 2.8 1.0 0.6 volume=2.116 peak=846 ppm1=8.370 ppm2=9.398

assign ( resid 97 and name HB1
  )
       ( resid 99 and name HG2#
  ) 4.3 2.5 0.9 volume=0.159 peak=1304 ppm1=2.656 ppm2=1.094

assign ( resid 65 and name HN
  )
       ( resid 66 and name HA2
  ) 3.5 1.7 0.7 volume=0.617 peak=460 ppm1=7.852 ppm2=3.680

assign ( resid 75 and name HA
  )
       ( resid 78 and name HN
  ) 4.1 2.3 0.8 volume=0.243 peak=977 ppm1=3.467 ppm2=7.445

assign ( resid 91 and name HG1
  )
       ( resid 91 and name HN
  ) 4.2 2.4 0.8 volume=0.205 peak=1065 ppm1=2.260 ppm2=9.403

assign ( resid 106 and name HB2
  )
       ( resid 97 and name HD1 or resid 97 and name HD2
  ) 4.1 2.3 0.8 volume=0.242 peak=1273 ppm1=2.814 ppm2=7.125

assign ( resid 76 and name HA
  )
       ( resid 80 and name HN
  ) 4.2 2.4 0.8 volume=0.183 peak=896 ppm1=4.201 ppm2=7.094

assign ( resid 88 and name HB2
  )
       ( resid 88 and name HD1 or resid 88 and name HD2
  ) 3.3 1.5 0.7 volume=0.857 peak=2313 ppm1=2.754 ppm2=6.812

assign ( resid 78 and name HA
  )
       ( resid 81 and name HB2
  ) 3.3 1.5 0.7 volume=0.808 peak=1163 ppm1=3.988 ppm2=1.496

assign ( resid 81 and name HA
  )
       ( resid 82 and name HN
  ) 3.2 1.4 0.6 volume=1.051 peak=1499 ppm1=3.936 ppm2=7.139

assign ( resid 69 and name HB1
  )
       ( resid 75 and name HD1#
  ) 4.1 2.3 0.8 volume=0.221 peak=1204 ppm1=2.523 ppm2=0.893

assign ( resid 108 and name HD1#
  )
       ( resid 105 and name HA
  ) 3.1 1.3 0.6 volume=1.177 peak=1623 ppm1=0.708 ppm2=3.829

assign ( resid 103 and name HD1#
  )
       ( resid 107 and name HB1
  ) 3.8 2.0 0.8 volume=0.346 peak=2209 ppm1=0.806 ppm2=2.043

assign ( resid 86 and name HA
  )
       ( resid 96 and name HD2#
  ) 4.3 2.5 0.9 volume=0.180 peak=2242 ppm1=4.101 ppm2=0.678

assign ( resid 98 and name HG2#
  )
       ( resid 85 and name HG1
  ) 4.3 2.5 0.9 volume=0.167 peak=874 ppm1=1.129 ppm2=2.119

assign ( resid 107 and name HN
  )
       ( resid 107 and name HG1
  ) 2.6 0.8 0.5 volume=3.200 peak=615 ppm1=8.027 ppm2=2.656

assign ( resid 60 and name HN
  )
       ( resid 68 and name HB1
  ) 3.5 1.7 0.7 volume=0.567 peak=463 ppm1=7.707 ppm2=3.480

assign ( resid 81 and name HA
  )
       ( resid 81 and name HG2
  or resid 81 and name HG1
  ) 2.4 0.6 0.5 volume=5.458 peak=1570 ppm1=3.940 ppm2=1.324

assign ( resid 87 and name HG1
  )
       ( resid 87 and name HA
  ) 4.0 2.2 0.8 volume=0.281 peak=2377 ppm1=1.131 ppm2=4.162

assign ( resid 69 and name HD1 or resid 69 and name HD2
  )
       ( resid 74 and name HB2
  ) 3.2 1.4 0.6 volume=0.926 peak=40 ppm1=6.905 ppm2=1.766

assign ( resid 103 and name HB2
  )
       ( resid 103 and name HD1#
  ) 3.1 1.3 0.6 volume=1.264 peak=1439 ppm1=1.829 ppm2=0.808

assign ( resid 78 and name HN
  )
       ( resid 77 and name HN
  ) 3.1 1.3 0.6 volume=1.256 peak=606 ppm1=7.444 ppm2=7.297

assign ( resid 105 and name HD2
  or resid 105 and name HD1
  )
       ( resid 105 and name HG2
  ) 2.6 0.8 0.5 volume=3.834 peak=1309 ppm1=3.051 ppm2=1.568

assign ( resid 69 and name HB1
  )
       ( resid 75 and name HD2#
  ) 4.1 2.3 0.8 volume=0.221 peak=2038 ppm1=2.524 ppm2=0.850

assign ( resid 86 and name HB#
  )
       ( resid 86 and name HA
  ) 2.8 1.0 0.6 volume=2.279 peak=1190 ppm1=1.068 ppm2=4.099

assign ( resid 77 and name HD2#
  )
       ( resid 78 and name HN
  ) 3.9 2.1 0.8 volume=0.301 peak=914 ppm1=0.736 ppm2=7.450

assign ( resid 78 and name HD2
  )
       ( resid 78 and name HB2
  ) 3.4 1.6 0.7 volume=0.700 peak=9 ppm1=6.723 ppm2=3.201

assign ( resid 91 and name HN
  )
       ( resid 90 and name HA
  ) 2.6 0.8 0.5 volume=3.326 peak=252 ppm1=9.400 ppm2=4.434

assign ( resid 101 and name HA1
  )
       ( resid 104 and name HD1
  or resid 104 and name HD2
  ) 4.2 2.4 0.8 volume=0.202 peak=1509 ppm1=3.568 ppm2=1.494

assign ( resid 95 and name HB1
  )
       ( resid 96 and name HN
  ) 3.7 1.9 0.7 volume=0.447 peak=1654 ppm1=1.274 ppm2=7.582

assign ( resid 76 and name HN
  )
       ( resid 75 and name HN
  ) 3.0 1.2 0.6 volume=1.367 peak=666 ppm1=8.457 ppm2=7.054

assign ( resid 79 and name HB2
  or resid 79 and name HB1
  )
       ( resid 80 and name HN
  ) 3.5 1.7 0.7 volume=0.584 peak=961 ppm1=1.814 ppm2=7.094

assign ( resid 91 and name HA
  )
       ( resid 91 and name HN
  ) 3.6 1.8 0.7 volume=0.509 peak=1333 ppm1=3.990 ppm2=9.403

assign ( resid 83 and name HN
  )
       ( resid 80 and name HA
  ) 3.4 1.6 0.7 volume=0.659 peak=864 ppm1=7.741 ppm2=3.946

assign ( resid 62 and name HB1
  )
       ( resid 62 and name HB2
  ) 3.2 1.4 0.6 volume=0.972 peak=1378 ppm1=3.220 ppm2=2.667

assign ( resid 89 and name HB1
  )
       ( resid 89 and name HG1
  or resid 89 and name HG2
  ) 2.8 1.0 0.6 volume=2.039 peak=1558 ppm1=1.598 ppm2=1.099

assign ( resid 103 and name HA
  )
       ( resid 103 and name HB1
  ) 3.4 1.6 0.7 volume=0.715 peak=2013 ppm1=3.030 ppm2=1.134

assign ( resid 106 and name HA
  )
       ( resid 109 and name HG2#
  ) 3.6 1.8 0.7 volume=0.459 peak=1458 ppm1=4.045 ppm2=0.485

assign ( resid 103 and name HA
  )
       ( resid 103 and name HD2#
  ) 3.2 1.4 0.6 volume=1.056 peak=2056 ppm1=3.029 ppm2=0.878

assign ( resid 95 and name HN
  )
       ( resid 94 and name HA1
  ) 3.3 1.5 0.7 volume=0.856 peak=209 ppm1=7.734 ppm2=3.575

assign ( resid 59 and name HD2
  )
       ( resid 60 and name HN
  ) 4.3 2.5 0.9 volume=0.169 peak=2186 ppm1=3.429 ppm2=7.703

assign ( resid 60 and name HN
  )
       ( resid 68 and name HB2
  ) 3.3 1.5 0.7 volume=0.903 peak=482 ppm1=7.709 ppm2=3.361

assign ( resid 100 and name HB2
  )
       ( resid 88 and name HE1 or resid 88 and name HE2
  ) 3.9 2.1 0.8 volume=0.288 peak=1078 ppm1=3.530 ppm2=6.665

assign ( resid 87 and name HA
  )
       ( resid 87 and name HN
  ) 3.7 1.9 0.7 volume=0.394 peak=2379 ppm1=4.187 ppm2=7.710

assign ( resid 110 and name HE1
  )
       ( resid 110 and name HD2
  ) 3.6 1.8 0.7 volume=0.532 peak=6 ppm1=7.857 ppm2=6.629

assign ( resid 88 and name HD1 or resid 88 and name HD2
  )
       ( resid 100 and name HB2
  ) 3.8 2.0 0.8 volume=0.374 peak=104 ppm1=6.813 ppm2=3.515

assign ( resid 95 and name HA
  )
       ( resid 95 and name HG1
  ) 3.0 1.2 0.6 volume=1.543 peak=889 ppm1=3.840 ppm2=1.034

assign ( resid 103 and name HD2#
  )
       ( resid 97 and name HD1 or resid 97 and name HD2
  ) 3.7 1.9 0.7 volume=0.413 peak=1887 ppm1=0.877 ppm2=7.106

assign ( resid 87 and name HG1
  )
       ( resid 87 and name HG2
  ) 2.3 0.5 0.5 volume=6.892 peak=2348 ppm1=1.130 ppm2=1.197

assign ( resid 86 and name HN
  )
       ( resid 80 and name HA
  ) 3.7 1.9 0.7 volume=0.437 peak=214 ppm1=8.200 ppm2=3.908

assign ( resid 68 and name HB1
  )
       ( resid 68 and name HB2
  ) 2.9 1.1 0.6 volume=1.790 peak=1195 ppm1=3.493 ppm2=3.350

assign ( resid 89 and name HN
  )
       ( resid 89 and name HG1
  or resid 89 and name HG2
  ) 3.0 1.2 0.6 volume=1.362 peak=784 ppm1=8.391 ppm2=1.103

assign ( resid 61 and name HN
  )
       ( resid 60 and name HA
  ) 2.7 0.9 0.5 volume=2.920 peak=446 ppm1=8.397 ppm2=4.597

assign ( resid 85 and name HB2
  )
       ( resid 85 and name HN
  ) 3.7 1.9 0.7 volume=0.452 peak=1826 ppm1=1.790 ppm2=7.941

assign ( resid 69 and name HB1
  )
       ( resid 75 and name HB2
  ) 4.1 2.3 0.8 volume=0.225 peak=2287 ppm1=2.522 ppm2=1.263

assign ( resid 97 and name HB2
  )
       ( resid 98 and name HG2#
  ) 3.8 2.0 0.8 volume=0.343 peak=1927 ppm1=3.113 ppm2=1.132

assign ( resid 59 and name HA
  )
       ( resid 59 and name HG1
  ) 3.2 1.4 0.6 volume=1.013 peak=967 ppm1=4.062 ppm2=1.812

assign ( resid 106 and name HD2
  )
       ( resid 90 and name HB1
  ) 3.2 1.4 0.6 volume=1.026 peak=69 ppm1=6.690 ppm2=3.262

assign ( resid 86 and name HB#
  )
       ( resid 85 and name HG2
  or resid 85 and name HG1
  ) 3.9 2.1 0.8 volume=0.294 peak=2206 ppm1=1.075 ppm2=2.096

assign ( resid 103 and name HN
  )
       ( resid 103 and name HA
  ) 2.9 1.1 0.6 volume=1.647 peak=757 ppm1=7.217 ppm2=3.029

assign ( resid 97 and name HZ
  )
       ( resid 106 and name HB1
  ) 4.7 2.9 0.9 volume=0.104 peak=43 ppm1=5.911 ppm2=2.585

assign ( resid 109 and name HA
  )
       ( resid 108 and name HB1
  ) 3.8 2.0 0.8 volume=0.358 peak=1356 ppm1=3.778 ppm2=1.589

assign ( resid 72 and name HB
  )
       ( resid 72 and name HN
  ) 3.6 1.8 0.7 volume=0.503 peak=2250 ppm1=0.881 ppm2=8.426

assign ( resid 96 and name HD1#
  )
       ( resid 89 and name HN
  ) 3.9 2.1 0.8 volume=0.298 peak=1651 ppm1=0.564 ppm2=8.397

assign ( resid 71 and name HN
  )
       ( resid 72 and name HN
  ) 3.9 2.1 0.8 volume=0.327 peak=691 ppm1=6.748 ppm2=8.434

assign ( resid 91 and name HN
  )
       ( resid 91 and name HG1
  ) 3.2 1.4 0.6 volume=1.090 peak=753 ppm1=9.401 ppm2=2.268

assign ( resid 70 and name HG2
  )
       ( resid 70 and name HB1
  or resid 70 and name HB2
  ) 2.5 0.7 0.5 volume=4.583 peak=1295 ppm1=1.668 ppm2=1.814

assign ( resid 91 and name HN
  )
       ( resid 92 and name HN
  ) 3.0 1.2 0.6 volume=1.592 peak=171 ppm1=9.402 ppm2=8.358

assign ( resid 97 and name HN
  )
       ( resid 96 and name HN
  ) 4.0 2.2 0.8 volume=0.282 peak=793 ppm1=8.694 ppm2=7.574

assign ( resid 77 and name HN
  )
       ( resid 77 and name HB1
  ) 2.7 0.9 0.5 volume=2.517 peak=817 ppm1=7.295 ppm2=1.461

assign ( resid 75 and name HD2#
  )
       ( resid 60 and name HD1 or resid 60 and name HD2
  ) 3.3 1.5 0.7 volume=0.776 peak=1583 ppm1=0.848 ppm2=6.831

assign ( resid 103 and name HB2
  )
       ( resid 103 and name HN
  ) 3.5 1.7 0.7 volume=0.604 peak=2135 ppm1=1.820 ppm2=7.223

assign ( resid 75 and name HB2
  )
       ( resid 72 and name HA
  ) 4.3 2.5 0.9 volume=0.173 peak=948 ppm1=1.256 ppm2=3.141

assign ( resid 77 and name HN
  )
       ( resid 77 and name HA
  ) 2.7 0.9 0.5 volume=2.560 peak=118 ppm1=7.291 ppm2=3.907

assign ( resid 103 and name HN
  )
       ( resid 103 and name HD2#
  ) 3.2 1.4 0.6 volume=1.016 peak=637 ppm1=7.219 ppm2=0.898

assign ( resid 102 and name HB2
  )
       ( resid 97 and name HD1 or resid 97 and name HD2
  ) 3.4 1.6 0.7 volume=0.648 peak=1667 ppm1=2.717 ppm2=7.107

assign ( resid 96 and name HG
  )
       ( resid 86 and name HB#
  ) 3.4 1.6 0.7 volume=0.736 peak=1348 ppm1=1.426 ppm2=1.069

assign ( resid 72 and name HG11
  )
       ( resid 60 and name HE1 or resid 60 and name HE2
  ) 4.3 2.5 0.9 volume=0.180 peak=1656 ppm1=0.707 ppm2=6.763

assign ( resid 71 and name HD2#
  )
       ( resid 71 and name HG
  ) 2.6 0.8 0.5 volume=3.653 peak=1697 ppm1=0.807 ppm2=1.490

assign ( resid 95 and name HN
  )
       ( resid 95 and name HG2
  ) 2.7 0.9 0.5 volume=2.658 peak=599 ppm1=7.736 ppm2=1.429

assign ( resid 71 and name HN
  )
       ( resid 69 and name HB2
  ) 3.4 1.6 0.7 volume=0.654 peak=761 ppm1=6.744 ppm2=3.059

assign ( resid 79 and name HN
  )
       ( resid 77 and name HA
  ) 3.3 1.5 0.7 volume=0.786 peak=732 ppm1=8.417 ppm2=3.922

assign ( resid 90 and name HA
  )
       ( resid 103 and name HD1#
  ) 4.3 2.5 0.9 volume=0.176 peak=1389 ppm1=4.430 ppm2=0.824

assign ( resid 65 and name HN
  )
       ( resid 64 and name HB2
  ) 3.0 1.2 0.6 volume=1.443 peak=308 ppm1=7.857 ppm2=1.409

assign ( resid 103 and name HD1#
  )
       ( resid 104 and name HN
  ) 3.7 1.9 0.7 volume=0.415 peak=2102 ppm1=0.810 ppm2=8.127

assign ( resid 78 and name HB2
  )
       ( resid 79 and name HN
  ) 4.1 2.3 0.8 volume=0.221 peak=950 ppm1=3.197 ppm2=8.421

assign ( resid 103 and name HN
  )
       ( resid 97 and name HB2
  ) 3.1 1.3 0.6 volume=1.126 peak=283 ppm1=7.215 ppm2=3.130

assign ( resid 87 and name HN
  )
       ( resid 87 and name HB2
  or resid 87 and name HB1
  ) 2.7 0.9 0.5 volume=2.883 peak=2365 ppm1=7.712 ppm2=1.380

assign ( resid 78 and name HB2
  )
       ( resid 78 and name HD2
  ) 4.4 2.6 0.9 volume=0.146 peak=1255 ppm1=3.205 ppm2=6.735

assign ( resid 64 and name HB2
  )
       ( resid 65 and name HN
  ) 3.3 1.5 0.7 volume=0.810 peak=867 ppm1=1.390 ppm2=7.876

assign ( resid 71 and name HB2
  )
       ( resid 71 and name HD2#
  ) 3.4 1.6 0.7 volume=0.735 peak=1948 ppm1=1.650 ppm2=0.809

assign ( resid 91 and name HN
  )
       ( resid 90 and name HN
  ) 4.0 2.2 0.8 volume=0.250 peak=247 ppm1=9.393 ppm2=9.119

assign ( resid 77 and name HA
  )
       ( resid 78 and name HN
  ) 3.7 1.9 0.7 volume=0.405 peak=1457 ppm1=3.903 ppm2=7.458

assign ( resid 72 and name HG12
  )
       ( resid 72 and name HD1#
  ) 2.6 0.8 0.5 volume=3.144 peak=1973 ppm1=0.781 ppm2=0.557

assign ( resid 69 and name HB2
  )
       ( resid 75 and name HB2
  ) 4.1 2.3 0.8 volume=0.217 peak=884 ppm1=3.059 ppm2=1.263

assign ( resid 97 and name HZ
  )
       ( resid 95 and name HD2
  ) 3.9 2.1 0.8 volume=0.298 peak=85 ppm1=5.913 ppm2=1.403

assign ( resid 106 and name HA
  )
       ( resid 106 and name HB1
  ) 3.0 1.2 0.6 volume=1.626 peak=1858 ppm1=4.051 ppm2=2.586

assign ( resid 89 and name HB2
  )
       ( resid 89 and name HN
  ) 3.8 2.0 0.8 volume=0.337 peak=1988 ppm1=1.293 ppm2=8.395

assign ( resid 75 and name HD2#
  )
       ( resid 75 and name HN
  ) 3.7 1.9 0.7 volume=0.409 peak=1855 ppm1=0.849 ppm2=7.046

assign ( resid 108 and name HD2#
  )
       ( resid 105 and name HA
  ) 3.2 1.4 0.6 volume=0.969 peak=1997 ppm1=0.793 ppm2=3.836

assign ( resid 78 and name HN
  )
       ( resid 77 and name HB2
  ) 3.2 1.4 0.6 volume=0.958 peak=557 ppm1=7.443 ppm2=1.558

assign ( resid 104 and name HN
  )
       ( resid 104 and name HB1
  or resid 104 and name HB2
  ) 2.4 0.6 0.5 volume=5.230 peak=596 ppm1=8.129 ppm2=1.671

assign ( resid 91 and name HN
  )
       ( resid 91 and name HA
  ) 3.2 1.4 0.6 volume=1.065 peak=782 ppm1=9.404 ppm2=4.000

assign ( resid 67 and name HA
  )
       ( resid 67 and name HN
  ) 3.2 1.4 0.6 volume=1.081 peak=1297 ppm1=3.952 ppm2=7.832

assign ( resid 102 and name HN
  )
       ( resid 101 and name HA1
  or resid 101 and name HA2
  ) 3.4 1.6 0.7 volume=0.747 peak=610 ppm1=7.852 ppm2=3.653

assign ( resid 88 and name HE1 or resid 88 and name HE2
  )
       ( resid 100 and name HB2
  ) 3.3 1.5 0.7 volume=0.766 peak=78 ppm1=6.665 ppm2=3.519

assign ( resid 61 and name HN
  )
       ( resid 60 and name HD1 or resid 60 and name HD2
  ) 3.8 2.0 0.8 volume=0.378 peak=202 ppm1=8.401 ppm2=6.823

assign ( resid 66 and name HA2
  )
       ( resid 66 and name HA1
  ) 3.0 1.2 0.6 volume=1.420 peak=1687 ppm1=3.676 ppm2=4.094

assign ( resid 59 and name HB2
  )
       ( resid 59 and name HA
  ) 3.8 2.0 0.8 volume=0.373 peak=1365 ppm1=0.976 ppm2=4.066

assign ( resid 77 and name HD2#
  )
       ( resid 80 and name HN
  ) 4.3 2.5 0.9 volume=0.174 peak=1545 ppm1=0.738 ppm2=7.092

assign ( resid 94 and name HN
  )
       ( resid 90 and name HB2
  ) 3.2 1.4 0.6 volume=0.925 peak=552 ppm1=8.295 ppm2=2.736

assign ( resid 94 and name HA2
  )
       ( resid 89 and name HB2
  ) 3.9 2.1 0.8 volume=0.328 peak=1840 ppm1=4.087 ppm2=1.293

assign ( resid 75 and name HN
  )
       ( resid 69 and name HB1
  ) 3.6 1.8 0.7 volume=0.526 peak=174 ppm1=7.049 ppm2=2.549

assign ( resid 111 and name HN
  )
       ( resid 111 and name HA
  ) 3.1 1.3 0.6 volume=1.227 peak=368 ppm1=7.580 ppm2=4.323

assign ( resid 102 and name HA
  )
       ( resid 103 and name HN
  ) 4.6 2.8 0.9 volume=0.111 peak=1818 ppm1=4.335 ppm2=7.189

assign ( resid 67 and name HN
  )
       ( resid 62 and name HA
  ) 4.2 2.4 0.8 volume=0.210 peak=491 ppm1=7.841 ppm2=4.315

assign ( resid 88 and name HN
  )
       ( resid 88 and name HB1
  ) 2.9 1.1 0.6 volume=1.895 peak=2373 ppm1=8.307 ppm2=2.646

assign ( resid 85 and name HG1
  )
       ( resid 85 and name HN
  ) 4.0 2.2 0.8 volume=0.244 peak=1978 ppm1=2.132 ppm2=7.947

assign ( resid 63 and name HA
  )
       ( resid 63 and name HN
  ) 4.4 2.6 0.9 volume=0.141 peak=1863 ppm1=4.016 ppm2=9.626

assign ( resid 108 and name HN
  )
       ( resid 109 and name HN
  ) 2.9 1.1 0.6 volume=1.661 peak=751 ppm1=6.919 ppm2=7.809

assign ( resid 72 and name HD1#
  )
       ( resid 72 and name HA
  ) 3.3 1.5 0.7 volume=0.786 peak=1410 ppm1=0.551 ppm2=3.154

assign ( resid 65 and name HN
  )
       ( resid 62 and name HA
  ) 3.8 2.0 0.8 volume=0.378 peak=170 ppm1=7.854 ppm2=4.354

assign ( resid 95 and name HG2
  )
       ( resid 95 and name HG1
  ) 2.6 0.8 0.5 volume=3.672 peak=1649 ppm1=1.423 ppm2=1.037

assign ( resid 79 and name HB2
  or resid 79 and name HB1
  )
       ( resid 79 and name HA
  ) 3.3 1.5 0.7 volume=0.891 peak=1605 ppm1=1.806 ppm2=3.464

assign ( resid 89 and name HA
  )
       ( resid 96 and name HB2
  ) 4.1 2.3 0.8 volume=0.221 peak=1747 ppm1=4.862 ppm2=1.066

assign ( resid 102 and name HN
  )
       ( resid 99 and name HN
  ) 3.7 1.9 0.7 volume=0.403 peak=667 ppm1=7.853 ppm2=7.053

assign ( resid 69 and name HB1
  )
       ( resid 69 and name HB2
  ) 3.8 2.0 0.8 volume=0.337 peak=1022 ppm1=2.512 ppm2=3.055

assign ( resid 69 and name HN
  )
       ( resid 68 and name HB2
  ) 3.1 1.3 0.6 volume=1.231 peak=468 ppm1=8.412 ppm2=3.336

assign ( resid 59 and name HB2
  )
       ( resid 60 and name HN
  ) 4.4 2.6 0.9 volume=0.155 peak=2152 ppm1=0.979 ppm2=7.720

assign ( resid 97 and name HE1 or resid 97 and name HE2
  )
       ( resid 95 and name HD1
  ) 3.2 1.4 0.6 volume=1.060 peak=2 ppm1=6.687 ppm2=1.347

assign ( resid 71 and name HA
  )
       ( resid 71 and name HD1#
  ) 3.7 1.9 0.7 volume=0.421 peak=1869 ppm1=4.875 ppm2=0.918

assign ( resid 96 and name HB1
  )
       ( resid 86 and name HB#
  ) 3.7 1.9 0.7 volume=0.438 peak=2222 ppm1=1.316 ppm2=1.069

assign ( resid 68 and name HA
  )
       ( resid 68 and name HB2
  ) 3.6 1.8 0.7 volume=0.462 peak=1912 ppm1=5.128 ppm2=3.354

assign ( resid 95 and name HA
  )
       ( resid 96 and name HD2#
  ) 3.5 1.7 0.7 volume=0.636 peak=1552 ppm1=3.847 ppm2=0.687

assign ( resid 109 and name HG2#
  )
       ( resid 111 and name HN
  ) 4.6 2.8 0.9 volume=0.107 peak=1628 ppm1=0.487 ppm2=7.581

assign ( resid 87 and name HG2
  )
       ( resid 87 and name HD2
  ) 3.3 1.5 0.7 volume=0.837 peak=2330 ppm1=1.201 ppm2=2.847

assign ( resid 109 and name HG2#
  )
       ( resid 110 and name HB2
  ) 4.3 2.5 0.9 volume=0.174 peak=1440 ppm1=0.487 ppm2=3.021

assign ( resid 62 and name HN
  )
       ( resid 68 and name HA
  ) 3.6 1.8 0.7 volume=0.513 peak=608 ppm1=8.875 ppm2=5.113

assign ( resid 100 and name HN
  )
       ( resid 100 and name HB1
  ) 3.0 1.2 0.6 volume=1.396 peak=212 ppm1=8.334 ppm2=3.367

assign ( resid 91 and name HB1
  )
       ( resid 91 and name HG1
  ) 2.6 0.8 0.5 volume=3.510 peak=1702 ppm1=1.891 ppm2=2.258

assign ( resid 85 and name HG2
  )
       ( resid 85 and name HB1
  ) 2.4 0.6 0.5 volume=5.166 peak=1510 ppm1=2.079 ppm2=1.857

assign ( resid 95 and name HD2
  )
       ( resid 95 and name HG1
  ) 2.8 1.0 0.6 volume=2.406 peak=1461 ppm1=1.396 ppm2=1.029

assign ( resid 80 and name HE2
  or resid 80 and name HE1
  )
       ( resid 80 and name HG1
  ) 2.4 0.6 0.5 volume=6.116 peak=934 ppm1=2.822 ppm2=1.354

assign ( resid 91 and name HN
  )
       ( resid 91 and name HB1
  ) 3.0 1.2 0.6 volume=1.575 peak=638 ppm1=9.398 ppm2=1.894

assign ( resid 107 and name HE22
  )
       ( resid 103 and name HD2#
  ) 3.5 1.7 0.7 volume=0.568 peak=433 ppm1=6.924 ppm2=0.851

assign ( resid 109 and name HN
  )
       ( resid 110 and name HN
  ) 2.8 1.0 0.6 volume=2.390 peak=158 ppm1=7.805 ppm2=7.108

assign ( resid 72 and name HA
  )
       ( resid 60 and name HB2
  ) 4.1 2.3 0.8 volume=0.229 peak=1533 ppm1=3.157 ppm2=2.600

assign ( resid 109 and name HG1#
  )
       ( resid 108 and name HN
  ) 4.1 2.3 0.8 volume=0.241 peak=1559 ppm1=0.307 ppm2=6.927

assign ( resid 62 and name HB1
  )
       ( resid 67 and name HN
  ) 3.6 1.8 0.7 volume=0.506 peak=1277 ppm1=3.231 ppm2=7.828

assign ( resid 77 and name HB2
  )
       ( resid 77 and name HD1#
  ) 2.8 1.0 0.6 volume=2.249 peak=1041 ppm1=1.552 ppm2=0.743

assign ( resid 72 and name HG2#
  )
       ( resid 60 and name HD1 or resid 60 and name HD2
  ) 3.9 2.1 0.8 volume=0.306 peak=1418 ppm1=0.583 ppm2=6.828

assign ( resid 64 and name HN
  )
       ( resid 64 and name HB2
  ) 2.8 1.0 0.6 volume=2.438 peak=484 ppm1=8.555 ppm2=1.406

assign ( resid 87 and name HA
  )
       ( resid 87 and name HG1
  ) 3.3 1.5 0.7 volume=0.893 peak=2369 ppm1=4.187 ppm2=1.128

assign ( resid 94 and name HN
  )
       ( resid 95 and name HN
  ) 2.4 0.6 0.5 volume=5.826 peak=727 ppm1=8.296 ppm2=7.736

assign ( resid 103 and name HD1#
  )
       ( resid 97 and name HB2
  ) 3.4 1.6 0.7 volume=0.755 peak=968 ppm1=0.808 ppm2=3.117

assign ( resid 78 and name HB2
  )
       ( resid 78 and name HN
  ) 3.7 1.9 0.7 volume=0.430 peak=1128 ppm1=3.192 ppm2=7.451

assign ( resid 72 and name HG2#
  )
       ( resid 72 and name HG11
  ) 2.4 0.6 0.5 volume=5.343 peak=1153 ppm1=0.583 ppm2=0.709

assign ( resid 68 and name HA
  )
       ( resid 69 and name HN
  ) 3.5 1.7 0.7 volume=0.542 peak=1318 ppm1=5.123 ppm2=8.413

assign ( resid 71 and name HN
  )
       ( resid 74 and name HD2#
  ) 3.4 1.6 0.7 volume=0.741 peak=812 ppm1=6.743 ppm2=0.786

assign ( resid 88 and name HB1
  )
       ( resid 88 and name HE1 or resid 88 and name HE2
  ) 3.9 2.1 0.8 volume=0.301 peak=2299 ppm1=2.632 ppm2=6.673

assign ( resid 67 and name HN
  )
       ( resid 66 and name HA2
  ) 3.3 1.5 0.7 volume=0.894 peak=485 ppm1=7.829 ppm2=3.680

assign ( resid 97 and name HB2
  )
       ( resid 97 and name HN
  ) 4.2 2.4 0.8 volume=0.205 peak=1994 ppm1=3.117 ppm2=8.695

assign ( resid 87 and name HG2
  )
       ( resid 87 and name HA
  ) 4.0 2.2 0.8 volume=0.244 peak=2349 ppm1=1.207 ppm2=4.166

assign ( resid 72 and name HA
  )
       ( resid 72 and name HG12
  ) 3.3 1.5 0.7 volume=0.871 peak=1029 ppm1=3.159 ppm2=0.785

assign ( resid 72 and name HB
  )
       ( resid 72 and name HG2#
  ) 2.8 1.0 0.6 volume=2.013 peak=1763 ppm1=0.880 ppm2=0.556

assign ( resid 74 and name HD1#
  )
       ( resid 71 and name HD1#
  ) 2.6 0.8 0.5 volume=3.621 peak=1956 ppm1=1.037 ppm2=0.931

assign ( resid 107 and name HE21
  )
       ( resid 107 and name HG1
  ) 3.0 1.2 0.6 volume=1.502 peak=414 ppm1=7.496 ppm2=2.639

assign ( resid 80 and name HN
  )
       ( resid 79 and name HN
  ) 3.3 1.5 0.7 volume=0.896 peak=363 ppm1=7.089 ppm2=8.415

assign ( resid 80 and name HB2
  or resid 80 and name HB1
  )
       ( resid 80 and name HA
  ) 3.0 1.2 0.6 volume=1.559 peak=2207 ppm1=1.717 ppm2=3.934

assign ( resid 90 and name HB1
  )
       ( resid 103 and name HD1#
  ) 3.3 1.5 0.7 volume=0.773 peak=2059 ppm1=3.260 ppm2=0.823

assign ( resid 71 and name HB2
  )
       ( resid 71 and name HN
  ) 4.6 2.8 0.9 volume=0.115 peak=2098 ppm1=1.645 ppm2=6.736

assign ( resid 90 and name HB2
  )
       ( resid 90 and name HB1
  ) 2.8 1.0 0.6 volume=2.113 peak=1048 ppm1=2.728 ppm2=3.256

assign ( resid 110 and name HD2
  )
       ( resid 110 and name HB2
  ) 2.9 1.1 0.6 volume=1.976 peak=17 ppm1=6.616 ppm2=3.018

assign ( resid 112 and name HN
  )
       ( resid 111 and name HA
  ) 2.7 0.9 0.5 volume=2.494 peak=149 ppm1=7.868 ppm2=4.325

assign ( resid 103 and name HN
  )
       ( resid 102 and name HN
  ) 3.0 1.2 0.6 volume=1.388 peak=693 ppm1=7.218 ppm2=7.855

assign ( resid 105 and name HD2
  or resid 105 and name HD1
  )
       ( resid 105 and name HG1
  ) 2.6 0.8 0.5 volume=3.899 peak=1252 ppm1=3.043 ppm2=1.445

assign ( resid 60 and name HN
  )
       ( resid 75 and name HD2#
  or resid 75 and name HD1#
  ) 3.5 1.7 0.7 volume=0.565 peak=774 ppm1=7.707 ppm2=0.873

assign ( resid 63 and name HB1
  )
       ( resid 63 and name HA
  ) 2.9 1.1 0.6 volume=1.800 peak=1805 ppm1=2.000 ppm2=4.011

assign ( resid 60 and name HN
  )
       ( resid 60 and name HB2
  ) 3.2 1.4 0.6 volume=1.060 peak=826 ppm1=7.711 ppm2=2.624

assign ( resid 90 and name HN
  )
       ( resid 103 and name HD1#
  ) 3.4 1.6 0.7 volume=0.759 peak=379 ppm1=9.126 ppm2=0.814

assign ( resid 99 and name HB
  )
       ( resid 100 and name HN
  ) 4.1 2.3 0.8 volume=0.238 peak=1969 ppm1=4.295 ppm2=8.332

assign ( resid 74 and name HB2
  )
       ( resid 75 and name HN
  ) 4.3 2.5 0.9 volume=0.179 peak=1620 ppm1=1.748 ppm2=7.051

assign ( resid 109 and name HG1#
  )
       ( resid 110 and name HN
  ) 3.4 1.6 0.7 volume=0.664 peak=1584 ppm1=0.308 ppm2=7.122

assign ( resid 74 and name HD1#
  )
       ( resid 75 and name HN
  ) 4.2 2.4 0.8 volume=0.205 peak=1271 ppm1=1.041 ppm2=7.054

assign ( resid 72 and name HN
  )
       ( resid 71 and name HG
  ) 3.9 2.1 0.8 volume=0.296 peak=683 ppm1=8.432 ppm2=1.476

assign ( resid 106 and name HN
  )
       ( resid 103 and name HA
  ) 3.0 1.2 0.6 volume=1.354 peak=716 ppm1=7.304 ppm2=3.024

assign ( resid 77 and name HB2
  )
       ( resid 77 and name HD1#
  ) 2.8 1.0 0.6 volume=2.129 peak=1330 ppm1=1.554 ppm2=0.709

assign ( resid 77 and name HD1#
  )
       ( resid 80 and name HD2
  or resid 80 and name HD1
  ) 2.3 0.5 0.5 volume=7.035 peak=1196 ppm1=0.713 ppm2=1.525

assign ( resid 107 and name HA
  )
       ( resid 109 and name HG1#
  ) 4.3 2.5 0.9 volume=0.176 peak=1359 ppm1=3.454 ppm2=0.316

assign ( resid 77 and name HD1#
  )
       ( resid 77 and name HG
  ) 2.3 0.5 0.5 volume=7.109 peak=1402 ppm1=0.714 ppm2=1.552

assign ( resid 103 and name HN
  )
       ( resid 100 and name HA
  ) 3.1 1.3 0.6 volume=1.239 peak=284 ppm1=7.218 ppm2=3.196

assign ( resid 95 and name HB2
  )
       ( resid 95 and name HA
  ) 3.4 1.6 0.7 volume=0.676 peak=1833 ppm1=1.182 ppm2=3.841

assign ( resid 79 and name HN
  )
       ( resid 76 and name HA
  ) 3.6 1.8 0.7 volume=0.494 peak=332 ppm1=8.414 ppm2=4.199

assign ( resid 97 and name HZ
  )
       ( resid 95 and name HD1
  ) 3.3 1.5 0.7 volume=0.820 peak=33 ppm1=5.914 ppm2=1.342

assign ( resid 79 and name HB2
  or resid 79 and name HB1
  )
       ( resid 78 and name HD2
  ) 3.7 1.9 0.7 volume=0.408 peak=2112 ppm1=1.810 ppm2=6.725

assign ( resid 97 and name HZ
  )
       ( resid 97 and name HE1 or resid 97 and name HE2
  ) 2.7 0.9 0.5 volume=2.796 peak=57 ppm1=5.908 ppm2=6.680

assign ( resid 60 and name HE1 or resid 60 and name HE2
  )
       ( resid 72 and name HA
  ) 3.7 1.9 0.7 volume=0.451 peak=87 ppm1=6.759 ppm2=3.158

assign ( resid 64 and name HA
  )
       ( resid 64 and name HB1
  ) 3.5 1.7 0.7 volume=0.574 peak=1989 ppm1=4.121 ppm2=1.350

assign ( resid 109 and name HN
  )
       ( resid 109 and name HG1#
  ) 2.7 0.9 0.5 volume=2.905 peak=510 ppm1=7.805 ppm2=0.322

assign ( resid 80 and name HA
  )
       ( resid 81 and name HN
  ) 3.1 1.3 0.6 volume=1.171 peak=1329 ppm1=3.929 ppm2=7.648

assign ( resid 96 and name HD1#
  )
       ( resid 94 and name HA1
  ) 4.6 2.8 0.9 volume=0.121 peak=1178 ppm1=0.558 ppm2=3.578

assign ( resid 79 and name HA
  )
       ( resid 82 and name HD2
  ) 3.2 1.4 0.6 volume=1.058 peak=911 ppm1=3.468 ppm2=6.611

assign ( resid 103 and name HD2#
  )
       ( resid 89 and name HN
  ) 3.8 2.0 0.8 volume=0.368 peak=904 ppm1=0.878 ppm2=8.396

assign ( resid 86 and name HB#
  )
       ( resid 87 and name HN
  ) 3.2 1.4 0.6 volume=0.955 peak=2362 ppm1=1.067 ppm2=7.713

assign ( resid 102 and name HB1
  )
       ( resid 97 and name HB2
  ) 3.6 1.8 0.7 volume=0.533 peak=871 ppm1=2.821 ppm2=3.107

assign ( resid 86 and name HB#
  )
       ( resid 96 and name HD1#
  ) 3.5 1.7 0.7 volume=0.618 peak=1820 ppm1=1.068 ppm2=0.563

assign ( resid 97 and name HN
  )
       ( resid 96 and name HA
  ) 2.7 0.9 0.5 volume=3.043 peak=244 ppm1=8.697 ppm2=4.757

assign ( resid 72 and name HG12
  )
       ( resid 72 and name HG2#
  ) 2.6 0.8 0.5 volume=3.144 peak=2002 ppm1=0.781 ppm2=0.579

assign ( resid 107 and name HG2
  )
       ( resid 107 and name HB1
  ) 3.4 1.6 0.7 volume=0.736 peak=2148 ppm1=2.697 ppm2=2.057

assign ( resid 74 and name HA
  )
       ( resid 74 and name HD2#
  ) 2.6 0.8 0.5 volume=3.511 peak=1567 ppm1=3.925 ppm2=0.763

assign ( resid 80 and name HE2
  or resid 80 and name HE1
  )
       ( resid 77 and name HD2#
  ) 3.2 1.4 0.6 volume=1.052 peak=1202 ppm1=2.817 ppm2=0.751

assign ( resid 108 and name HD2#
  )
       ( resid 112 and name HA1
  or resid 112 and name HA2
  ) 4.0 2.2 0.8 volume=0.272 peak=1865 ppm1=0.799 ppm2=3.673

assign ( resid 106 and name HN
  )
       ( resid 105 and name HN
  ) 2.7 0.9 0.5 volume=2.717 peak=639 ppm1=7.302 ppm2=7.549

assign ( resid 82 and name HB1
  )
       ( resid 82 and name HD2
  ) 3.3 1.5 0.7 volume=0.802 peak=1104 ppm1=3.012 ppm2=6.607

assign ( resid 87 and name HN
  )
       ( resid 98 and name HG2#
  ) 2.7 0.9 0.5 volume=2.560 peak=2323 ppm1=7.705 ppm2=1.146

assign ( resid 86 and name HN
  )
       ( resid 86 and name HA
  ) 2.6 0.8 0.5 volume=3.430 peak=208 ppm1=8.202 ppm2=4.114

assign ( resid 88 and name HN
  )
       ( resid 103 and name HD2#
  ) 3.8 2.0 0.8 volume=0.345 peak=2387 ppm1=8.309 ppm2=0.885

assign ( resid 107 and name HN
  )
       ( resid 110 and name HN
  ) 3.9 2.1 0.8 volume=0.318 peak=437 ppm1=8.025 ppm2=7.112

assign ( resid 69 and name HE1 or resid 69 and name HE2
  )
       ( resid 75 and name HA
  ) 3.7 1.9 0.7 volume=0.444 peak=7 ppm1=6.138 ppm2=3.474

assign ( resid 87 and name HN
  )
       ( resid 86 and name HB#
  ) 2.8 1.0 0.6 volume=2.228 peak=2303 ppm1=7.706 ppm2=1.091

assign ( resid 90 and name HN
  )
       ( resid 90 and name HB1
  ) 2.9 1.1 0.6 volume=1.733 peak=504 ppm1=9.126 ppm2=3.256

assign ( resid 108 and name HB2
  )
       ( resid 108 and name HD1#
  ) 2.7 0.9 0.5 volume=2.780 peak=2039 ppm1=1.353 ppm2=0.723

assign ( resid 59 and name HD1
  )
       ( resid 59 and name HG1
  ) 3.5 1.7 0.7 volume=0.603 peak=958 ppm1=3.394 ppm2=1.806

assign ( resid 99 and name HN
  )
       ( resid 99 and name HB
  ) 3.2 1.4 0.6 volume=1.046 peak=119 ppm1=7.056 ppm2=4.292

assign ( resid 79 and name HE1
  )
       ( resid 79 and name HN
  ) 4.4 2.6 0.9 volume=0.140 peak=1017 ppm1=3.078 ppm2=8.396

assign ( resid 85 and name HB2
  )
       ( resid 80 and name HE2
  or resid 80 and name HE1
  ) 4.0 2.2 0.8 volume=0.250 peak=1422 ppm1=1.797 ppm2=2.820

assign ( resid 63 and name HG2
  or resid 63 and name HG1
  )
       ( resid 63 and name HN
  ) 4.5 2.7 0.9 volume=0.121 peak=1920 ppm1=2.267 ppm2=9.656

assign ( resid 75 and name HD1#
  )
       ( resid 60 and name HB2
  ) 3.4 1.6 0.7 volume=0.733 peak=1615 ppm1=0.888 ppm2=2.630

assign ( resid 110 and name HN
  )
       ( resid 109 and name HN
  ) 2.8 1.0 0.6 volume=2.388 peak=802 ppm1=7.117 ppm2=7.801

assign ( resid 107 and name HN
  )
       ( resid 107 and name HG2
  ) 2.7 0.9 0.5 volume=2.970 peak=586 ppm1=8.028 ppm2=2.717

assign ( resid 107 and name HB1
  )
       ( resid 104 and name HA
  ) 3.6 1.8 0.7 volume=0.463 peak=1576 ppm1=2.049 ppm2=3.906

assign ( resid 94 and name HA1
  )
       ( resid 89 and name HG1
  or resid 89 and name HG2
  ) 3.5 1.7 0.7 volume=0.552 peak=1598 ppm1=3.576 ppm2=1.102

assign ( resid 69 and name HE1 or resid 69 and name HE2
  )
       ( resid 74 and name HD1#
  ) 3.4 1.6 0.7 volume=0.670 peak=3 ppm1=6.143 ppm2=1.060

assign ( resid 84 and name HA2
  or resid 84 and name HA1
  )
       ( resid 80 and name HG1  
  ) 4.1 2.3 0.8 volume=0.236 peak=3 ppm1=3.858 ppm2=1.377

assign ( resid 86 and name HB#
  )
       ( resid 79 and name HB1
  or resid 79 and name HB2  
  ) 3.8 2.0 0.8 volume=0.377 peak=34 ppm1=1.069 ppm2=1.854

 ASSIGN  (segid "   A" and resid 58   and name N   ) (segid "   A" and resid 58   and name CA  )
         (segid "   A" and resid 58   and name C   ) (segid "   A" and resid 59   and name N   )  1.00 153.08 33.08 2

 ASSIGN  (segid "   A" and resid 58   and name C   ) (segid "   A" and resid 59   and name N   )
         (segid "   A" and resid 59   and name CA  ) (segid "   A" and resid 59   and name C   )  1.00 -56.95 33.05 2

 ASSIGN  (segid "   A" and resid 59   and name N   ) (segid "   A" and resid 59   and name CA  )
         (segid "   A" and resid 59   and name C   ) (segid "   A" and resid 60   and name N   )  1.00 138.27 18.27 2

 ASSIGN  (segid "   A" and resid 59   and name C   ) (segid "   A" and resid 60   and name N   )
         (segid "   A" and resid 60   and name CA  ) (segid "   A" and resid 60   and name C   )  1.00 -101.58 28.42 2

 ASSIGN  (segid "   A" and resid 61   and name C   ) (segid "   A" and resid 62   and name N   )
         (segid "   A" and resid 62   and name CA  ) (segid "   A" and resid 62   and name C   )  1.00 -59.45 50.55 2

 ASSIGN  (segid "   A" and resid 62   and name N   ) (segid "   A" and resid 62   and name CA  )
         (segid "   A" and resid 62   and name C   ) (segid "   A" and resid 63   and name N   )  1.00 130.12 30.12 2

 ASSIGN  (segid "   A" and resid 62   and name C   ) (segid "   A" and resid 63   and name N   )
         (segid "   A" and resid 63   and name CA  ) (segid "   A" and resid 63   and name C   )  1.00 -58.30 31.70 2

 ASSIGN  (segid "   A" and resid 63   and name N   ) (segid "   A" and resid 63   and name CA  )
         (segid "   A" and resid 63   and name C   ) (segid "   A" and resid 64   and name N   )  1.00 -23.78 36.22 2

 ASSIGN  (segid "   A" and resid 63   and name C   ) (segid "   A" and resid 64   and name N   )
         (segid "   A" and resid 64   and name CA  ) (segid "   A" and resid 64   and name C   )  1.00 -64.66 35.34 2

 ASSIGN  (segid "   A" and resid 64   and name N   ) (segid "   A" and resid 64   and name CA  )
         (segid "   A" and resid 64   and name C   ) (segid "   A" and resid 65   and name N   )  1.00 -25.04 24.96 2

 ASSIGN  (segid "   A" and resid 64   and name C   ) (segid "   A" and resid 65   and name N   )
         (segid "   A" and resid 65   and name CA  ) (segid "   A" and resid 65   and name C   )  1.00 -97.30 32.70 2

 ASSIGN  (segid "   A" and resid 65   and name N   ) (segid "   A" and resid 65   and name CA  )
         (segid "   A" and resid 65   and name C   ) (segid "   A" and resid 66   and name N   )  1.00   2.48 32.48 2

 ASSIGN  (segid "   A" and resid 65   and name C   ) (segid "   A" and resid 66   and name N   )
         (segid "   A" and resid 66   and name CA  ) (segid "   A" and resid 66   and name C   )  1.00  75.69 15.69 2

 ASSIGN  (segid "   A" and resid 66   and name N   ) (segid "   A" and resid 66   and name CA  )
         (segid "   A" and resid 66   and name C   ) (segid "   A" and resid 67   and name N   )  1.00   4.54 34.54 2

 ASSIGN  (segid "   A" and resid 66   and name C   ) (segid "   A" and resid 67   and name N   )
         (segid "   A" and resid 67   and name CA  ) (segid "   A" and resid 67   and name C   )  1.00 -65.70 44.30 2

 ASSIGN  (segid "   A" and resid 67   and name N   ) (segid "   A" and resid 67   and name CA  )
         (segid "   A" and resid 67   and name C   ) (segid "   A" and resid 68   and name N   )  1.00 146.48 36.48 2

 ASSIGN  (segid "   A" and resid 67   and name C   ) (segid "   A" and resid 68   and name N   )
         (segid "   A" and resid 68   and name CA  ) (segid "   A" and resid 68   and name C   )  1.00 -96.68 73.32 2

 ASSIGN  (segid "   A" and resid 68   and name N   ) (segid "   A" and resid 68   and name CA  )
         (segid "   A" and resid 68   and name C   ) (segid "   A" and resid 69   and name N   )  1.00 136.72 46.72 2

 ASSIGN  (segid "   A" and resid 68   and name C   ) (segid "   A" and resid 69   and name N   )
         (segid "   A" and resid 69   and name CA  ) (segid "   A" and resid 69   and name C   )  1.00 -130.99 39.01 2

 ASSIGN  (segid "   A" and resid 69   and name N   ) (segid "   A" and resid 69   and name CA  )
         (segid "   A" and resid 69   and name C   ) (segid "   A" and resid 70   and name N   )  1.00 153.19 43.19 2

 ASSIGN  (segid "   A" and resid 69   and name C   ) (segid "   A" and resid 70   and name N   )
         (segid "   A" and resid 70   and name CA  ) (segid "   A" and resid 70   and name C   )  1.00 -85.03 34.97 2

 ASSIGN  (segid "   A" and resid 70   and name N   ) (segid "   A" and resid 70   and name CA  )
         (segid "   A" and resid 70   and name C   ) (segid "   A" and resid 71   and name N   )  1.00 -14.81 25.19 2

 ASSIGN  (segid "   A" and resid 70   and name C   ) (segid "   A" and resid 71   and name N   )
         (segid "   A" and resid 71   and name CA  ) (segid "   A" and resid 71   and name C   )  1.00 -135.84 44.16 2

 ASSIGN  (segid "   A" and resid 71   and name N   ) (segid "   A" and resid 71   and name CA  )
         (segid "   A" and resid 71   and name C   ) (segid "   A" and resid 72   and name N   )  1.00 160.61 40.61 2

 ASSIGN  (segid "   A" and resid 71   and name C   ) (segid "   A" and resid 72   and name N   )
         (segid "   A" and resid 72   and name CA  ) (segid "   A" and resid 72   and name C   )  1.00 -59.69 20.31 2

 ASSIGN  (segid "   A" and resid 72   and name N   ) (segid "   A" and resid 72   and name CA  )
         (segid "   A" and resid 72   and name C   ) (segid "   A" and resid 73   and name N   )  1.00 -40.49 29.51 2

 ASSIGN  (segid "   A" and resid 72   and name C   ) (segid "   A" and resid 73   and name N   )
         (segid "   A" and resid 73   and name CA  ) (segid "   A" and resid 73   and name C   )  1.00 -62.56 27.44 2

 ASSIGN  (segid "   A" and resid 73   and name N   ) (segid "   A" and resid 73   and name CA  )
         (segid "   A" and resid 73   and name C   ) (segid "   A" and resid 74   and name N   )  1.00 -35.35 34.65 2

 ASSIGN  (segid "   A" and resid 73   and name C   ) (segid "   A" and resid 74   and name N   )
         (segid "   A" and resid 74   and name CA  ) (segid "   A" and resid 74   and name C   )  1.00 -64.38 25.62 2

 ASSIGN  (segid "   A" and resid 74   and name N   ) (segid "   A" and resid 74   and name CA  )
         (segid "   A" and resid 74   and name C   ) (segid "   A" and resid 75   and name N   )  1.00 -39.00 31.00 2

 ASSIGN  (segid "   A" and resid 74   and name C   ) (segid "   A" and resid 75   and name N   )
         (segid "   A" and resid 75   and name CA  ) (segid "   A" and resid 75   and name C   )  1.00 -61.08 28.92 2

 ASSIGN  (segid "   A" and resid 75   and name N   ) (segid "   A" and resid 75   and name CA  )
         (segid "   A" and resid 75   and name C   ) (segid "   A" and resid 76   and name N   )  1.00 -43.75 26.25 2

 ASSIGN  (segid "   A" and resid 75   and name C   ) (segid "   A" and resid 76   and name N   )
         (segid "   A" and resid 76   and name CA  ) (segid "   A" and resid 76   and name C   )  1.00 -64.05 15.95 2

 ASSIGN  (segid "   A" and resid 76   and name N   ) (segid "   A" and resid 76   and name CA  )
         (segid "   A" and resid 76   and name C   ) (segid "   A" and resid 77   and name N   )  1.00 -44.24 25.76 2

 ASSIGN  (segid "   A" and resid 76   and name C   ) (segid "   A" and resid 77   and name N   )
         (segid "   A" and resid 77   and name CA  ) (segid "   A" and resid 77   and name C   )  1.00 -64.93 15.07 2

 ASSIGN  (segid "   A" and resid 77   and name N   ) (segid "   A" and resid 77   and name CA  )
         (segid "   A" and resid 77   and name C   ) (segid "   A" and resid 78   and name N   )  1.00 -44.96 25.04 2

 ASSIGN  (segid "   A" and resid 77   and name C   ) (segid "   A" and resid 78   and name N   )
         (segid "   A" and resid 78   and name CA  ) (segid "   A" and resid 78   and name C   )  1.00 -64.89 25.11 2

 ASSIGN  (segid "   A" and resid 78   and name N   ) (segid "   A" and resid 78   and name CA  )
         (segid "   A" and resid 78   and name C   ) (segid "   A" and resid 79   and name N   )  1.00 -44.36 25.64 2

 ASSIGN  (segid "   A" and resid 78   and name C   ) (segid "   A" and resid 79   and name N   )
         (segid "   A" and resid 79   and name CA  ) (segid "   A" and resid 79   and name C   )  1.00 -64.27 25.73 2

 ASSIGN  (segid "   A" and resid 79   and name N   ) (segid "   A" and resid 79   and name CA  )
         (segid "   A" and resid 79   and name C   ) (segid "   A" and resid 80   and name N   )  1.00 -44.39 25.61 2

 ASSIGN  (segid "   A" and resid 79   and name C   ) (segid "   A" and resid 80   and name N   )
         (segid "   A" and resid 80   and name CA  ) (segid "   A" and resid 80   and name C   )  1.00 -64.00 26.00 2

 ASSIGN  (segid "   A" and resid 80   and name N   ) (segid "   A" and resid 80   and name CA  )
         (segid "   A" and resid 80   and name C   ) (segid "   A" and resid 81   and name N   )  1.00 -37.50 32.50 2

 ASSIGN  (segid "   A" and resid 80   and name C   ) (segid "   A" and resid 81   and name N   )
         (segid "   A" and resid 81   and name CA  ) (segid "   A" and resid 81   and name C   )  1.00 -56.95 33.05 2

 ASSIGN  (segid "   A" and resid 81   and name N   ) (segid "   A" and resid 81   and name CA  )
         (segid "   A" and resid 81   and name C   ) (segid "   A" and resid 82   and name N   )  1.00 -33.30 26.70 2

 ASSIGN  (segid "   A" and resid 81   and name C   ) (segid "   A" and resid 82   and name N   )
         (segid "   A" and resid 82   and name CA  ) (segid "   A" and resid 82   and name C   )  1.00 -74.60 35.40 2

 ASSIGN  (segid "   A" and resid 82   and name N   ) (segid "   A" and resid 82   and name CA  )
         (segid "   A" and resid 82   and name C   ) (segid "   A" and resid 83   and name N   )  1.00 -21.02 28.98 2

 ASSIGN  (segid "   A" and resid 82   and name C   ) (segid "   A" and resid 83   and name N   )
         (segid "   A" and resid 83   and name CA  ) (segid "   A" and resid 83   and name C   )  1.00 -96.77 33.23 2

 ASSIGN  (segid "   A" and resid 83   and name N   ) (segid "   A" and resid 83   and name CA  )
         (segid "   A" and resid 83   and name C   ) (segid "   A" and resid 84   and name N   )  1.00  -4.90 35.10 2

 ASSIGN  (segid "   A" and resid 85   and name C   ) (segid "   A" and resid 86   and name N   )
         (segid "   A" and resid 86   and name CA  ) (segid "   A" and resid 86   and name C   )  1.00 -114.99 65.01 2

 ASSIGN  (segid "   A" and resid 86   and name N   ) (segid "   A" and resid 86   and name CA  )
         (segid "   A" and resid 86   and name C   ) (segid "   A" and resid 87   and name N   )  1.00 142.19 62.19 2

 ASSIGN  (segid "   A" and resid 86   and name C   ) (segid "   A" and resid 87   and name N   )
         (segid "   A" and resid 87   and name CA  ) (segid "   A" and resid 87   and name C   )  1.00 -131.41 48.59 2

 ASSIGN  (segid "   A" and resid 87   and name C   ) (segid "   A" and resid 88   and name N   )
         (segid "   A" and resid 88   and name CA  ) (segid "   A" and resid 88   and name C   )  1.00 -82.73 67.27 2

 ASSIGN  (segid "   A" and resid 88   and name N   ) (segid "   A" and resid 88   and name CA  )
         (segid "   A" and resid 88   and name C   ) (segid "   A" and resid 89   and name N   )  1.00 148.94 58.94 2

 ASSIGN  (segid "   A" and resid 88   and name C   ) (segid "   A" and resid 89   and name N   )
         (segid "   A" and resid 89   and name CA  ) (segid "   A" and resid 89   and name C   )  1.00 -115.29 34.71 2

 ASSIGN  (segid "   A" and resid 89   and name N   ) (segid "   A" and resid 89   and name CA  )
         (segid "   A" and resid 89   and name C   ) (segid "   A" and resid 90   and name N   )  1.00 126.75 26.75 2

 ASSIGN  (segid "   A" and resid 89   and name C   ) (segid "   A" and resid 90   and name N   )
         (segid "   A" and resid 90   and name CA  ) (segid "   A" and resid 90   and name C   )  1.00 -64.59 35.41 2

 ASSIGN  (segid "   A" and resid 90   and name N   ) (segid "   A" and resid 90   and name CA  )
         (segid "   A" and resid 90   and name C   ) (segid "   A" and resid 91   and name N   )  1.00 125.80 25.80 2

 ASSIGN  (segid "   A" and resid 90   and name C   ) (segid "   A" and resid 91   and name N   )
         (segid "   A" and resid 91   and name CA  ) (segid "   A" and resid 91   and name C   )  1.00 -63.13 36.87 2

 ASSIGN  (segid "   A" and resid 91   and name N   ) (segid "   A" and resid 91   and name CA  )
         (segid "   A" and resid 91   and name C   ) (segid "   A" and resid 92   and name N   )  1.00 -16.97 33.03 2

 ASSIGN  (segid "   A" and resid 91   and name C   ) (segid "   A" and resid 92   and name N   )
         (segid "   A" and resid 92   and name CA  ) (segid "   A" and resid 92   and name C   )  1.00 -76.92 43.08 2

 ASSIGN  (segid "   A" and resid 92   and name N   ) (segid "   A" and resid 92   and name CA  )
         (segid "   A" and resid 92   and name C   ) (segid "   A" and resid 93   and name N   )  1.00 -11.19 38.81 2

 ASSIGN  (segid "   A" and resid 92   and name C   ) (segid "   A" and resid 93   and name N   )
         (segid "   A" and resid 93   and name CA  ) (segid "   A" and resid 93   and name C   )  1.00 -104.55 25.45 2

 ASSIGN  (segid "   A" and resid 93   and name N   ) (segid "   A" and resid 93   and name CA  )
         (segid "   A" and resid 93   and name C   ) (segid "   A" and resid 94   and name N   )  1.00   4.33 44.33 2

 ASSIGN  (segid "   A" and resid 93   and name C   ) (segid "   A" and resid 94   and name N   )
         (segid "   A" and resid 94   and name CA  ) (segid "   A" and resid 94   and name C   )  1.00  76.07 16.07 2

 ASSIGN  (segid "   A" and resid 94   and name N   ) (segid "   A" and resid 94   and name CA  )
         (segid "   A" and resid 94   and name C   ) (segid "   A" and resid 95   and name N   )  1.00   4.42 34.42 2

 ASSIGN  (segid "   A" and resid 94   and name C   ) (segid "   A" and resid 95   and name N   )
         (segid "   A" and resid 95   and name CA  ) (segid "   A" and resid 95   and name C   )  1.00 -71.21 38.79 2

 ASSIGN  (segid "   A" and resid 95   and name N   ) (segid "   A" and resid 95   and name CA  )
         (segid "   A" and resid 95   and name C   ) (segid "   A" and resid 96   and name N   )  1.00 152.54 32.54 2

 ASSIGN  (segid "   A" and resid 95   and name C   ) (segid "   A" and resid 96   and name N   )
         (segid "   A" and resid 96   and name CA  ) (segid "   A" and resid 96   and name C   )  1.00 -121.08 48.92 2

 ASSIGN  (segid "   A" and resid 96   and name N   ) (segid "   A" and resid 96   and name CA  )
         (segid "   A" and resid 96   and name C   ) (segid "   A" and resid 97   and name N   )  1.00 135.13 35.13 2

 ASSIGN  (segid "   A" and resid 96   and name C   ) (segid "   A" and resid 97   and name N   )
         (segid "   A" and resid 97   and name CA  ) (segid "   A" and resid 97   and name C   )  1.00 -134.15 35.85 2

 ASSIGN  (segid "   A" and resid 97   and name N   ) (segid "   A" and resid 97   and name CA  )
         (segid "   A" and resid 97   and name C   ) (segid "   A" and resid 98   and name N   )  1.00 152.83 42.83 2

 ASSIGN  (segid "   A" and resid 97   and name C   ) (segid "   A" and resid 98   and name N   )
         (segid "   A" and resid 98   and name CA  ) (segid "   A" and resid 98   and name C   )  1.00 -84.99 15.01 2

 ASSIGN  (segid "   A" and resid 99   and name N   ) (segid "   A" and resid 99   and name CA  )
         (segid "   A" and resid 99   and name C   ) (segid "   A" and resid 100  and name N   )  1.00 161.04 31.04 2

 ASSIGN  (segid "   A" and resid 99   and name C   ) (segid "   A" and resid 100  and name N   )
         (segid "   A" and resid 100  and name CA  ) (segid "   A" and resid 100  and name C   )  1.00 -64.89 25.11 2

 ASSIGN  (segid "   A" and resid 100  and name N   ) (segid "   A" and resid 100  and name CA  )
         (segid "   A" and resid 100  and name C   ) (segid "   A" and resid 101  and name N   )  1.00 -25.51 34.49 2

 ASSIGN  (segid "   A" and resid 100  and name C   ) (segid "   A" and resid 101  and name N   )
         (segid "   A" and resid 101  and name CA  ) (segid "   A" and resid 101  and name C   )  1.00 -64.21 25.79 2

 ASSIGN  (segid "   A" and resid 101  and name N   ) (segid "   A" and resid 101  and name CA  )
         (segid "   A" and resid 101  and name C   ) (segid "   A" and resid 102  and name N   )  1.00 -42.72 27.28 2

 ASSIGN  (segid "   A" and resid 101  and name C   ) (segid "   A" and resid 102  and name N   )
         (segid "   A" and resid 102  and name CA  ) (segid "   A" and resid 102  and name C   )  1.00 -64.94 25.06 2

 ASSIGN  (segid "   A" and resid 102  and name N   ) (segid "   A" and resid 102  and name CA  )
         (segid "   A" and resid 102  and name C   ) (segid "   A" and resid 103  and name N   )  1.00 -44.01 15.99 2

 ASSIGN  (segid "   A" and resid 102  and name C   ) (segid "   A" and resid 103  and name N   )
         (segid "   A" and resid 103  and name CA  ) (segid "   A" and resid 103  and name C   )  1.00 -64.87 25.13 2

 ASSIGN  (segid "   A" and resid 103  and name N   ) (segid "   A" and resid 103  and name CA  )
         (segid "   A" and resid 103  and name C   ) (segid "   A" and resid 104  and name N   )  1.00 -44.52 15.48 2

 ASSIGN  (segid "   A" and resid 103  and name C   ) (segid "   A" and resid 104  and name N   )
         (segid "   A" and resid 104  and name CA  ) (segid "   A" and resid 104  and name C   )  1.00 -64.30 25.70 2

 ASSIGN  (segid "   A" and resid 104  and name N   ) (segid "   A" and resid 104  and name CA  )
         (segid "   A" and resid 104  and name C   ) (segid "   A" and resid 105  and name N   )  1.00 -43.50 26.50 2

 ASSIGN  (segid "   A" and resid 104  and name C   ) (segid "   A" and resid 105  and name N   )
         (segid "   A" and resid 105  and name CA  ) (segid "   A" and resid 105  and name C   )  1.00 -64.20 25.80 2

 ASSIGN  (segid "   A" and resid 105  and name N   ) (segid "   A" and resid 105  and name CA  )
         (segid "   A" and resid 105  and name C   ) (segid "   A" and resid 106  and name N   )  1.00 -44.12 25.88 2

 ASSIGN  (segid "   A" and resid 105  and name C   ) (segid "   A" and resid 106  and name N   )
         (segid "   A" and resid 106  and name CA  ) (segid "   A" and resid 106  and name C   )  1.00 -64.52 25.48 2

 ASSIGN  (segid "   A" and resid 106  and name N   ) (segid "   A" and resid 106  and name CA  )
         (segid "   A" and resid 106  and name C   ) (segid "   A" and resid 107  and name N   )  1.00 -44.13 25.87 2

 ASSIGN  (segid "   A" and resid 106  and name C   ) (segid "   A" and resid 107  and name N   )
         (segid "   A" and resid 107  and name CA  ) (segid "   A" and resid 107  and name C   )  1.00 -62.84 27.16 2

 ASSIGN  (segid "   A" and resid 107  and name N   ) (segid "   A" and resid 107  and name CA  )
         (segid "   A" and resid 107  and name C   ) (segid "   A" and resid 108  and name N   )  1.00 -44.75 25.25 2

 ASSIGN  (segid "   A" and resid 107  and name C   ) (segid "   A" and resid 108  and name N   )
         (segid "   A" and resid 108  and name CA  ) (segid "   A" and resid 108  and name C   )  1.00 -63.97 26.03 2

 ASSIGN  (segid "   A" and resid 108  and name N   ) (segid "   A" and resid 108  and name CA  )
         (segid "   A" and resid 108  and name C   ) (segid "   A" and resid 109  and name N   )  1.00 -36.39 33.61 2

 ASSIGN  (segid "   A" and resid 108  and name C   ) (segid "   A" and resid 109  and name N   )
         (segid "   A" and resid 109  and name CA  ) (segid "   A" and resid 109  and name C   )  1.00 -59.72 30.28 2

 ASSIGN  (segid "   A" and resid 109  and name N   ) (segid "   A" and resid 109  and name CA  )
         (segid "   A" and resid 109  and name C   ) (segid "   A" and resid 110  and name N   )  1.00 -30.47 29.53 2

 ASSIGN  (segid "   A" and resid 109  and name C   ) (segid "   A" and resid 110  and name N   )
         (segid "   A" and resid 110  and name CA  ) (segid "   A" and resid 110  and name C   )  1.00 -92.55 27.45 2

 ASSIGN  (segid "   A" and resid 110  and name N   ) (segid "   A" and resid 110  and name CA  )
         (segid "   A" and resid 110  and name C   ) (segid "   A" and resid 111  and name N   )  1.00  -6.41 43.59 2

 ASSIGN  (segid "   A" and resid 82   and name C   ) (segid "   A" and resid 83   and name N   )
         (segid "   A" and resid 83   and name CA  ) (segid "   A" and resid 83   and name C   )  1.00 -96.77 33.23 2

ASSIGN  (segid "   A" and resid 60    and name N   ) (segid "   A" and resid 60    and name CA   )
         (segid "   A" and resid 60    and name CB  ) (segid "   A" and resid 60   and name CG   )  1.00 -60.00 40.00 2

ASSIGN  (segid "   A" and resid 62    and name N   ) (segid "   A" and resid 62    and name CA   )
         (segid "   A" and resid 62    and name CB  ) (segid "   A" and resid 62   and name SGZN   )  1.00 180.00 40.00 2

ASSIGN  (segid "   A" and resid 65    and name N   ) (segid "   A" and resid 65    and name CA   )
         (segid "   A" and resid 65    and name CB  ) (segid "   A" and resid 65    and name SG   )  1.00  60.00 40.00 2

ASSIGN  (segid "   A" and resid 75    and name N   ) (segid "   A" and resid 75    and name CA   )
         (segid "   A" and resid 75    and name CB  ) (segid "   A" and resid 75    and name CG   )  1.00 180.00 40.00 2

ASSIGN  (segid "   A" and resid 78    and name N   ) (segid "   A" and resid 78    and name CA   )
         (segid "   A" and resid 78    and name CB  ) (segid "   A" and resid 78    and name CG   )  1.00 180.00 40.00 2

ASSIGN  (segid "   A" and resid 82    and name N   ) (segid "   A" and resid 82    and name CA   )
         (segid "   A" and resid 82    and name CB  ) (segid "   A" and resid 82    and name CG   )  1.00 -60.00 40.00 2

ASSIGN  (segid "   A" and resid 88    and name N   ) (segid "   A" and resid 88    and name CA   )
         (segid "   A" and resid 88    and name CB  ) (segid "   A" and resid 88    and name CG   )  1.00 -60.00 40.00 2

ASSIGN  (segid "   A" and resid 93    and name N   ) (segid "   A" and resid 93    and name CA   )
         (segid "   A" and resid 93    and name CB  ) (segid "   A" and resid 93    and name SG   )  1.00  60.00 40.00 2

ASSIGN  (segid "   A" and resid 106    and name N   ) (segid "   A" and resid 106    and name CA   )
         (segid "   A" and resid 106    and name CB  ) (segid "   A" and resid 106    and name CG   )  1.00 180.00 40.00 2

ASSIGN  (segid "   A" and resid 110    and name N   ) (segid "   A" and resid 110    and name CA   )
         (segid "   A" and resid 110    and name CB  ) (segid "   A" and resid 110    and name CG   )  1.00 -60.00 40.00 2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    LYS  58           HT1      LYS  58 -15.843  -9.541  -5.542
    2    HA   LYS  58           HA       LYS  58 -15.436  -9.953  -3.281
    3    HB2  LYS  58           HB2      LYS  58 -12.796  -9.656  -4.738
    4    HB3  LYS  58           HB1      LYS  58 -13.023 -10.567  -3.255
    5    HG2  LYS  58           HG2      LYS  58 -13.057 -12.219  -4.854
    6    HG3  LYS  58           HG1      LYS  58 -14.775 -11.895  -4.629
    7    HD2  LYS  58           HD2      LYS  58 -14.807 -10.508  -6.611
    8    HD3  LYS  58           HD1      LYS  58 -13.065 -10.708  -6.808
    9    HE2  LYS  58           HE2      LYS  58 -14.224 -12.174  -8.332
   10    HE3  LYS  58           HE1      LYS  58 -13.405 -13.130  -7.100
   11    HZ1  LYS  58           HZ1      LYS  58 -15.497 -13.422  -5.958
   12    HZ2  LYS  58           HZ2      LYS  58 -15.652 -13.922  -7.571
   13    HZ3  LYS  58           HZ3      LYS  58 -16.292 -12.434  -7.086
   14    HA   PRO  59           HA       PRO  59 -14.606  -6.353  -0.830
   15    HB2  PRO  59           HB2      PRO  59 -13.941  -8.362   1.250
   16    HB3  PRO  59           HB1      PRO  59 -15.101  -7.030   1.302
   17    HG2  PRO  59           HG2      PRO  59 -15.923  -9.555   1.057
   18    HG3  PRO  59           HG1      PRO  59 -16.737  -8.231   0.202
   19    HD2  PRO  59           HD2      PRO  59 -14.809 -10.259  -0.851
   20    HD3  PRO  59           HD1      PRO  59 -16.248  -9.565  -1.613
   21    H    TYR  60           HN       TYR  60 -12.868  -5.320  -1.135
   22    HA   TYR  60           HA       TYR  60 -10.238  -6.567  -0.718
   23    HB2  TYR  60           HB2      TYR  60 -10.967  -4.052  -2.243
   24    HB3  TYR  60           HB1      TYR  60  -9.340  -4.708  -2.073
   25    HD1  TYR  60           HD2      TYR  60  -9.653  -7.522  -2.549
   26    HD2  TYR  60           HD1      TYR  60 -11.585  -4.244  -4.449
   27    HE1  TYR  60           HE2      TYR  60 -10.011  -8.898  -4.544
   28    HE2  TYR  60           HE1      TYR  60 -11.947  -5.614  -6.448
   29    HH   TYR  60           HH       TYR  60 -11.700  -8.912  -6.502
   30    H    GLY  61           HN       GLY  61  -9.650  -6.231   1.350
   31    HA2  GLY  61           HA2      GLY  61 -10.417  -3.648   2.520
   32    HA3  GLY  61           HA1      GLY  61 -10.348  -5.151   3.425
   33    H    CYS  62           HN       CYS  62  -9.150  -2.702   4.004
   34    HA   CYS  62           HA       CYS  62  -6.383  -2.650   3.389
   35    HB2  CYS  62           HB2      CYS  62  -7.864  -0.722   4.159
   36    HB3  CYS  62           HB1      CYS  62  -7.733  -1.389   5.781
   37    H    GLU  63           HN       GLU  63  -5.002  -4.158   4.025
   38    HA   GLU  63           HA       GLU  63  -5.264  -5.996   6.115
   39    HB2  GLU  63           HB2      GLU  63  -3.704  -6.285   4.275
   40    HB3  GLU  63           HB1      GLU  63  -2.801  -4.863   4.764
   41    HG2  GLU  63           HG2      GLU  63  -2.249  -6.065   6.896
   42    HG3  GLU  63           HG1      GLU  63  -2.975  -7.507   6.185
   43    H    GLU  64           HN       GLU  64  -4.571  -2.713   6.202
   44    HA   GLU  64           HA       GLU  64  -2.844  -2.737   8.505
   45    HB2  GLU  64           HB2      GLU  64  -2.101  -1.128   7.124
   46    HB3  GLU  64           HB1      GLU  64  -3.669  -0.891   6.381
   47    HG2  GLU  64           HG2      GLU  64  -4.258   0.267   8.619
   48    HG3  GLU  64           HG1      GLU  64  -2.499   0.401   8.786
   49    H    CYS  65           HN       CYS  65  -6.172  -1.683   7.739
   50    HA   CYS  65           HA       CYS  65  -6.503  -1.054  10.580
   51    HB2  CYS  65           HB2      CYS  65  -8.022   0.812   9.828
   52    HB3  CYS  65           HB1      CYS  65  -6.314   1.053   9.473
   53    H    GLY  66           HN       GLY  66  -7.749  -2.440   7.703
   54    HA2  GLY  66           HA2      GLY  66  -9.002  -4.366   7.766
   55    HA3  GLY  66           HA1      GLY  66  -9.541  -3.945   9.385
   56    H    LYS  67           HN       LYS  67  -9.769  -1.687   6.712
   57    HA   LYS  67           HA       LYS  67 -12.687  -2.008   6.749
   58    HB2  LYS  67           HB2      LYS  67 -10.953   0.248   5.729
   59    HB3  LYS  67           HB1      LYS  67 -12.692   0.168   5.479
   60    HG2  LYS  67           HG2      LYS  67 -12.988   0.117   7.945
   61    HG3  LYS  67           HG1      LYS  67 -11.247   0.369   8.113
   62    HD2  LYS  67           HD2      LYS  67 -11.401   2.483   6.953
   63    HD3  LYS  67           HD1      LYS  67 -13.113   2.213   6.625
   64    HE2  LYS  67           HE2      LYS  67 -11.860   2.555   9.345
   65    HE3  LYS  67           HE1      LYS  67 -12.807   3.764   8.482
   66    HZ1  LYS  67           HZ1      LYS  67 -13.767   1.155   9.524
   67    HZ2  LYS  67           HZ2      LYS  67 -14.689   2.175   8.535
   68    HZ3  LYS  67           HZ3      LYS  67 -14.206   2.701  10.074
   69    H    SER  68           HN       SER  68 -13.674  -3.023   5.117
   70    HA   SER  68           HA       SER  68 -12.117  -3.770   2.791
   71    HB2  SER  68           HB2      SER  68 -14.673  -4.765   2.420
   72    HB3  SER  68           HB1      SER  68 -13.299  -5.641   3.108
   73    HG   SER  68           HG       SER  68 -14.731  -5.795   4.706
   74    H    TYR  69           HN       TYR  69 -12.443  -3.142   0.757
   75    HA   TYR  69           HA       TYR  69 -14.573  -1.162   0.281
   76    HB2  TYR  69           HB2      TYR  69 -11.727  -1.218  -0.674
   77    HB3  TYR  69           HB1      TYR  69 -12.957  -0.370  -1.598
   78    HD1  TYR  69           HD2      TYR  69 -11.418  -0.610   1.749
   79    HD2  TYR  69           HD1      TYR  69 -13.622   1.780  -0.980
   80    HE1  TYR  69           HE2      TYR  69 -11.161   1.320   3.252
   81    HE2  TYR  69           HE1      TYR  69 -13.368   3.717   0.493
   82    HH   TYR  69           HH       TYR  69 -11.159   3.858   2.990
   83    H    ARG  70           HN       ARG  70 -15.348  -1.021  -1.945
   84    HA   ARG  70           HA       ARG  70 -16.040  -3.618  -2.901
   85    HB2  ARG  70           HB2      ARG  70 -16.539  -0.892  -4.111
   86    HB3  ARG  70           HB1      ARG  70 -17.272  -2.388  -4.665
   87    HG2  ARG  70           HG2      ARG  70 -17.641  -1.193  -1.926
   88    HG3  ARG  70           HG1      ARG  70 -18.775  -1.039  -3.269
   89    HD2  ARG  70           HD2      ARG  70 -18.926  -3.531  -3.321
   90    HD3  ARG  70           HD1      ARG  70 -17.951  -3.567  -1.851
   91    HE   ARG  70           HE       ARG  70 -20.014  -1.895  -1.237
   92   HH11  ARG  70          HH11      ARG  70 -19.849  -5.153  -2.516
   93   HH12  ARG  70          HH12      ARG  70 -21.313  -5.672  -1.734
   94   HH21  ARG  70          HH21      ARG  70 -21.932  -2.560  -0.222
   95   HH22  ARG  70          HH22      ARG  70 -22.500  -4.194  -0.409
   96    H    LEU  71           HN       LEU  71 -13.952  -1.016  -4.143
   97    HA   LEU  71           HA       LEU  71 -13.096  -2.856  -6.271
   98    HB2  LEU  71           HB2      LEU  71 -12.848   0.154  -6.197
   99    HB3  LEU  71           HB1      LEU  71 -12.374  -0.891  -7.524
  100    HG   LEU  71           HG       LEU  71 -14.342  -0.198  -8.356
  101   HD11  LEU  71          HD11      LEU  71 -14.598  -2.618  -7.977
  102   HD12  LEU  71          HD12      LEU  71 -16.129  -1.746  -8.037
  103   HD13  LEU  71          HD13      LEU  71 -15.458  -2.242  -6.480
  104   HD21  LEU  71          HD21      LEU  71 -14.740   1.346  -6.475
  105   HD22  LEU  71          HD22      LEU  71 -15.565   0.032  -5.633
  106   HD23  LEU  71          HD23      LEU  71 -16.212   0.649  -7.152
  107    H    ILE  72           HN       ILE  72 -10.830  -2.692  -6.945
  108    HA   ILE  72           HA       ILE  72  -9.007  -2.704  -4.763
  109    HB   ILE  72           HB       ILE  72  -8.628  -2.778  -7.752
  110   HG12  ILE  72          HG12      ILE  72  -9.467  -4.764  -6.473
  111   HG13  ILE  72          HG11      ILE  72  -7.980  -5.056  -7.369
  112   HG21  ILE  72          HG21      ILE  72  -6.727  -1.546  -6.847
  113   HG22  ILE  72          HG22      ILE  72  -6.243  -3.143  -7.417
  114   HG23  ILE  72          HG23      ILE  72  -6.434  -2.845  -5.691
  115   HD11  ILE  72          HD11      ILE  72  -7.958  -6.065  -5.135
  116   HD12  ILE  72          HD12      ILE  72  -8.154  -4.464  -4.419
  117   HD13  ILE  72          HD13      ILE  72  -6.690  -4.854  -5.324
  118    H    SER  73           HN       SER  73  -9.720  -0.409  -7.354
  119    HA   SER  73           HA       SER  73  -7.771   1.503  -6.711
  120    HB2  SER  73           HB2      SER  73 -10.448   2.220  -7.874
  121    HB3  SER  73           HB1      SER  73  -8.859   2.880  -8.264
  122    HG   SER  73           HG       SER  73  -8.635   1.394  -9.722
  123    H    LEU  74           HN       LEU  74 -11.060   1.023  -5.595
  124    HA   LEU  74           HA       LEU  74 -11.445   3.233  -4.012
  125    HB2  LEU  74           HB2      LEU  74 -12.514   0.572  -4.306
  126    HB3  LEU  74           HB1      LEU  74 -12.452   1.019  -2.609
  127    HG   LEU  74           HG       LEU  74 -13.872   2.489  -4.814
  128   HD11  LEU  74          HD11      LEU  74 -15.865   1.937  -3.528
  129   HD12  LEU  74          HD12      LEU  74 -14.881   1.082  -2.340
  130   HD13  LEU  74          HD13      LEU  74 -15.006   0.465  -3.993
  131   HD21  LEU  74          HD21      LEU  74 -14.591   3.901  -2.829
  132   HD22  LEU  74          HD22      LEU  74 -12.946   4.111  -3.440
  133   HD23  LEU  74          HD23      LEU  74 -13.225   3.161  -1.982
  134    H    LEU  75           HN       LEU  75 -10.124   0.142  -3.081
  135    HA   LEU  75           HA       LEU  75  -9.417   0.910  -0.448
  136    HB2  LEU  75           HB2      LEU  75  -9.831  -1.358  -0.836
  137    HB3  LEU  75           HB1      LEU  75  -8.826  -1.380  -2.281
  138    HG   LEU  75           HG       LEU  75  -6.855  -0.997  -0.725
  139   HD11  LEU  75          HD11      LEU  75  -8.905  -1.878   1.298
  140   HD12  LEU  75          HD12      LEU  75  -8.118  -0.300   1.237
  141   HD13  LEU  75          HD13      LEU  75  -7.168  -1.747   1.574
  142   HD21  LEU  75          HD21      LEU  75  -7.323  -3.035  -1.892
  143   HD22  LEU  75          HD22      LEU  75  -8.481  -3.518  -0.643
  144   HD23  LEU  75          HD23      LEU  75  -6.756  -3.397  -0.255
  145    H    ASN  76           HN       ASN  76  -7.982   1.084  -3.534
  146    HA   ASN  76           HA       ASN  76  -5.260   1.379  -2.746
  147    HB2  ASN  76           HB2      ASN  76  -6.583   1.006  -5.121
  148    HB3  ASN  76           HB1      ASN  76  -6.087   2.696  -5.245
  149   HD21  ASN  76          HD21      ASN  76  -5.038  -0.597  -4.932
  150   HD22  ASN  76          HD22      ASN  76  -3.388  -0.340  -5.400
  151    H    LEU  77           HN       LEU  77  -7.963   3.542  -3.372
  152    HA   LEU  77           HA       LEU  77  -6.425   5.908  -2.912
  153    HB2  LEU  77           HB2      LEU  77  -9.211   5.194  -3.573
  154    HB3  LEU  77           HB1      LEU  77  -8.986   6.701  -2.711
  155    HG   LEU  77           HG       LEU  77  -9.043   6.648  -5.322
  156   HD11  LEU  77          HD11      LEU  77  -7.613   8.626  -5.331
  157   HD12  LEU  77          HD12      LEU  77  -6.992   8.177  -3.742
  158   HD13  LEU  77          HD13      LEU  77  -8.689   8.604  -3.936
  159   HD21  LEU  77          HD21      LEU  77  -7.275   4.963  -5.574
  160   HD22  LEU  77          HD22      LEU  77  -6.135   6.052  -4.787
  161   HD23  LEU  77          HD23      LEU  77  -6.846   6.491  -6.340
  162    H    HIS  78           HN       HIS  78  -8.346   3.718  -1.052
  163    HA   HIS  78           HA       HIS  78  -8.470   5.220   1.344
  164    HB2  HIS  78           HB2      HIS  78  -9.858   3.276   1.166
  165    HB3  HIS  78           HB1      HIS  78  -8.475   2.246   0.786
  166    HD1  HIS  78           HD1      HIS  78 -10.378   3.675   3.655
  167    HD2  HIS  78           HD2      HIS  78  -6.874   1.535   2.985
  168    HE1  HIS  78           HE1      HIS  78  -9.616   2.828   5.915
  169    H    LYS  79           HN       LYS  79  -6.114   3.009  -0.041
  170    HA   LYS  79           HA       LYS  79  -4.362   3.044   2.214
  171    HB2  LYS  79           HB2      LYS  79  -4.576   1.341   0.201
  172    HB3  LYS  79           HB1      LYS  79  -3.413   2.419  -0.562
  173    HG2  LYS  79           HG2      LYS  79  -2.225   0.624   0.474
  174    HG3  LYS  79           HG1      LYS  79  -1.920   2.097   1.397
  175    HD2  LYS  79           HD2      LYS  79  -2.328   0.356   2.967
  176    HD3  LYS  79           HD1      LYS  79  -3.759   1.387   2.952
  177    HE2  LYS  79           HE2      LYS  79  -4.595  -0.814   2.939
  178    HE3  LYS  79           HE1      LYS  79  -4.732  -0.262   1.271
  179    HZ1  LYS  79           HZ1      LYS  79  -3.815  -2.558   1.587
  180    HZ2  LYS  79           HZ2      LYS  79  -2.427  -1.846   2.257
  181    HZ3  LYS  79           HZ3      LYS  79  -2.855  -1.524   0.643
  182    H    LYS  80           HN       LYS  80  -4.636   4.766  -0.822
  183    HA   LYS  80           HA       LYS  80  -2.384   6.412  -0.607
  184    HB2  LYS  80           HB2      LYS  80  -3.573   6.311  -2.679
  185    HB3  LYS  80           HB1      LYS  80  -5.070   6.837  -1.922
  186    HG2  LYS  80           HG2      LYS  80  -4.239   9.040  -1.643
  187    HG3  LYS  80           HG1      LYS  80  -2.608   8.557  -2.078
  188    HD2  LYS  80           HD2      LYS  80  -4.950   8.354  -3.953
  189    HD3  LYS  80           HD1      LYS  80  -3.909   9.779  -3.853
  190    HE2  LYS  80           HE2      LYS  80  -1.962   8.329  -4.299
  191    HE3  LYS  80           HE1      LYS  80  -3.067   6.972  -4.524
  192    HZ1  LYS  80           HZ1      LYS  80  -2.831   9.415  -6.185
  193    HZ2  LYS  80           HZ2      LYS  80  -4.140   8.349  -6.316
  194    HZ3  LYS  80           HZ3      LYS  80  -2.569   7.808  -6.660
  195    H    ARG  81           HN       ARG  81  -5.658   6.710   0.690
  196    HA   ARG  81           HA       ARG  81  -5.527   9.348   1.581
  197    HB2  ARG  81           HB2      ARG  81  -7.527   7.810   1.461
  198    HB3  ARG  81           HB1      ARG  81  -6.991   7.144   2.997
  199    HG2  ARG  81           HG2      ARG  81  -7.201   9.325   4.039
  200    HG3  ARG  81           HG1      ARG  81  -7.693  10.026   2.493
  201    HD2  ARG  81           HD2      ARG  81  -9.700   9.624   3.624
  202    HD3  ARG  81           HD1      ARG  81  -9.526   8.289   2.483
  203    HE   ARG  81           HE       ARG  81  -8.501   7.789   5.145
  204   HH11  ARG  81          HH11      ARG  81 -11.188   7.414   2.917
  205   HH12  ARG  81          HH12      ARG  81 -11.965   6.204   3.893
  206   HH21  ARG  81          HH21      ARG  81  -9.515   6.217   6.400
  207   HH22  ARG  81          HH22      ARG  81 -11.036   5.534   5.880
  208    H    HIS  82           HN       HIS  82  -4.431   6.381   3.150
  209    HA   HIS  82           HA       HIS  82  -4.045   7.517   5.716
  210    HB2  HIS  82           HB2      HIS  82  -3.116   4.995   4.400
  211    HB3  HIS  82           HB1      HIS  82  -2.497   5.446   5.970
  212    HD1  HIS  82           HD1      HIS  82  -4.145   5.254   7.973
  213    HD2  HIS  82           HD2      HIS  82  -5.692   4.138   4.296
  214    HE1  HIS  82           HE1      HIS  82  -6.262   3.981   8.457
  215    H    SER  83           HN       SER  83  -2.020   7.332   2.868
  216    HA   SER  83           HA       SER  83   0.203   8.488   4.405
  217    HB2  SER  83           HB2      SER  83   1.543   7.857   2.324
  218    HB3  SER  83           HB1      SER  83   0.930   6.520   3.301
  219    HG   SER  83           HG       SER  83   0.159   7.385   0.756
  220    H    GLY  84           HN       GLY  84  -2.308   9.714   3.028
  221    HA2  GLY  84           HA2      GLY  84  -2.663  11.878   2.211
  222    HA3  GLY  84           HA1      GLY  84  -0.926  12.039   1.968
  223    H    GLU  85           HN       GLU  85  -0.097  10.349   0.339
  224    HA   GLU  85           HA       GLU  85  -1.872  10.113  -1.940
  225    HB2  GLU  85           HB2      GLU  85  -0.728  11.902  -2.742
  226    HB3  GLU  85           HB1      GLU  85   0.545  11.723  -1.551
  227    HG2  GLU  85           HG2      GLU  85   1.753  11.273  -3.307
  228    HG3  GLU  85           HG1      GLU  85   1.104   9.651  -3.082
  229    H    ALA  86           HN       ALA  86  -0.843   8.532  -3.505
  230    HA   ALA  86           HA       ALA  86   0.788   6.536  -2.096
  231    HB1  ALA  86           HB1      ALA  86  -0.505   4.740  -3.123
  232    HB2  ALA  86           HB2      ALA  86  -1.567   5.925  -3.881
  233    HB3  ALA  86           HB3      ALA  86  -1.536   5.764  -2.124
  234    H    ARG  87           HN       ARG  87   2.667   6.612  -3.080
  235    HA   ARG  87           HA       ARG  87   2.763   7.251  -5.912
  236    HB2  ARG  87           HB2      ARG  87   5.041   7.059  -3.951
  237    HB3  ARG  87           HB1      ARG  87   5.078   7.787  -5.547
  238    HG2  ARG  87           HG2      ARG  87   3.288   8.779  -3.369
  239    HG3  ARG  87           HG1      ARG  87   4.966   9.296  -3.550
  240    HD2  ARG  87           HD2      ARG  87   4.236   9.734  -6.022
  241    HD3  ARG  87           HD1      ARG  87   2.617   9.763  -5.325
  242    HE   ARG  87           HE       ARG  87   4.015  11.465  -3.746
  243   HH11  ARG  87          HH11      ARG  87   3.443  11.249  -7.192
  244   HH12  ARG  87          HH12      ARG  87   3.711  12.944  -7.469
  245   HH21  ARG  87          HH21      ARG  87   4.367  13.670  -4.093
  246   HH22  ARG  87          HH22      ARG  87   4.247  14.329  -5.696
  247    H    TYR  88           HN       TYR  88   5.017   5.384  -4.053
  248    HA   TYR  88           HA       TYR  88   5.242   3.396  -6.155
  249    HB2  TYR  88           HB2      TYR  88   6.652   3.651  -3.487
  250    HB3  TYR  88           HB1      TYR  88   7.063   2.510  -4.753
  251    HD1  TYR  88           HD1      TYR  88   6.779   6.155  -4.106
  252    HD2  TYR  88           HD2      TYR  88   8.669   3.066  -6.319
  253    HE1  TYR  88           HE1      TYR  88   8.326   7.804  -5.071
  254    HE2  TYR  88           HE2      TYR  88  10.219   4.692  -7.284
  255    HH   TYR  88           HH       TYR  88  10.376   7.089  -7.707
  256    H    ARG  89           HN       ARG  89   4.894   1.125  -5.763
  257    HA   ARG  89           HA       ARG  89   3.757   0.536  -3.127
  258    HB2  ARG  89           HB2      ARG  89   2.277  -1.077  -3.960
  259    HB3  ARG  89           HB1      ARG  89   2.067   0.296  -5.026
  260    HG2  ARG  89           HG2      ARG  89   3.555  -0.808  -6.667
  261    HG3  ARG  89           HG1      ARG  89   3.618  -2.208  -5.589
  262    HD2  ARG  89           HD2      ARG  89   1.153  -2.348  -5.716
  263    HD3  ARG  89           HD1      ARG  89   1.187  -1.046  -6.910
  264    HE   ARG  89           HE       ARG  89   2.738  -2.709  -8.157
  265   HH11  ARG  89          HH11      ARG  89  -0.082  -3.543  -6.246
  266   HH12  ARG  89          HH12      ARG  89  -0.434  -4.980  -7.147
  267   HH21  ARG  89          HH21      ARG  89   2.282  -4.623  -9.340
  268   HH22  ARG  89          HH22      ARG  89   0.933  -5.617  -8.874
  269    H    CYS  90           HN       CYS  90   4.354  -1.394  -2.275
  270    HA   CYS  90           HA       CYS  90   6.866  -2.498  -2.935
  271    HB2  CYS  90           HB2      CYS  90   5.310  -2.630  -0.796
  272    HB3  CYS  90           HB1      CYS  90   4.750  -4.076  -1.559
  273    H    GLU  91           HN       GLU  91   7.299  -3.834  -4.637
  274    HA   GLU  91           HA       GLU  91   5.245  -4.482  -6.472
  275    HB2  GLU  91           HB2      GLU  91   7.051  -5.541  -7.774
  276    HB3  GLU  91           HB1      GLU  91   7.448  -3.904  -7.247
  277    HG2  GLU  91           HG2      GLU  91   8.905  -4.655  -5.607
  278    HG3  GLU  91           HG1      GLU  91   8.269  -6.290  -5.696
  279    H    ASP  92           HN       ASP  92   5.674  -5.839  -3.662
  280    HA   ASP  92           HA       ASP  92   5.225  -8.579  -4.634
  281    HB2  ASP  92           HB2      ASP  92   6.158  -9.263  -2.341
  282    HB3  ASP  92           HB1      ASP  92   7.303  -8.693  -3.551
  283    H    CYS  93           HN       CYS  93   4.371  -6.175  -2.114
  284    HA   CYS  93           HA       CYS  93   2.124  -7.946  -1.487
  285    HB2  CYS  93           HB2      CYS  93   2.351  -7.427   0.811
  286    HB3  CYS  93           HB1      CYS  93   3.970  -7.804   0.238
  287    H    GLY  94           HN       GLY  94   3.168  -4.896  -2.463
  288    HA2  GLY  94           HA2      GLY  94   1.966  -3.385  -3.648
  289    HA3  GLY  94           HA1      GLY  94   0.482  -4.207  -3.196
  290    H    LYS  95           HN       LYS  95   2.860  -3.060  -0.915
  291    HA   LYS  95           HA       LYS  95   0.956  -1.263   0.281
  292    HB2  LYS  95           HB2      LYS  95   3.832  -1.888   0.910
  293    HB3  LYS  95           HB1      LYS  95   2.791  -0.859   1.887
  294    HG2  LYS  95           HG2      LYS  95   1.237  -2.931   1.855
  295    HG3  LYS  95           HG1      LYS  95   2.723  -3.790   1.456
  296    HD2  LYS  95           HD2      LYS  95   3.743  -3.239   3.435
  297    HD3  LYS  95           HD1      LYS  95   2.664  -1.878   3.745
  298    HE2  LYS  95           HE2      LYS  95   2.093  -3.659   5.254
  299    HE3  LYS  95           HE1      LYS  95   0.806  -3.467   4.064
  300    HZ1  LYS  95           HZ1      LYS  95   1.741  -5.353   2.841
  301    HZ2  LYS  95           HZ2      LYS  95   1.268  -5.784   4.409
  302    HZ3  LYS  95           HZ3      LYS  95   2.912  -5.564   4.053
  303    H    LEU  96           HN       LEU  96   0.918   0.913   0.049
  304    HA   LEU  96           HA       LEU  96   2.604   1.983  -2.069
  305    HB2  LEU  96           HB2      LEU  96   0.148   3.085  -0.719
  306    HB3  LEU  96           HB1      LEU  96   1.060   3.963  -1.942
  307    HG   LEU  96           HG       LEU  96  -0.905   2.983  -2.950
  308   HD11  LEU  96          HD11      LEU  96   1.081   3.043  -4.326
  309   HD12  LEU  96          HD12      LEU  96   0.116   1.612  -4.698
  310   HD13  LEU  96          HD13      LEU  96   1.573   1.463  -3.713
  311   HD21  LEU  96          HD21      LEU  96  -1.229   0.539  -3.019
  312   HD22  LEU  96          HD22      LEU  96  -1.353   1.204  -1.389
  313   HD23  LEU  96          HD23      LEU  96   0.115   0.363  -1.888
  314    H    PHE  97           HN       PHE  97   4.242   3.224  -1.727
  315    HA   PHE  97           HA       PHE  97   4.393   4.737   0.803
  316    HB2  PHE  97           HB2      PHE  97   6.756   3.543  -0.671
  317    HB3  PHE  97           HB1      PHE  97   6.819   4.504   0.797
  318    HD1  PHE  97           HD2      PHE  97   5.746   1.240  -0.582
  319    HD2  PHE  97           HD1      PHE  97   6.415   3.558   2.925
  320    HE1  PHE  97           HE2      PHE  97   5.505  -0.793   0.798
  321    HE2  PHE  97           HE1      PHE  97   6.178   1.535   4.308
  322    HZ   PHE  97           HZ       PHE  97   5.724  -0.638   3.243
  323    H    THR  98           HN       THR  98   5.052   6.791   0.685
  324    HA   THR  98           HA       THR  98   5.004   8.033  -1.928
  325    HB   THR  98           HB       THR  98   5.012  10.136  -0.607
  326    HG1  THR  98           HG1      THR  98   5.266  10.065   1.566
  327   HG21  THR  98          HG21      THR  98   2.920   9.074  -1.160
  328   HG22  THR  98          HG22      THR  98   2.816   9.695   0.492
  329   HG23  THR  98          HG23      THR  98   3.086   7.968   0.207
  330    H    THR  99           HN       THR  99   7.221   6.829   0.265
  331    HA   THR  99           HA       THR  99   9.396   8.318  -1.018
  332    HB   THR  99           HB       THR  99   9.239   7.086   1.742
  333    HG1  THR  99           HG1      THR  99   9.445   9.796   0.861
  334   HG21  THR  99          HG21      THR  99  11.514   8.657   0.563
  335   HG22  THR  99          HG22      THR  99  11.452   6.899   0.602
  336   HG23  THR  99          HG23      THR  99  11.464   7.810   2.111
  337    H    SER 100           HN       SER 100  10.753   7.099  -2.184
  338    HA   SER 100           HA       SER 100  10.201   4.344  -2.592
  339    HB2  SER 100           HB2      SER 100  12.204   4.507  -4.125
  340    HB3  SER 100           HB1      SER 100  10.905   5.659  -4.469
  341    HG   SER 100           HG       SER 100  13.152   6.504  -4.383
  342    H    GLY 101           HN       GLY 101  12.417   6.177  -0.659
  343    HA2  GLY 101           HA2      GLY 101  14.148   4.015   0.025
  344    HA3  GLY 101           HA1      GLY 101  13.986   5.528   0.890
  345    H    ASN 102           HN       ASN 102  11.315   5.473   1.671
  346    HA   ASN 102           HA       ASN 102  11.237   3.714   3.859
  347    HB2  ASN 102           HB2      ASN 102   9.035   5.132   2.356
  348    HB3  ASN 102           HB1      ASN 102   8.710   4.105   3.742
  349   HD21  ASN 102          HD21      ASN 102   8.206   6.939   3.427
  350   HD22  ASN 102          HD22      ASN 102   9.086   7.740   4.692
  351    H    LEU 103           HN       LEU 103  10.108   3.579   0.582
  352    HA   LEU 103           HA       LEU 103   8.669   1.202   0.765
  353    HB2  LEU 103           HB2      LEU 103   8.293   2.591  -1.086
  354    HB3  LEU 103           HB1      LEU 103  10.013   2.737  -1.426
  355    HG   LEU 103           HG       LEU 103   9.968   0.282  -2.025
  356   HD11  LEU 103          HD11      LEU 103   7.000   0.776  -2.181
  357   HD12  LEU 103          HD12      LEU 103   7.795  -0.138  -0.881
  358   HD13  LEU 103          HD13      LEU 103   7.872  -0.728  -2.544
  359   HD21  LEU 103          HD21      LEU 103   9.026   0.797  -4.245
  360   HD22  LEU 103          HD22      LEU 103  10.148   2.024  -3.641
  361   HD23  LEU 103          HD23      LEU 103   8.414   2.314  -3.577
  362    H    LYS 104           HN       LYS 104  11.905   1.984  -0.337
  363    HA   LYS 104           HA       LYS 104  12.892  -0.445  -1.080
  364    HB2  LYS 104           HB2      LYS 104  13.972   1.682  -1.468
  365    HB3  LYS 104           HB1      LYS 104  14.281   1.866   0.250
  366    HG2  LYS 104           HG2      LYS 104  15.792   0.016   0.242
  367    HG3  LYS 104           HG1      LYS 104  15.398  -0.353  -1.444
  368    HD2  LYS 104           HD2      LYS 104  16.573   2.271  -0.559
  369    HD3  LYS 104           HD1      LYS 104  17.560   0.900  -1.070
  370    HE2  LYS 104           HE2      LYS 104  15.481   2.344  -2.718
  371    HE3  LYS 104           HE1      LYS 104  17.230   2.437  -2.921
  372    HZ1  LYS 104           HZ1      LYS 104  16.359   0.941  -4.534
  373    HZ2  LYS 104           HZ2      LYS 104  15.500   0.066  -3.367
  374    HZ3  LYS 104           HZ3      LYS 104  17.196   0.011  -3.386
  375    H    ARG 105           HN       ARG 105  13.160   1.019   2.174
  376    HA   ARG 105           HA       ARG 105  14.521  -1.111   3.365
  377    HB2  ARG 105           HB2      ARG 105  12.473   0.712   4.652
  378    HB3  ARG 105           HB1      ARG 105  13.722  -0.208   5.487
  379    HG2  ARG 105           HG2      ARG 105  15.416   1.064   4.190
  380    HG3  ARG 105           HG1      ARG 105  14.112   2.075   3.573
  381    HD2  ARG 105           HD2      ARG 105  14.657   1.702   6.504
  382    HD3  ARG 105           HD1      ARG 105  15.372   2.997   5.548
  383    HE   ARG 105           HE       ARG 105  13.020   3.698   5.070
  384   HH11  ARG 105          HH11      ARG 105  13.879   1.952   7.975
  385   HH12  ARG 105          HH12      ARG 105  12.508   2.523   8.883
  386   HH21  ARG 105          HH21      ARG 105  11.236   4.499   6.269
  387   HH22  ARG 105          HH22      ARG 105  10.985   3.949   7.904
  388    H    HIS 106           HN       HIS 106  11.141  -0.560   2.784
  389    HA   HIS 106           HA       HIS 106  10.230  -2.939   4.102
  390    HB2  HIS 106           HB2      HIS 106   8.767  -0.979   3.875
  391    HB3  HIS 106           HB1      HIS 106   8.827  -1.128   2.122
  392    HD1  HIS 106           HD1      HIS 106   7.286  -2.743   5.167
  393    HD2  HIS 106           HD2      HIS 106   7.284  -3.059   1.033
  394    HE1  HIS 106           HE1      HIS 106   5.364  -4.282   4.576
  395    H    GLN 107           HN       GLN 107  11.666  -2.338   1.077
  396    HA   GLN 107           HA       GLN 107  10.403  -4.566  -0.280
  397    HB2  GLN 107           HB2      GLN 107  12.796  -2.922  -1.164
  398    HB3  GLN 107           HB1      GLN 107  11.825  -3.983  -2.176
  399    HG2  GLN 107           HG2      GLN 107  10.198  -1.945  -0.989
  400    HG3  GLN 107           HG1      GLN 107  11.589  -1.242  -1.800
  401   HE21  GLN 107          HE21      GLN 107   8.694  -3.093  -2.224
  402   HE22  GLN 107          HE22      GLN 107   8.650  -2.965  -3.954
  403    H    LEU 108           HN       LEU 108  13.093  -3.656   1.574
  404    HA   LEU 108           HA       LEU 108  14.845  -5.816   0.874
  405    HB2  LEU 108           HB2      LEU 108  14.881  -3.567   2.820
  406    HB3  LEU 108           HB1      LEU 108  16.042  -4.870   2.962
  407    HG   LEU 108           HG       LEU 108  17.294  -4.138   1.227
  408   HD11  LEU 108          HD11      LEU 108  16.424  -3.125  -0.808
  409   HD12  LEU 108          HD12      LEU 108  14.805  -3.080  -0.100
  410   HD13  LEU 108          HD13      LEU 108  15.581  -4.629  -0.434
  411   HD21  LEU 108          HD21      LEU 108  17.262  -1.704   1.040
  412   HD22  LEU 108          HD22      LEU 108  17.082  -2.234   2.714
  413   HD23  LEU 108          HD23      LEU 108  15.670  -1.672   1.809
  414    H    VAL 109           HN       VAL 109  12.289  -5.345   3.063
  415    HA   VAL 109           HA       VAL 109  13.196  -7.389   4.839
  416    HB   VAL 109           HB       VAL 109  11.055  -7.177   5.910
  417   HG11  VAL 109          HG11      VAL 109  11.929  -4.477   4.937
  418   HG12  VAL 109          HG12      VAL 109  12.651  -5.356   6.289
  419   HG13  VAL 109          HG13      VAL 109  10.980  -4.799   6.389
  420   HG21  VAL 109          HG21      VAL 109   9.259  -5.814   4.948
  421   HG22  VAL 109          HG22      VAL 109   9.665  -7.204   3.935
  422   HG23  VAL 109          HG23      VAL 109  10.249  -5.594   3.500
  423    H    HIS 110           HN       HIS 110  11.603  -7.168   1.818
  424    HA   HIS 110           HA       HIS 110  10.614  -9.923   1.962
  425    HB2  HIS 110           HB2      HIS 110  10.532  -7.812  -0.174
  426    HB3  HIS 110           HB1      HIS 110   9.955  -9.437  -0.432
  427    HD1  HIS 110           HD1      HIS 110   7.598  -9.972   0.455
  428    HD2  HIS 110           HD2      HIS 110   9.090  -6.268   1.527
  429    HE1  HIS 110           HE1      HIS 110   5.620  -8.610   1.261
  430    H    SER 111           HN       SER 111  13.488  -8.399   1.350
  431    HA   SER 111           HA       SER 111  14.638 -10.758   0.142
  432    HB2  SER 111           HB2      SER 111  14.728  -8.085  -1.282
  433    HB3  SER 111           HB1      SER 111  15.679  -9.500  -1.734
  434    HG   SER 111           HG       SER 111  13.017 -10.065  -1.475
  435    H    GLY 112           HN       GLY 112  14.981  -9.866   2.624
  436    HA2  GLY 112           HA2      GLY 112  17.697  -8.738   2.593
  437    HA3  GLY 112           HA1      GLY 112  16.455  -8.066   3.658
  Start of MODEL    2
    1    H    LYS  58           HT1      LYS  58 -17.018  -9.606  -4.714
    2    HA   LYS  58           HA       LYS  58 -15.440  -9.870  -2.976
    3    HB2  LYS  58           HB2      LYS  58 -14.808  -8.592  -5.513
    4    HB3  LYS  58           HB1      LYS  58 -13.589  -8.265  -4.290
    5    HG2  LYS  58           HG2      LYS  58 -14.550 -10.999  -5.113
    6    HG3  LYS  58           HG1      LYS  58 -13.047 -10.232  -5.631
    7    HD2  LYS  58           HD2      LYS  58 -12.331 -10.117  -3.269
    8    HD3  LYS  58           HD1      LYS  58 -13.804 -10.971  -2.804
    9    HE2  LYS  58           HE2      LYS  58 -13.111 -12.875  -4.199
   10    HE3  LYS  58           HE1      LYS  58 -11.629 -12.015  -4.611
   11    HZ1  LYS  58           HZ1      LYS  58 -11.021 -12.020  -2.265
   12    HZ2  LYS  58           HZ2      LYS  58 -11.246 -13.600  -2.840
   13    HZ3  LYS  58           HZ3      LYS  58 -12.440 -12.871  -1.882
   14    HA   PRO  59           HA       PRO  59 -14.967  -6.264  -0.368
   15    HB2  PRO  59           HB2      PRO  59 -14.304  -7.951   1.800
   16    HB3  PRO  59           HB1      PRO  59 -15.881  -7.238   1.463
   17    HG2  PRO  59           HG2      PRO  59 -15.263  -9.965   1.375
   18    HG3  PRO  59           HG1      PRO  59 -16.707  -9.201   0.687
   19    HD2  PRO  59           HD2      PRO  59 -14.171 -10.025  -0.665
   20    HD3  PRO  59           HD1      PRO  59 -15.835 -10.053  -1.264
   21    H    TYR  60           HN       TYR  60 -13.184  -5.243  -0.685
   22    HA   TYR  60           HA       TYR  60 -10.600  -6.529  -0.105
   23    HB2  TYR  60           HB2      TYR  60 -11.211  -4.094  -1.801
   24    HB3  TYR  60           HB1      TYR  60  -9.594  -4.698  -1.447
   25    HD1  TYR  60           HD2      TYR  60  -9.900  -7.584  -1.811
   26    HD2  TYR  60           HD1      TYR  60 -11.495  -4.347  -4.062
   27    HE1  TYR  60           HE2      TYR  60  -9.958  -9.003  -3.806
   28    HE2  TYR  60           HE1      TYR  60 -11.548  -5.758  -6.062
   29    HH   TYR  60           HH       TYR  60 -10.391  -7.776  -6.919
   30    H    GLY  61           HN       GLY  61 -10.418  -6.145   2.051
   31    HA2  GLY  61           HA2      GLY  61 -11.163  -3.469   2.957
   32    HA3  GLY  61           HA1      GLY  61 -11.150  -4.903   3.967
   33    H    CYS  62           HN       CYS  62 -10.003  -2.281   4.186
   34    HA   CYS  62           HA       CYS  62  -7.219  -2.229   3.904
   35    HB2  CYS  62           HB2      CYS  62  -8.940  -0.377   4.456
   36    HB3  CYS  62           HB1      CYS  62  -8.744  -0.888   6.124
   37    H    GLU  63           HN       GLU  63  -5.771  -3.502   4.867
   38    HA   GLU  63           HA       GLU  63  -6.431  -5.255   6.994
   39    HB2  GLU  63           HB2      GLU  63  -4.180  -6.004   6.853
   40    HB3  GLU  63           HB1      GLU  63  -4.716  -5.674   5.220
   41    HG2  GLU  63           HG2      GLU  63  -2.969  -3.880   6.891
   42    HG3  GLU  63           HG1      GLU  63  -2.409  -4.961   5.622
   43    H    GLU  64           HN       GLU  64  -5.606  -2.034   6.952
   44    HA   GLU  64           HA       GLU  64  -4.171  -2.064   9.468
   45    HB2  GLU  64           HB2      GLU  64  -3.001  -0.553   8.373
   46    HB3  GLU  64           HB1      GLU  64  -4.159  -0.519   7.070
   47    HG2  GLU  64           HG2      GLU  64  -5.138   0.979   9.303
   48    HG3  GLU  64           HG1      GLU  64  -3.529   1.536   8.837
   49    H    CYS  65           HN       CYS  65  -7.227  -0.840   8.156
   50    HA   CYS  65           HA       CYS  65  -7.878   0.153  10.844
   51    HB2  CYS  65           HB2      CYS  65  -9.277   1.850   9.778
   52    HB3  CYS  65           HB1      CYS  65  -7.618   1.971   9.188
   53    H    GLY  66           HN       GLY  66  -8.763  -1.699   8.103
   54    HA2  GLY  66           HA2      GLY  66 -10.026  -3.616   8.239
   55    HA3  GLY  66           HA1      GLY  66 -10.768  -2.999   9.710
   56    H    LYS  67           HN       LYS  67 -10.713  -0.793   7.094
   57    HA   LYS  67           HA       LYS  67 -13.579  -1.095   6.731
   58    HB2  LYS  67           HB2      LYS  67 -11.614   0.924   5.642
   59    HB3  LYS  67           HB1      LYS  67 -13.342   0.953   5.313
   60    HG2  LYS  67           HG2      LYS  67 -12.030   1.244   8.012
   61    HG3  LYS  67           HG1      LYS  67 -12.797   2.523   7.068
   62    HD2  LYS  67           HD2      LYS  67 -14.939   1.308   7.218
   63    HD3  LYS  67           HD1      LYS  67 -14.154   0.086   8.221
   64    HE2  LYS  67           HE2      LYS  67 -13.631   1.804   9.887
   65    HE3  LYS  67           HE1      LYS  67 -14.438   3.014   8.889
   66    HZ1  LYS  67           HZ1      LYS  67 -16.481   1.599   9.083
   67    HZ2  LYS  67           HZ2      LYS  67 -15.977   2.337  10.523
   68    HZ3  LYS  67           HZ3      LYS  67 -15.669   0.690  10.264
   69    H    SER  68           HN       SER  68 -14.455  -2.264   5.148
   70    HA   SER  68           HA       SER  68 -12.761  -3.345   3.069
   71    HB2  SER  68           HB2      SER  68 -15.481  -4.146   2.768
   72    HB3  SER  68           HB1      SER  68 -14.088  -5.119   3.257
   73    HG   SER  68           HG       SER  68 -14.538  -4.779   5.344
   74    H    TYR  69           HN       TYR  69 -12.820  -2.901   0.959
   75    HA   TYR  69           HA       TYR  69 -14.986  -1.131  -0.002
   76    HB2  TYR  69           HB2      TYR  69 -12.048  -1.079  -0.641
   77    HB3  TYR  69           HB1      TYR  69 -13.234  -0.396  -1.747
   78    HD1  TYR  69           HD2      TYR  69 -11.994  -0.209   1.745
   79    HD2  TYR  69           HD1      TYR  69 -14.074   1.742  -1.395
   80    HE1  TYR  69           HE2      TYR  69 -11.995   1.864   3.046
   81    HE2  TYR  69           HE1      TYR  69 -14.075   3.834  -0.112
   82    HH   TYR  69           HH       TYR  69 -13.938   4.477   2.349
   83    H    ARG  70           HN       ARG  70 -15.454  -1.342  -2.335
   84    HA   ARG  70           HA       ARG  70 -15.699  -4.132  -2.980
   85    HB2  ARG  70           HB2      ARG  70 -16.720  -1.601  -4.204
   86    HB3  ARG  70           HB1      ARG  70 -16.777  -3.095  -5.123
   87    HG2  ARG  70           HG2      ARG  70 -18.885  -2.828  -4.107
   88    HG3  ARG  70           HG1      ARG  70 -18.055  -4.103  -3.220
   89    HD2  ARG  70           HD2      ARG  70 -17.553  -2.613  -1.418
   90    HD3  ARG  70           HD1      ARG  70 -18.137  -1.226  -2.337
   91    HE   ARG  70           HE       ARG  70 -20.049  -3.363  -1.781
   92   HH11  ARG  70          HH11      ARG  70 -18.827  -0.177  -0.980
   93   HH12  ARG  70          HH12      ARG  70 -20.274   0.308  -0.141
   94   HH21  ARG  70          HH21      ARG  70 -21.956  -2.718  -0.690
   95   HH22  ARG  70          HH22      ARG  70 -22.056  -1.132   0.005
   96    H    LEU  71           HN       LEU  71 -13.947  -1.354  -4.345
   97    HA   LEU  71           HA       LEU  71 -12.710  -3.198  -6.263
   98    HB2  LEU  71           HB2      LEU  71 -12.775  -0.177  -6.298
   99    HB3  LEU  71           HB1      LEU  71 -12.029  -1.195  -7.517
  100    HG   LEU  71           HG       LEU  71 -13.944  -0.818  -8.612
  101   HD11  LEU  71          HD11      LEU  71 -15.049  -2.830  -6.688
  102   HD12  LEU  71          HD12      LEU  71 -14.030  -3.208  -8.083
  103   HD13  LEU  71          HD13      LEU  71 -15.631  -2.503  -8.324
  104   HD21  LEU  71          HD21      LEU  71 -16.019  -0.080  -7.684
  105   HD22  LEU  71          HD22      LEU  71 -14.697   0.822  -6.936
  106   HD23  LEU  71          HD23      LEU  71 -15.477  -0.493  -6.059
  107    H    ILE  72           HN       ILE  72 -10.435  -3.066  -6.626
  108    HA   ILE  72           HA       ILE  72  -8.863  -2.672  -4.299
  109    HB   ILE  72           HB       ILE  72  -8.069  -3.021  -7.193
  110   HG12  ILE  72          HG12      ILE  72  -9.161  -4.917  -5.951
  111   HG13  ILE  72          HG11      ILE  72  -7.556  -5.280  -6.571
  112   HG21  ILE  72          HG21      ILE  72  -5.789  -3.427  -6.374
  113   HG22  ILE  72          HG22      ILE  72  -6.296  -2.927  -4.762
  114   HG23  ILE  72          HG23      ILE  72  -6.318  -1.768  -6.092
  115   HD11  ILE  72          HD11      ILE  72  -7.881  -6.160  -4.324
  116   HD12  ILE  72          HD12      ILE  72  -8.223  -4.532  -3.731
  117   HD13  ILE  72          HD13      ILE  72  -6.619  -4.927  -4.350
  118    H    SER  73           HN       SER  73  -9.400  -0.759  -7.235
  119    HA   SER  73           HA       SER  73  -7.676   1.360  -6.622
  120    HB2  SER  73           HB2      SER  73  -9.251   2.673  -8.148
  121    HB3  SER  73           HB1      SER  73  -8.544   1.209  -8.836
  122    HG   SER  73           HG       SER  73 -11.097   1.803  -8.644
  123    H    LEU  74           HN       LEU  74 -11.030   0.786  -5.753
  124    HA   LEU  74           HA       LEU  74 -11.671   3.074  -4.375
  125    HB2  LEU  74           HB2      LEU  74 -12.525   0.317  -4.523
  126    HB3  LEU  74           HB1      LEU  74 -12.642   0.908  -2.871
  127    HG   LEU  74           HG       LEU  74 -13.992   2.050  -5.302
  128   HD11  LEU  74          HD11      LEU  74 -16.029   1.489  -4.045
  129   HD12  LEU  74          HD12      LEU  74 -15.038   0.769  -2.776
  130   HD13  LEU  74          HD13      LEU  74 -15.059   0.055  -4.392
  131   HD21  LEU  74          HD21      LEU  74 -13.632   3.048  -2.512
  132   HD22  LEU  74          HD22      LEU  74 -14.952   3.605  -3.549
  133   HD23  LEU  74          HD23      LEU  74 -13.271   3.869  -4.028
  134    H    LEU  75           HN       LEU  75 -10.251   0.172  -3.076
  135    HA   LEU  75           HA       LEU  75  -9.872   1.243  -0.476
  136    HB2  LEU  75           HB2      LEU  75 -10.210  -1.060  -0.631
  137    HB3  LEU  75           HB1      LEU  75  -9.063  -1.230  -1.956
  138    HG   LEU  75           HG       LEU  75  -7.296  -0.546  -0.198
  139   HD11  LEU  75          HD11      LEU  75  -9.539  -1.487   1.578
  140   HD12  LEU  75          HD12      LEU  75  -8.847   0.137   1.537
  141   HD13  LEU  75          HD13      LEU  75  -7.864  -1.224   2.075
  142   HD21  LEU  75          HD21      LEU  75  -7.067  -2.892   0.408
  143   HD22  LEU  75          HD22      LEU  75  -7.463  -2.666  -1.303
  144   HD23  LEU  75          HD23      LEU  75  -8.718  -3.189  -0.167
  145    H    ASN  76           HN       ASN  76  -8.168   1.176  -3.407
  146    HA   ASN  76           HA       ASN  76  -5.527   1.590  -2.457
  147    HB2  ASN  76           HB2      ASN  76  -6.641   1.062  -4.890
  148    HB3  ASN  76           HB1      ASN  76  -6.241   2.774  -5.069
  149   HD21  ASN  76          HD21      ASN  76  -5.061  -0.435  -4.714
  150   HD22  ASN  76          HD22      ASN  76  -3.389  -0.095  -5.023
  151    H    LEU  77           HN       LEU  77  -8.206   3.676  -3.397
  152    HA   LEU  77           HA       LEU  77  -6.711   6.076  -2.945
  153    HB2  LEU  77           HB2      LEU  77  -9.441   5.316  -3.779
  154    HB3  LEU  77           HB1      LEU  77  -9.267   6.876  -3.009
  155    HG   LEU  77           HG       LEU  77  -9.157   6.725  -5.579
  156   HD11  LEU  77          HD11      LEU  77  -8.675   8.705  -4.257
  157   HD12  LEU  77          HD12      LEU  77  -7.583   8.578  -5.636
  158   HD13  LEU  77          HD13      LEU  77  -7.020   8.152  -4.019
  159   HD21  LEU  77          HD21      LEU  77  -7.537   4.884  -5.692
  160   HD22  LEU  77          HD22      LEU  77  -6.329   5.912  -4.917
  161   HD23  LEU  77          HD23      LEU  77  -6.955   6.332  -6.512
  162    H    HIS  78           HN       HIS  78  -8.682   3.929  -1.139
  163    HA   HIS  78           HA       HIS  78  -9.067   5.576   1.156
  164    HB2  HIS  78           HB2      HIS  78 -10.446   3.611   0.873
  165    HB3  HIS  78           HB1      HIS  78  -9.023   2.570   0.770
  166    HD1  HIS  78           HD1      HIS  78 -11.257   4.283   3.231
  167    HD2  HIS  78           HD2      HIS  78  -7.848   1.905   3.199
  168    HE1  HIS  78           HE1      HIS  78 -10.872   3.561   5.621
  169    H    LYS  79           HN       LYS  79  -6.626   3.300   0.082
  170    HA   LYS  79           HA       LYS  79  -5.048   3.395   2.460
  171    HB2  LYS  79           HB2      LYS  79  -5.004   1.526   0.801
  172    HB3  LYS  79           HB1      LYS  79  -4.249   2.613  -0.354
  173    HG2  LYS  79           HG2      LYS  79  -2.583   1.190   0.639
  174    HG3  LYS  79           HG1      LYS  79  -2.325   2.857   1.157
  175    HD2  LYS  79           HD2      LYS  79  -2.053   1.293   3.018
  176    HD3  LYS  79           HD1      LYS  79  -3.419   2.376   3.285
  177    HE2  LYS  79           HE2      LYS  79  -4.953   0.616   2.522
  178    HE3  LYS  79           HE1      LYS  79  -3.585  -0.464   2.275
  179    HZ1  LYS  79           HZ1      LYS  79  -3.212  -0.660   4.537
  180    HZ2  LYS  79           HZ2      LYS  79  -4.904  -0.623   4.447
  181    HZ3  LYS  79           HZ3      LYS  79  -4.060   0.766   4.919
  182    H    LYS  80           HN       LYS  80  -4.958   4.951  -0.696
  183    HA   LYS  80           HA       LYS  80  -2.752   6.607  -0.321
  184    HB2  LYS  80           HB2      LYS  80  -3.731   6.400  -2.496
  185    HB3  LYS  80           HB1      LYS  80  -5.286   6.982  -1.922
  186    HG2  LYS  80           HG2      LYS  80  -4.465   9.189  -1.699
  187    HG3  LYS  80           HG1      LYS  80  -2.801   8.680  -1.921
  188    HD2  LYS  80           HD2      LYS  80  -4.944   8.407  -4.022
  189    HD3  LYS  80           HD1      LYS  80  -3.858   9.797  -3.904
  190    HE2  LYS  80           HE2      LYS  80  -1.941   8.268  -4.098
  191    HE3  LYS  80           HE1      LYS  80  -3.060   6.922  -4.302
  192    HZ1  LYS  80           HZ1      LYS  80  -3.950   8.201  -6.276
  193    HZ2  LYS  80           HZ2      LYS  80  -2.396   7.544  -6.455
  194    HZ3  LYS  80           HZ3      LYS  80  -2.585   9.199  -6.140
  195    H    ARG  81           HN       ARG  81  -6.109   6.951   0.746
  196    HA   ARG  81           HA       ARG  81  -5.897   9.651   1.531
  197    HB2  ARG  81           HB2      ARG  81  -8.049   8.425   1.271
  198    HB3  ARG  81           HB1      ARG  81  -7.701   7.568   2.769
  199    HG2  ARG  81           HG2      ARG  81  -9.218   9.451   3.132
  200    HG3  ARG  81           HG1      ARG  81  -7.693   9.665   3.994
  201    HD2  ARG  81           HD2      ARG  81  -6.950  10.965   1.893
  202    HD3  ARG  81           HD1      ARG  81  -8.671  11.047   1.523
  203    HE   ARG  81           HE       ARG  81  -8.718  11.994   3.975
  204   HH11  ARG  81          HH11      ARG  81  -6.428  12.649   1.411
  205   HH12  ARG  81          HH12      ARG  81  -6.042  14.247   1.979
  206   HH21  ARG  81          HH21      ARG  81  -8.234  14.112   4.720
  207   HH22  ARG  81          HH22      ARG  81  -7.071  15.070   3.857
  208    H    HIS  82           HN       HIS  82  -5.093   6.672   3.248
  209    HA   HIS  82           HA       HIS  82  -4.731   7.960   5.780
  210    HB2  HIS  82           HB2      HIS  82  -3.939   5.250   4.738
  211    HB3  HIS  82           HB1      HIS  82  -3.548   5.785   6.354
  212    HD1  HIS  82           HD1      HIS  82  -5.733   6.304   7.905
  213    HD2  HIS  82           HD2      HIS  82  -6.324   4.179   4.389
  214    HE1  HIS  82           HE1      HIS  82  -7.917   5.090   8.165
  215    H    SER  83           HN       SER  83  -2.553   6.861   3.205
  216    HA   SER  83           HA       SER  83  -0.222   7.726   4.683
  217    HB2  SER  83           HB2      SER  83  -0.425   6.667   1.853
  218    HB3  SER  83           HB1      SER  83   1.045   6.813   2.817
  219    HG   SER  83           HG       SER  83  -0.592   5.436   4.294
  220    H    GLY  84           HN       GLY  84  -2.451   9.487   3.238
  221    HA2  GLY  84           HA2      GLY  84  -2.353  11.726   2.568
  222    HA3  GLY  84           HA1      GLY  84  -0.602  11.584   2.433
  223    H    GLU  85           HN       GLU  85  -0.036   9.768   0.720
  224    HA   GLU  85           HA       GLU  85  -1.902   9.736  -1.501
  225    HB2  GLU  85           HB2      GLU  85   0.000  10.131  -3.079
  226    HB3  GLU  85           HB1      GLU  85  -0.437  11.532  -2.112
  227    HG2  GLU  85           HG2      GLU  85   1.705   9.753  -1.109
  228    HG3  GLU  85           HG1      GLU  85   2.057  10.809  -2.472
  229    H    ALA  86           HN       ALA  86  -0.608   8.285  -3.248
  230    HA   ALA  86           HA       ALA  86   0.693   6.044  -1.920
  231    HB1  ALA  86           HB1      ALA  86  -0.696   4.405  -3.118
  232    HB2  ALA  86           HB2      ALA  86  -1.681   5.717  -3.764
  233    HB3  ALA  86           HB3      ALA  86  -1.665   5.397  -2.030
  234    H    ARG  87           HN       ARG  87   2.594   6.130  -2.857
  235    HA   ARG  87           HA       ARG  87   2.742   7.105  -5.596
  236    HB2  ARG  87           HB2      ARG  87   4.966   6.875  -3.592
  237    HB3  ARG  87           HB1      ARG  87   4.946   7.832  -5.067
  238    HG2  ARG  87           HG2      ARG  87   2.995   8.318  -2.861
  239    HG3  ARG  87           HG1      ARG  87   4.627   8.990  -2.831
  240    HD2  ARG  87           HD2      ARG  87   2.657   9.360  -5.078
  241    HD3  ARG  87           HD1      ARG  87   2.908  10.530  -3.781
  242    HE   ARG  87           HE       ARG  87   5.358  10.417  -4.644
  243   HH11  ARG  87          HH11      ARG  87   2.484  10.296  -6.655
  244   HH12  ARG  87          HH12      ARG  87   3.256  11.082  -7.996
  245   HH21  ARG  87          HH21      ARG  87   6.360  11.419  -6.403
  246   HH22  ARG  87          HH22      ARG  87   5.463  11.699  -7.872
  247    H    TYR  88           HN       TYR  88   4.885   5.143  -3.688
  248    HA   TYR  88           HA       TYR  88   5.397   3.413  -5.986
  249    HB2  TYR  88           HB2      TYR  88   6.731   3.400  -3.279
  250    HB3  TYR  88           HB1      TYR  88   7.309   2.656  -4.755
  251    HD1  TYR  88           HD1      TYR  88   6.654   5.892  -3.128
  252    HD2  TYR  88           HD2      TYR  88   8.691   3.860  -6.245
  253    HE1  TYR  88           HE1      TYR  88   7.942   7.922  -3.583
  254    HE2  TYR  88           HE2      TYR  88   9.997   5.890  -6.721
  255    HH   TYR  88           HH       TYR  88  10.033   8.577  -4.571
  256    H    ARG  89           HN       ARG  89   5.200   1.117  -5.799
  257    HA   ARG  89           HA       ARG  89   4.071   0.218  -3.249
  258    HB2  ARG  89           HB2      ARG  89   2.740  -1.421  -4.291
  259    HB3  ARG  89           HB1      ARG  89   2.450   0.070  -5.178
  260    HG2  ARG  89           HG2      ARG  89   3.978  -0.704  -6.940
  261    HG3  ARG  89           HG1      ARG  89   4.204  -2.213  -6.046
  262    HD2  ARG  89           HD2      ARG  89   1.722  -2.520  -6.135
  263    HD3  ARG  89           HD1      ARG  89   1.665  -1.145  -7.237
  264    HE   ARG  89           HE       ARG  89   3.506  -2.972  -8.262
  265   HH11  ARG  89          HH11      ARG  89   0.059  -2.755  -7.664
  266   HH12  ARG  89          HH12      ARG  89  -0.362  -3.875  -8.920
  267   HH21  ARG  89          HH21      ARG  89   2.960  -4.471  -9.882
  268   HH22  ARG  89          HH22      ARG  89   1.290  -4.859 -10.185
  269    H    CYS  90           HN       CYS  90   4.790  -1.779  -2.546
  270    HA   CYS  90           HA       CYS  90   7.478  -2.442  -3.085
  271    HB2  CYS  90           HB2      CYS  90   6.047  -2.979  -1.027
  272    HB3  CYS  90           HB1      CYS  90   5.424  -4.312  -1.945
  273    H    GLU  91           HN       GLU  91   8.340  -3.763  -4.591
  274    HA   GLU  91           HA       GLU  91   6.855  -4.407  -6.873
  275    HB2  GLU  91           HB2      GLU  91   8.900  -5.471  -7.673
  276    HB3  GLU  91           HB1      GLU  91   9.242  -3.914  -6.918
  277    HG2  GLU  91           HG2      GLU  91   9.983  -4.973  -4.919
  278    HG3  GLU  91           HG1      GLU  91   9.486  -6.536  -5.539
  279    H    ASP  92           HN       ASP  92   6.896  -5.996  -3.954
  280    HA   ASP  92           HA       ASP  92   6.444  -8.603  -5.242
  281    HB2  ASP  92           HB2      ASP  92   7.277  -9.562  -3.035
  282    HB3  ASP  92           HB1      ASP  92   8.477  -8.835  -4.100
  283    H    CYS  93           HN       CYS  93   5.345  -6.373  -2.684
  284    HA   CYS  93           HA       CYS  93   3.158  -8.263  -2.276
  285    HB2  CYS  93           HB2      CYS  93   3.302  -8.101   0.056
  286    HB3  CYS  93           HB1      CYS  93   4.967  -8.299  -0.481
  287    H    GLY  94           HN       GLY  94   4.000  -5.315  -3.298
  288    HA2  GLY  94           HA2      GLY  94   2.763  -3.607  -4.060
  289    HA3  GLY  94           HA1      GLY  94   1.340  -4.589  -3.739
  290    H    LYS  95           HN       LYS  95   3.639  -3.411  -1.308
  291    HA   LYS  95           HA       LYS  95   1.554  -1.935   0.038
  292    HB2  LYS  95           HB2      LYS  95   4.509  -2.224   0.545
  293    HB3  LYS  95           HB1      LYS  95   3.448  -1.234   1.542
  294    HG2  LYS  95           HG2      LYS  95   2.134  -3.292   1.998
  295    HG3  LYS  95           HG1      LYS  95   3.414  -4.210   1.194
  296    HD2  LYS  95           HD2      LYS  95   4.135  -4.292   3.371
  297    HD3  LYS  95           HD1      LYS  95   4.954  -2.847   2.802
  298    HE2  LYS  95           HE2      LYS  95   3.991  -2.404   4.963
  299    HE3  LYS  95           HE1      LYS  95   3.133  -1.471   3.739
  300    HZ1  LYS  95           HZ1      LYS  95   1.692  -2.571   5.423
  301    HZ2  LYS  95           HZ2      LYS  95   2.163  -4.074   4.790
  302    HZ3  LYS  95           HZ3      LYS  95   1.310  -2.972   3.823
  303    H    LEU  96           HN       LEU  96   1.229   0.241  -0.098
  304    HA   LEU  96           HA       LEU  96   2.782   1.612  -2.134
  305    HB2  LEU  96           HB2      LEU  96   0.236   2.333  -0.716
  306    HB3  LEU  96           HB1      LEU  96   1.054   3.432  -1.821
  307    HG   LEU  96           HG       LEU  96  -0.758   2.368  -2.986
  308   HD11  LEU  96          HD11      LEU  96   1.848   1.104  -3.797
  309   HD12  LEU  96          HD12      LEU  96   1.290   2.717  -4.255
  310   HD13  LEU  96          HD13      LEU  96   0.418   1.290  -4.817
  311   HD21  LEU  96          HD21      LEU  96  -1.035   0.417  -1.557
  312   HD22  LEU  96          HD22      LEU  96   0.482  -0.250  -2.171
  313   HD23  LEU  96          HD23      LEU  96  -0.901  -0.056  -3.253
  314    H    PHE  97           HN       PHE  97   4.545   2.575  -1.525
  315    HA   PHE  97           HA       PHE  97   4.524   4.058   1.030
  316    HB2  PHE  97           HB2      PHE  97   6.940   3.113  -0.548
  317    HB3  PHE  97           HB1      PHE  97   6.986   4.020   0.956
  318    HD1  PHE  97           HD2      PHE  97   6.105   0.745  -0.526
  319    HD2  PHE  97           HD1      PHE  97   6.641   2.991   3.053
  320    HE1  PHE  97           HE2      PHE  97   5.966  -1.345   0.812
  321    HE2  PHE  97           HE1      PHE  97   6.526   0.919   4.375
  322    HZ   PHE  97           HZ       PHE  97   6.194  -1.242   3.250
  323    H    THR  98           HN       THR  98   5.015   6.195   1.040
  324    HA   THR  98           HA       THR  98   4.735   7.503  -1.532
  325    HB   THR  98           HB       THR  98   4.374   9.530  -0.251
  326    HG1  THR  98           HG1      THR  98   5.001   9.712   1.784
  327   HG21  THR  98          HG21      THR  98   2.509   7.996  -0.502
  328   HG22  THR  98          HG22      THR  98   2.431   8.783   1.078
  329   HG23  THR  98          HG23      THR  98   3.014   7.118   0.942
  330    H    THR  99           HN       THR  99   7.194   6.398   0.353
  331    HA   THR  99           HA       THR  99   9.104   8.239  -0.883
  332    HB   THR  99           HB       THR  99   9.124   7.045   1.893
  333    HG1  THR  99           HG1      THR  99   8.362   9.412   0.874
  334   HG21  THR  99          HG21      THR  99  11.297   8.706   0.657
  335   HG22  THR  99          HG22      THR  99  11.321   6.944   0.694
  336   HG23  THR  99          HG23      THR  99  11.316   7.856   2.205
  337    H    SER 100           HN       SER 100  10.623   7.236  -2.050
  338    HA   SER 100           HA       SER 100  10.331   4.480  -2.613
  339    HB2  SER 100           HB2      SER 100  12.327   4.876  -4.107
  340    HB3  SER 100           HB1      SER 100  10.946   5.940  -4.402
  341    HG   SER 100           HG       SER 100  13.426   6.642  -3.879
  342    H    GLY 101           HN       GLY 101  12.523   6.326  -0.598
  343    HA2  GLY 101           HA2      GLY 101  14.327   4.128  -0.193
  344    HA3  GLY 101           HA1      GLY 101  14.279   5.610   0.729
  345    H    ASN 102           HN       ASN 102  11.500   5.389   1.556
  346    HA   ASN 102           HA       ASN 102  11.683   3.582   3.745
  347    HB2  ASN 102           HB2      ASN 102   9.310   4.927   2.441
  348    HB3  ASN 102           HB1      ASN 102   9.146   3.846   3.814
  349   HD21  ASN 102          HD21      ASN 102   8.372   5.352   5.229
  350   HD22  ASN 102          HD22      ASN 102   9.305   6.685   5.816
  351    H    LEU 103           HN       LEU 103  10.302   3.556   0.563
  352    HA   LEU 103           HA       LEU 103   9.034   1.097   0.665
  353    HB2  LEU 103           HB2      LEU 103   8.520   2.493  -1.119
  354    HB3  LEU 103           HB1      LEU 103  10.212   2.817  -1.472
  355    HG   LEU 103           HG       LEU 103  10.378   0.411  -2.226
  356   HD11  LEU 103          HD11      LEU 103   8.211  -0.217  -1.069
  357   HD12  LEU 103          HD12      LEU 103   8.424  -0.802  -2.721
  358   HD13  LEU 103          HD13      LEU 103   7.379   0.605  -2.405
  359   HD21  LEU 103          HD21      LEU 103   8.642   2.430  -3.588
  360   HD22  LEU 103          HD22      LEU 103   9.292   0.998  -4.391
  361   HD23  LEU 103          HD23      LEU 103  10.384   2.229  -3.747
  362    H    LYS 104           HN       LYS 104  12.145   1.991  -0.733
  363    HA   LYS 104           HA       LYS 104  13.366  -0.303  -1.420
  364    HB2  LYS 104           HB2      LYS 104  14.171   2.309  -0.592
  365    HB3  LYS 104           HB1      LYS 104  15.276   1.134   0.103
  366    HG2  LYS 104           HG2      LYS 104  16.226   1.764  -1.931
  367    HG3  LYS 104           HG1      LYS 104  15.505   0.176  -2.228
  368    HD2  LYS 104           HD2      LYS 104  13.503   1.354  -3.156
  369    HD3  LYS 104           HD1      LYS 104  14.393   2.871  -3.002
  370    HE2  LYS 104           HE2      LYS 104  14.592   2.088  -5.263
  371    HE3  LYS 104           HE1      LYS 104  16.156   1.930  -4.468
  372    HZ1  LYS 104           HZ1      LYS 104  15.611  -0.024  -5.794
  373    HZ2  LYS 104           HZ2      LYS 104  14.207  -0.274  -4.883
  374    HZ3  LYS 104           HZ3      LYS 104  15.729  -0.426  -4.152
  375    H    ARG 105           HN       ARG 105  13.528   1.051   1.883
  376    HA   ARG 105           HA       ARG 105  14.903  -0.966   3.144
  377    HB2  ARG 105           HB2      ARG 105  12.578   0.679   4.170
  378    HB3  ARG 105           HB1      ARG 105  13.570  -0.344   5.196
  379    HG2  ARG 105           HG2      ARG 105  14.721   1.872   3.535
  380    HG3  ARG 105           HG1      ARG 105  14.122   2.115   5.182
  381    HD2  ARG 105           HD2      ARG 105  16.313   0.228   4.326
  382    HD3  ARG 105           HD1      ARG 105  16.517   1.751   5.195
  383    HE   ARG 105           HE       ARG 105  14.766   0.129   6.665
  384   HH11  ARG 105          HH11      ARG 105  18.138   0.248   5.721
  385   HH12  ARG 105          HH12      ARG 105  18.687  -0.682   7.088
  386   HH21  ARG 105          HH21      ARG 105  15.479  -1.080   8.470
  387   HH22  ARG 105          HH22      ARG 105  17.172  -1.418   8.660
  388    H    HIS 106           HN       HIS 106  11.422  -0.745   2.597
  389    HA   HIS 106           HA       HIS 106  10.830  -3.249   3.811
  390    HB2  HIS 106           HB2      HIS 106   9.145  -1.479   3.672
  391    HB3  HIS 106           HB1      HIS 106   9.192  -1.559   1.913
  392    HD1  HIS 106           HD1      HIS 106   8.125  -3.674   4.894
  393    HD2  HIS 106           HD2      HIS 106   7.694  -3.437   0.772
  394    HE1  HIS 106           HE1      HIS 106   6.407  -5.422   4.265
  395    H    GLN 107           HN       GLN 107  12.134  -2.497   0.754
  396    HA   GLN 107           HA       GLN 107  10.903  -4.718  -0.621
  397    HB2  GLN 107           HB2      GLN 107  13.269  -3.260  -1.737
  398    HB3  GLN 107           HB1      GLN 107  11.898  -3.920  -2.588
  399    HG2  GLN 107           HG2      GLN 107  10.584  -2.012  -1.587
  400    HG3  GLN 107           HG1      GLN 107  12.134  -1.355  -1.116
  401   HE21  GLN 107          HE21      GLN 107  10.069  -2.158  -3.758
  402   HE22  GLN 107          HE22      GLN 107  10.933  -1.271  -4.975
  403    H    LEU 108           HN       LEU 108  13.672  -3.712   1.042
  404    HA   LEU 108           HA       LEU 108  15.472  -5.719   0.178
  405    HB2  LEU 108           HB2      LEU 108  15.488  -3.711   2.397
  406    HB3  LEU 108           HB1      LEU 108  16.735  -4.939   2.277
  407    HG   LEU 108           HG       LEU 108  17.824  -3.869   0.626
  408   HD11  LEU 108          HD11      LEU 108  16.054  -4.334  -0.987
  409   HD12  LEU 108          HD12      LEU 108  16.774  -2.742  -1.243
  410   HD13  LEU 108          HD13      LEU 108  15.193  -2.883  -0.461
  411   HD21  LEU 108          HD21      LEU 108  16.034  -1.627   1.546
  412   HD22  LEU 108          HD22      LEU 108  17.585  -1.440   0.721
  413   HD23  LEU 108          HD23      LEU 108  17.523  -2.158   2.331
  414    H    VAL 109           HN       VAL 109  13.240  -5.290   2.818
  415    HA   VAL 109           HA       VAL 109  14.301  -7.289   4.456
  416    HB   VAL 109           HB       VAL 109  12.267  -7.176   5.696
  417   HG11  VAL 109          HG11      VAL 109  13.667  -5.159   5.778
  418   HG12  VAL 109          HG12      VAL 109  11.955  -4.796   6.014
  419   HG13  VAL 109          HG13      VAL 109  12.716  -4.481   4.452
  420   HG21  VAL 109          HG21      VAL 109  10.246  -6.090   4.807
  421   HG22  VAL 109          HG22      VAL 109  10.708  -7.523   3.886
  422   HG23  VAL 109          HG23      VAL 109  11.067  -5.916   3.252
  423    H    HIS 110           HN       HIS 110  12.530  -7.388   1.546
  424    HA   HIS 110           HA       HIS 110  11.429 -10.033   1.982
  425    HB2  HIS 110           HB2      HIS 110  11.581  -8.190  -0.359
  426    HB3  HIS 110           HB1      HIS 110  11.055  -9.842  -0.570
  427    HD1  HIS 110           HD1      HIS 110   8.651 -10.393   0.175
  428    HD2  HIS 110           HD2      HIS 110   9.965  -6.589   1.147
  429    HE1  HIS 110           HE1      HIS 110   6.597  -9.078   0.848
  430    H    SER 111           HN       SER 111  14.537  -9.303   1.774
  431    HA   SER 111           HA       SER 111  15.297 -11.951   1.071
  432    HB2  SER 111           HB2      SER 111  15.036 -11.106  -1.219
  433    HB3  SER 111           HB1      SER 111  16.099  -9.751  -0.849
  434    HG   SER 111           HG       SER 111  16.758 -12.515  -0.997
  435    H    GLY 112           HN       GLY 112  16.189  -8.679   1.489
  436    HA2  GLY 112           HA2      GLY 112  17.543  -7.658   3.006
  437    HA3  GLY 112           HA1      GLY 112  18.031  -9.248   3.606
  Start of MODEL    3
    1    H    LYS  58           HT1      LYS  58 -15.783  -8.206  -5.311
    2    HA   LYS  58           HA       LYS  58 -16.270  -9.779  -2.861
    3    HB2  LYS  58           HB2      LYS  58 -13.917 -10.649  -3.286
    4    HB3  LYS  58           HB1      LYS  58 -15.195 -11.309  -4.288
    5    HG2  LYS  58           HG2      LYS  58 -14.510  -9.684  -6.073
    6    HG3  LYS  58           HG1      LYS  58 -13.112  -9.287  -5.067
    7    HD2  LYS  58           HD2      LYS  58 -12.350 -11.578  -5.143
    8    HD3  LYS  58           HD1      LYS  58 -13.809 -12.070  -6.003
    9    HE2  LYS  58           HE2      LYS  58 -12.034 -11.920  -7.591
   10    HE3  LYS  58           HE1      LYS  58 -13.126 -10.568  -7.870
   11    HZ1  LYS  58           HZ1      LYS  58 -10.652 -10.331  -6.254
   12    HZ2  LYS  58           HZ2      LYS  58 -11.619  -9.078  -6.875
   13    HZ3  LYS  58           HZ3      LYS  58 -10.696 -10.038  -7.919
   14    HA   PRO  59           HA       PRO  59 -14.650  -6.226  -0.929
   15    HB2  PRO  59           HB2      PRO  59 -13.961  -7.326   1.460
   16    HB3  PRO  59           HB1      PRO  59 -15.629  -6.975   0.993
   17    HG2  PRO  59           HG2      PRO  59 -14.142  -9.561   0.910
   18    HG3  PRO  59           HG1      PRO  59 -15.812  -9.244   1.418
   19    HD2  PRO  59           HD2      PRO  59 -15.191 -10.244  -1.015
   20    HD3  PRO  59           HD1      PRO  59 -16.586  -9.187  -0.751
   21    H    TYR  60           HN       TYR  60 -12.895  -5.313  -1.264
   22    HA   TYR  60           HA       TYR  60 -10.324  -6.716  -1.204
   23    HB2  TYR  60           HB2      TYR  60 -11.057  -3.998  -2.327
   24    HB3  TYR  60           HB1      TYR  60  -9.461  -4.744  -2.419
   25    HD1  TYR  60           HD2      TYR  60  -9.704  -7.318  -3.343
   26    HD2  TYR  60           HD1      TYR  60 -12.196  -4.020  -4.306
   27    HE1  TYR  60           HE2      TYR  60 -10.321  -8.407  -5.445
   28    HE2  TYR  60           HE1      TYR  60 -12.817  -5.099  -6.419
   29    HH   TYR  60           HH       TYR  60 -12.017  -6.775  -7.951
   30    H    GLY  61           HN       GLY  61  -9.669  -6.684   0.904
   31    HA2  GLY  61           HA2      GLY  61 -10.037  -4.155   2.334
   32    HA3  GLY  61           HA1      GLY  61 -10.031  -5.732   3.100
   33    H    CYS  62           HN       CYS  62  -8.554  -3.347   3.598
   34    HA   CYS  62           HA       CYS  62  -5.834  -3.605   2.827
   35    HB2  CYS  62           HB2      CYS  62  -7.389  -1.692   4.012
   36    HB3  CYS  62           HB1      CYS  62  -6.439  -2.263   5.375
   37    H    GLU  63           HN       GLU  63  -4.329  -4.948   3.613
   38    HA   GLU  63           HA       GLU  63  -4.946  -6.960   5.522
   39    HB2  GLU  63           HB2      GLU  63  -2.087  -6.426   5.163
   40    HB3  GLU  63           HB1      GLU  63  -2.997  -7.894   4.897
   41    HG2  GLU  63           HG2      GLU  63  -2.111  -7.350   2.814
   42    HG3  GLU  63           HG1      GLU  63  -3.792  -6.827   2.731
   43    H    GLU  64           HN       GLU  64  -3.797  -3.796   5.794
   44    HA   GLU  64           HA       GLU  64  -2.228  -4.194   8.191
   45    HB2  GLU  64           HB2      GLU  64  -2.325  -1.517   7.873
   46    HB3  GLU  64           HB1      GLU  64  -1.185  -2.561   7.036
   47    HG2  GLU  64           HG2      GLU  64  -2.457  -2.551   5.064
   48    HG3  GLU  64           HG1      GLU  64  -3.868  -1.882   5.890
   49    H    CYS  65           HN       CYS  65  -5.352  -2.803   7.331
   50    HA   CYS  65           HA       CYS  65  -5.725  -2.074  10.145
   51    HB2  CYS  65           HB2      CYS  65  -7.118  -0.117   9.071
   52    HB3  CYS  65           HB1      CYS  65  -5.365   0.016   9.200
   53    H    GLY  66           HN       GLY  66  -6.650  -3.910   7.653
   54    HA2  GLY  66           HA2      GLY  66  -8.295  -5.398   7.386
   55    HA3  GLY  66           HA1      GLY  66  -8.676  -5.114   9.077
   56    H    LYS  67           HN       LYS  67  -8.913  -2.739   6.481
   57    HA   LYS  67           HA       LYS  67 -11.833  -2.765   6.848
   58    HB2  LYS  67           HB2      LYS  67 -10.689  -0.623   7.386
   59    HB3  LYS  67           HB1      LYS  67 -10.120  -0.548   5.726
   60    HG2  LYS  67           HG2      LYS  67 -12.019   0.879   5.944
   61    HG3  LYS  67           HG1      LYS  67 -12.476  -0.518   4.970
   62    HD2  LYS  67           HD2      LYS  67 -14.258  -0.116   6.495
   63    HD3  LYS  67           HD1      LYS  67 -13.402  -1.550   7.068
   64    HE2  LYS  67           HE2      LYS  67 -12.192  -0.164   8.689
   65    HE3  LYS  67           HE1      LYS  67 -13.065   1.257   8.120
   66    HZ1  LYS  67           HZ1      LYS  67 -14.190  -1.112   9.508
   67    HZ2  LYS  67           HZ2      LYS  67 -15.147   0.071   8.763
   68    HZ3  LYS  67           HZ3      LYS  67 -14.148   0.491  10.065
   69    H    SER  68           HN       SER  68 -13.071  -3.335   5.187
   70    HA   SER  68           HA       SER  68 -11.700  -4.083   2.722
   71    HB2  SER  68           HB2      SER  68 -14.299  -5.009   2.498
   72    HB3  SER  68           HB1      SER  68 -12.892  -5.954   3.000
   73    HG   SER  68           HG       SER  68 -13.586  -5.932   5.008
   74    H    TYR  69           HN       TYR  69 -12.140  -3.301   0.792
   75    HA   TYR  69           HA       TYR  69 -14.358  -1.371   0.565
   76    HB2  TYR  69           HB2      TYR  69 -11.583  -1.268  -0.582
   77    HB3  TYR  69           HB1      TYR  69 -12.912  -0.408  -1.357
   78    HD1  TYR  69           HD2      TYR  69 -10.905  -0.679   1.731
   79    HD2  TYR  69           HD1      TYR  69 -13.773   1.566  -0.445
   80    HE1  TYR  69           HE2      TYR  69 -10.621   1.183   3.298
   81    HE2  TYR  69           HE1      TYR  69 -13.500   3.446   1.109
   82    HH   TYR  69           HH       TYR  69 -10.958   3.679   3.276
   83    H    ARG  70           HN       ARG  70 -15.528  -1.338  -1.303
   84    HA   ARG  70           HA       ARG  70 -15.902  -3.891  -2.526
   85    HB2  ARG  70           HB2      ARG  70 -17.772  -2.432  -1.963
   86    HB3  ARG  70           HB1      ARG  70 -17.152  -1.191  -3.043
   87    HG2  ARG  70           HG2      ARG  70 -17.729  -2.395  -4.951
   88    HG3  ARG  70           HG1      ARG  70 -17.923  -3.907  -4.048
   89    HD2  ARG  70           HD2      ARG  70 -19.674  -1.457  -3.856
   90    HD3  ARG  70           HD1      ARG  70 -20.098  -2.992  -4.616
   91    HE   ARG  70           HE       ARG  70 -19.631  -3.877  -2.209
   92   HH11  ARG  70          HH11      ARG  70 -21.196  -0.860  -3.060
   93   HH12  ARG  70          HH12      ARG  70 -22.154  -0.810  -1.608
   94   HH21  ARG  70          HH21      ARG  70 -20.884  -3.811  -0.314
   95   HH22  ARG  70          HH22      ARG  70 -21.984  -2.491  -0.058
   96    H    LEU  71           HN       LEU  71 -14.445  -0.843  -3.497
   97    HA   LEU  71           HA       LEU  71 -13.928  -1.950  -6.164
   98    HB2  LEU  71           HB2      LEU  71 -14.121   0.833  -5.067
   99    HB3  LEU  71           HB1      LEU  71 -13.247   0.529  -6.557
  100    HG   LEU  71           HG       LEU  71 -15.180  -0.137  -7.702
  101   HD11  LEU  71          HD11      LEU  71 -17.349  -0.499  -6.703
  102   HD12  LEU  71          HD12      LEU  71 -16.678  -0.168  -5.105
  103   HD13  LEU  71          HD13      LEU  71 -16.145  -1.588  -6.009
  104   HD21  LEU  71          HD21      LEU  71 -15.996   2.100  -5.877
  105   HD22  LEU  71          HD22      LEU  71 -16.713   1.730  -7.445
  106   HD23  LEU  71          HD23      LEU  71 -15.036   2.271  -7.347
  107    H    ILE  72           HN       ILE  72 -11.887  -2.029  -6.992
  108    HA   ILE  72           HA       ILE  72  -9.689  -2.283  -5.253
  109    HB   ILE  72           HB       ILE  72  -9.886  -2.016  -8.241
  110   HG12  ILE  72          HG12      ILE  72 -10.551  -4.120  -7.051
  111   HG13  ILE  72          HG11      ILE  72  -9.259  -4.341  -8.226
  112   HG21  ILE  72          HG21      ILE  72  -7.484  -2.501  -8.383
  113   HG22  ILE  72          HG22      ILE  72  -7.358  -2.325  -6.634
  114   HG23  ILE  72          HG23      ILE  72  -7.799  -0.936  -7.628
  115   HD11  ILE  72          HD11      ILE  72  -8.930  -4.096  -5.242
  116   HD12  ILE  72          HD12      ILE  72  -7.623  -4.316  -6.408
  117   HD13  ILE  72          HD13      ILE  72  -8.827  -5.586  -6.184
  118    H    SER  73           HN       SER  73 -10.667   0.385  -7.401
  119    HA   SER  73           HA       SER  73  -8.459   2.030  -6.683
  120    HB2  SER  73           HB2      SER  73  -9.746   2.353  -8.776
  121    HB3  SER  73           HB1      SER  73 -11.141   2.858  -7.825
  122    HG   SER  73           HG       SER  73  -9.147   4.342  -7.000
  123    H    LEU  74           HN       LEU  74 -11.525   1.386  -5.254
  124    HA   LEU  74           HA       LEU  74 -11.723   3.567  -3.531
  125    HB2  LEU  74           HB2      LEU  74 -13.058   1.093  -4.022
  126    HB3  LEU  74           HB1      LEU  74 -12.744   1.220  -2.294
  127    HG   LEU  74           HG       LEU  74 -14.234   3.220  -3.986
  128   HD11  LEU  74          HD11      LEU  74 -16.139   2.596  -2.608
  129   HD12  LEU  74          HD12      LEU  74 -15.151   1.415  -1.745
  130   HD13  LEU  74          HD13      LEU  74 -15.513   1.184  -3.457
  131   HD21  LEU  74          HD21      LEU  74 -13.376   3.166  -1.125
  132   HD22  LEU  74          HD22      LEU  74 -14.559   4.310  -1.781
  133   HD23  LEU  74          HD23      LEU  74 -12.891   4.309  -2.372
  134    H    LEU  75           HN       LEU  75 -10.465   0.337  -3.015
  135    HA   LEU  75           HA       LEU  75  -9.419   0.848  -0.430
  136    HB2  LEU  75           HB2      LEU  75  -9.858  -1.385  -0.945
  137    HB3  LEU  75           HB1      LEU  75  -9.078  -1.273  -2.516
  138    HG   LEU  75           HG       LEU  75  -6.899  -0.985  -1.217
  139   HD11  LEU  75          HD11      LEU  75  -7.872  -0.525   0.968
  140   HD12  LEU  75          HD12      LEU  75  -6.862  -1.972   1.011
  141   HD13  LEU  75          HD13      LEU  75  -8.620  -2.123   0.977
  142   HD21  LEU  75          HD21      LEU  75  -7.474  -2.909  -2.514
  143   HD22  LEU  75          HD22      LEU  75  -8.463  -3.546  -1.196
  144   HD23  LEU  75          HD23      LEU  75  -6.709  -3.427  -1.007
  145    H    ASN  76           HN       ASN  76  -8.326   1.204  -3.671
  146    HA   ASN  76           HA       ASN  76  -5.548   1.449  -3.219
  147    HB2  ASN  76           HB2      ASN  76  -7.212   1.414  -5.413
  148    HB3  ASN  76           HB1      ASN  76  -6.627   3.080  -5.399
  149   HD21  ASN  76          HD21      ASN  76  -5.785  -0.265  -5.673
  150   HD22  ASN  76          HD22      ASN  76  -4.188  -0.032  -6.310
  151    H    LEU  77           HN       LEU  77  -8.223   3.728  -3.275
  152    HA   LEU  77           HA       LEU  77  -6.557   5.997  -2.824
  153    HB2  LEU  77           HB2      LEU  77  -9.428   5.424  -3.163
  154    HB3  LEU  77           HB1      LEU  77  -9.038   6.839  -2.211
  155    HG   LEU  77           HG       LEU  77  -9.453   7.106  -4.737
  156   HD11  LEU  77          HD11      LEU  77  -8.623   8.851  -3.275
  157   HD12  LEU  77          HD12      LEU  77  -7.802   8.910  -4.835
  158   HD13  LEU  77          HD13      LEU  77  -6.986   8.220  -3.432
  159   HD21  LEU  77          HD21      LEU  77  -7.481   6.843  -6.142
  160   HD22  LEU  77          HD22      LEU  77  -8.001   5.291  -5.487
  161   HD23  LEU  77          HD23      LEU  77  -6.608   6.120  -4.793
  162    H    HIS  78           HN       HIS  78  -8.307   3.709  -0.888
  163    HA   HIS  78           HA       HIS  78  -8.101   5.055   1.594
  164    HB2  HIS  78           HB2      HIS  78  -9.531   3.177   1.581
  165    HB3  HIS  78           HB1      HIS  78  -8.320   2.154   0.802
  166    HD1  HIS  78           HD1      HIS  78  -9.070   3.711   4.204
  167    HD2  HIS  78           HD2      HIS  78  -6.737   0.721   2.480
  168    HE1  HIS  78           HE1      HIS  78  -8.037   2.416   6.115
  169    H    LYS  79           HN       LYS  79  -5.959   2.921  -0.192
  170    HA   LYS  79           HA       LYS  79  -3.931   2.786   1.807
  171    HB2  LYS  79           HB2      LYS  79  -4.380   1.239  -0.249
  172    HB3  LYS  79           HB1      LYS  79  -3.440   2.428  -1.142
  173    HG2  LYS  79           HG2      LYS  79  -1.890   0.794  -0.561
  174    HG3  LYS  79           HG1      LYS  79  -1.635   2.068   0.632
  175    HD2  LYS  79           HD2      LYS  79  -1.626  -0.075   1.742
  176    HD3  LYS  79           HD1      LYS  79  -3.070   0.821   2.216
  177    HE2  LYS  79           HE2      LYS  79  -3.692  -1.459   1.786
  178    HE3  LYS  79           HE1      LYS  79  -4.353  -0.448   0.505
  179    HZ1  LYS  79           HZ1      LYS  79  -3.354  -2.519  -0.315
  180    HZ2  LYS  79           HZ2      LYS  79  -1.847  -2.036   0.279
  181    HZ3  LYS  79           HZ3      LYS  79  -2.601  -1.147  -0.959
  182    H    LYS  80           HN       LYS  80  -4.669   4.848  -0.915
  183    HA   LYS  80           HA       LYS  80  -2.318   6.428  -0.809
  184    HB2  LYS  80           HB2      LYS  80  -3.656   6.414  -2.815
  185    HB3  LYS  80           HB1      LYS  80  -5.068   6.984  -1.938
  186    HG2  LYS  80           HG2      LYS  80  -4.156   9.139  -1.688
  187    HG3  LYS  80           HG1      LYS  80  -2.552   8.612  -2.165
  188    HD2  LYS  80           HD2      LYS  80  -4.926   8.487  -4.013
  189    HD3  LYS  80           HD1      LYS  80  -3.907   9.921  -3.878
  190    HE2  LYS  80           HE2      LYS  80  -1.942   8.538  -4.448
  191    HE3  LYS  80           HE1      LYS  80  -3.012   7.156  -4.659
  192    HZ1  LYS  80           HZ1      LYS  80  -3.173   9.679  -6.223
  193    HZ2  LYS  80           HZ2      LYS  80  -4.116   8.287  -6.464
  194    HZ3  LYS  80           HZ3      LYS  80  -2.445   8.246  -6.764
  195    H    ARG  81           HN       ARG  81  -5.429   6.569   0.852
  196    HA   ARG  81           HA       ARG  81  -5.205   9.123   1.972
  197    HB2  ARG  81           HB2      ARG  81  -6.544   6.603   2.917
  198    HB3  ARG  81           HB1      ARG  81  -6.650   8.104   3.813
  199    HG2  ARG  81           HG2      ARG  81  -7.523   7.706   0.975
  200    HG3  ARG  81           HG1      ARG  81  -8.588   7.734   2.381
  201    HD2  ARG  81           HD2      ARG  81  -7.886  10.036   2.857
  202    HD3  ARG  81           HD1      ARG  81  -6.836  10.005   1.443
  203    HE   ARG  81           HE       ARG  81  -9.455   9.373   0.637
  204   HH11  ARG  81          HH11      ARG  81  -7.587  12.078   1.857
  205   HH12  ARG  81          HH12      ARG  81  -8.561  13.280   1.063
  206   HH21  ARG  81          HH21      ARG  81 -10.763  10.962  -0.391
  207   HH22  ARG  81          HH22      ARG  81 -10.372  12.644  -0.200
  208    H    HIS  82           HN       HIS  82  -3.893   6.046   3.035
  209    HA   HIS  82           HA       HIS  82  -3.105   6.779   5.612
  210    HB2  HIS  82           HB2      HIS  82  -2.121   4.686   3.713
  211    HB3  HIS  82           HB1      HIS  82  -1.328   4.925   5.250
  212    HD1  HIS  82           HD1      HIS  82  -2.705   4.256   7.396
  213    HD2  HIS  82           HD2      HIS  82  -4.489   3.431   3.740
  214    HE1  HIS  82           HE1      HIS  82  -4.587   2.638   7.864
  215    H    SER  83           HN       SER  83  -1.395   7.196   2.542
  216    HA   SER  83           HA       SER  83   0.836   8.418   4.020
  217    HB2  SER  83           HB2      SER  83   0.776   7.300   1.214
  218    HB3  SER  83           HB1      SER  83   2.191   7.979   2.018
  219    HG   SER  83           HG       SER  83   1.457   5.502   2.069
  220    H    GLY  84           HN       GLY  84  -1.834   9.562   2.966
  221    HA2  GLY  84           HA2      GLY  84  -2.427  11.706   2.300
  222    HA3  GLY  84           HA1      GLY  84  -0.724  12.060   2.027
  223    H    GLU  85           HN       GLU  85   0.211  10.644   0.160
  224    HA   GLU  85           HA       GLU  85  -1.791  10.314  -1.953
  225    HB2  GLU  85           HB2      GLU  85  -0.119  10.920  -3.593
  226    HB3  GLU  85           HB1      GLU  85  -0.238  12.211  -2.408
  227    HG2  GLU  85           HG2      GLU  85   1.788  10.158  -1.864
  228    HG3  GLU  85           HG1      GLU  85   2.071  11.167  -3.277
  229    H    ALA  86           HN       ALA  86  -0.307   8.898  -3.711
  230    HA   ALA  86           HA       ALA  86   0.920   6.676  -2.289
  231    HB1  ALA  86           HB1      ALA  86  -1.481   6.123  -2.354
  232    HB2  ALA  86           HB2      ALA  86  -0.506   5.003  -3.304
  233    HB3  ALA  86           HB3      ALA  86  -1.446   6.256  -4.113
  234    H    ARG  87           HN       ARG  87   2.812   6.611  -3.297
  235    HA   ARG  87           HA       ARG  87   2.841   7.141  -6.152
  236    HB2  ARG  87           HB2      ARG  87   5.248   6.938  -4.370
  237    HB3  ARG  87           HB1      ARG  87   5.123   7.731  -5.931
  238    HG2  ARG  87           HG2      ARG  87   3.527   8.643  -3.583
  239    HG3  ARG  87           HG1      ARG  87   5.205   9.134  -3.813
  240    HD2  ARG  87           HD2      ARG  87   4.551   9.971  -6.085
  241    HD3  ARG  87           HD1      ARG  87   2.875   9.613  -5.663
  242    HE   ARG  87           HE       ARG  87   3.702  11.203  -3.633
  243   HH11  ARG  87          HH11      ARG  87   3.730  11.547  -7.122
  244   HH12  ARG  87          HH12      ARG  87   3.615  13.285  -7.068
  245   HH21  ARG  87          HH21      ARG  87   3.520  13.475  -3.569
  246   HH22  ARG  87          HH22      ARG  87   3.511  14.370  -5.061
  247    H    TYR  88           HN       TYR  88   5.003   5.248  -4.160
  248    HA   TYR  88           HA       TYR  88   5.172   3.192  -6.210
  249    HB2  TYR  88           HB2      TYR  88   6.676   3.573  -3.619
  250    HB3  TYR  88           HB1      TYR  88   7.011   2.325  -4.807
  251    HD1  TYR  88           HD1      TYR  88   6.744   6.027  -4.530
  252    HD2  TYR  88           HD2      TYR  88   8.614   2.708  -6.402
  253    HE1  TYR  88           HE1      TYR  88   8.284   7.551  -5.686
  254    HE2  TYR  88           HE2      TYR  88  10.155   4.206  -7.556
  255    HH   TYR  88           HH       TYR  88  10.277   6.562  -8.266
  256    H    ARG  89           HN       ARG  89   4.836   0.976  -5.803
  257    HA   ARG  89           HA       ARG  89   3.350   0.354  -3.328
  258    HB2  ARG  89           HB2      ARG  89   3.375  -0.927  -6.039
  259    HB3  ARG  89           HB1      ARG  89   3.055  -1.912  -4.627
  260    HG2  ARG  89           HG2      ARG  89   1.129  -0.707  -4.100
  261    HG3  ARG  89           HG1      ARG  89   1.488   0.539  -5.308
  262    HD2  ARG  89           HD2      ARG  89   1.451  -1.464  -6.958
  263    HD3  ARG  89           HD1      ARG  89   0.545  -2.253  -5.670
  264    HE   ARG  89           HE       ARG  89  -0.568   0.285  -6.219
  265   HH11  ARG  89          HH11      ARG  89  -0.327  -2.942  -7.569
  266   HH12  ARG  89          HH12      ARG  89  -1.802  -2.805  -8.482
  267   HH21  ARG  89          HH21      ARG  89  -2.469   0.487  -7.430
  268   HH22  ARG  89          HH22      ARG  89  -3.021  -0.843  -8.415
  269    H    CYS  90           HN       CYS  90   4.039  -1.355  -2.129
  270    HA   CYS  90           HA       CYS  90   6.681  -2.380  -2.400
  271    HB2  CYS  90           HB2      CYS  90   5.144  -2.374  -0.320
  272    HB3  CYS  90           HB1      CYS  90   4.401  -3.779  -1.022
  273    H    GLU  91           HN       GLU  91   7.264  -3.754  -3.999
  274    HA   GLU  91           HA       GLU  91   5.482  -4.630  -5.940
  275    HB2  GLU  91           HB2      GLU  91   7.376  -6.054  -6.727
  276    HB3  GLU  91           HB1      GLU  91   7.767  -4.349  -6.510
  277    HG2  GLU  91           HG2      GLU  91   8.658  -4.925  -4.297
  278    HG3  GLU  91           HG1      GLU  91   8.418  -6.624  -4.675
  279    H    ASP  92           HN       ASP  92   5.709  -5.818  -2.881
  280    HA   ASP  92           HA       ASP  92   5.003  -8.539  -3.749
  281    HB2  ASP  92           HB2      ASP  92   5.731  -9.201  -1.404
  282    HB3  ASP  92           HB1      ASP  92   7.008  -8.721  -2.518
  283    H    CYS  93           HN       CYS  93   4.090  -5.816  -1.626
  284    HA   CYS  93           HA       CYS  93   1.710  -7.364  -1.010
  285    HB2  CYS  93           HB2      CYS  93   1.892  -7.030   1.286
  286    HB3  CYS  93           HB1      CYS  93   3.526  -7.423   0.792
  287    H    GLY  94           HN       GLY  94   2.875  -4.660  -2.388
  288    HA2  GLY  94           HA2      GLY  94   1.843  -2.984  -3.405
  289    HA3  GLY  94           HA1      GLY  94   0.320  -3.772  -3.023
  290    H    LYS  95           HN       LYS  95   2.672  -2.518  -0.709
  291    HA   LYS  95           HA       LYS  95   0.708  -0.664   0.313
  292    HB2  LYS  95           HB2      LYS  95   3.585  -0.995   1.119
  293    HB3  LYS  95           HB1      LYS  95   2.309  -0.214   2.041
  294    HG2  LYS  95           HG2      LYS  95   1.188  -2.510   1.989
  295    HG3  LYS  95           HG1      LYS  95   2.785  -3.108   1.526
  296    HD2  LYS  95           HD2      LYS  95   3.181  -3.201   3.715
  297    HD3  LYS  95           HD1      LYS  95   3.394  -1.462   3.573
  298    HE2  LYS  95           HE2      LYS  95   1.908  -1.849   5.400
  299    HE3  LYS  95           HE1      LYS  95   0.969  -1.183   4.068
  300    HZ1  LYS  95           HZ1      LYS  95   1.075  -4.016   4.947
  301    HZ2  LYS  95           HZ2      LYS  95   0.329  -3.514   3.512
  302    HZ3  LYS  95           HZ3      LYS  95  -0.254  -2.968   5.001
  303    H    LEU  96           HN       LEU  96   0.779   1.511   0.016
  304    HA   LEU  96           HA       LEU  96   2.465   2.308  -2.214
  305    HB2  LEU  96           HB2      LEU  96  -0.081   3.359  -1.064
  306    HB3  LEU  96           HB1      LEU  96   0.865   4.334  -2.177
  307    HG   LEU  96           HG       LEU  96  -0.900   3.245  -3.396
  308   HD11  LEU  96          HD11      LEU  96   0.356   2.007  -5.054
  309   HD12  LEU  96          HD12      LEU  96   1.698   1.822  -3.920
  310   HD13  LEU  96          HD13      LEU  96   1.262   3.429  -4.521
  311   HD21  LEU  96          HD21      LEU  96  -1.081   0.805  -3.517
  312   HD22  LEU  96          HD22      LEU  96  -1.378   1.419  -1.889
  313   HD23  LEU  96          HD23      LEU  96   0.171   0.669  -2.279
  314    H    PHE  97           HN       PHE  97   4.348   3.069  -1.639
  315    HA   PHE  97           HA       PHE  97   4.495   4.900   0.661
  316    HB2  PHE  97           HB2      PHE  97   6.757   3.495  -0.801
  317    HB3  PHE  97           HB1      PHE  97   6.946   4.599   0.554
  318    HD1  PHE  97           HD2      PHE  97   5.723   1.265  -0.435
  319    HD2  PHE  97           HD1      PHE  97   6.455   3.955   2.787
  320    HE1  PHE  97           HE2      PHE  97   5.378  -0.575   1.188
  321    HE2  PHE  97           HE1      PHE  97   6.118   2.127   4.396
  322    HZ   PHE  97           HZ       PHE  97   5.581  -0.135   3.591
  323    H    THR  98           HN       THR  98   5.311   6.926   0.478
  324    HA   THR  98           HA       THR  98   5.117   8.026  -2.204
  325    HB   THR  98           HB       THR  98   4.948  10.193  -1.045
  326    HG1  THR  98           HG1      THR  98   4.911  10.190   1.245
  327   HG21  THR  98          HG21      THR  98   2.982   8.798  -1.467
  328   HG22  THR  98          HG22      THR  98   2.797   9.712   0.035
  329   HG23  THR  98          HG23      THR  98   3.217   7.994   0.087
  330    H    THR  99           HN       THR  99   7.422   6.677  -0.530
  331    HA   THR  99           HA       THR  99   9.480   8.178  -1.913
  332    HB   THR  99           HB       THR  99   9.473   7.540   1.036
  333    HG1  THR  99           HG1      THR  99   8.993   9.735  -0.414
  334   HG21  THR  99          HG21      THR  99  11.780   8.120   1.141
  335   HG22  THR  99          HG22      THR  99  11.806   8.534  -0.575
  336   HG23  THR  99          HG23      THR  99  11.584   6.858  -0.077
  337    H    SER 100           HN       SER 100  10.853   6.838  -2.894
  338    HA   SER 100           HA       SER 100  10.259   4.081  -3.051
  339    HB2  SER 100           HB2      SER 100  12.281   4.019  -4.537
  340    HB3  SER 100           HB1      SER 100  11.085   5.242  -4.992
  341    HG   SER 100           HG       SER 100  12.857   6.437  -4.974
  342    H    GLY 101           HN       GLY 101  12.562   5.957  -1.249
  343    HA2  GLY 101           HA2      GLY 101  14.168   3.752  -0.402
  344    HA3  GLY 101           HA1      GLY 101  14.144   5.350   0.305
  345    H    ASN 102           HN       ASN 102  11.502   5.579   1.148
  346    HA   ASN 102           HA       ASN 102  11.342   4.091   3.516
  347    HB2  ASN 102           HB2      ASN 102   9.153   5.340   1.843
  348    HB3  ASN 102           HB1      ASN 102   8.873   4.616   3.418
  349   HD21  ASN 102          HD21      ASN 102  11.379   5.573   4.540
  350   HD22  ASN 102          HD22      ASN 102  11.187   7.271   4.799
  351    H    LEU 103           HN       LEU 103  10.157   3.642   0.294
  352    HA   LEU 103           HA       LEU 103   8.606   1.377   0.723
  353    HB2  LEU 103           HB2      LEU 103   8.302   2.585  -1.253
  354    HB3  LEU 103           HB1      LEU 103  10.028   2.621  -1.594
  355    HG   LEU 103           HG       LEU 103   9.881   0.142  -1.998
  356   HD11  LEU 103          HD11      LEU 103   7.686  -0.052  -0.778
  357   HD12  LEU 103          HD12      LEU 103   7.782  -0.867  -2.343
  358   HD13  LEU 103          HD13      LEU 103   6.930   0.687  -2.207
  359   HD21  LEU 103          HD21      LEU 103   8.365   2.100  -3.675
  360   HD22  LEU 103          HD22      LEU 103   8.884   0.511  -4.240
  361   HD23  LEU 103          HD23      LEU 103  10.080   1.724  -3.773
  362    H    LYS 104           HN       LYS 104  11.840   1.773  -0.591
  363    HA   LYS 104           HA       LYS 104  12.717  -0.761  -0.965
  364    HB2  LYS 104           HB2      LYS 104  13.843   1.284  -1.599
  365    HB3  LYS 104           HB1      LYS 104  14.228   1.611   0.079
  366    HG2  LYS 104           HG2      LYS 104  15.635  -0.339   0.182
  367    HG3  LYS 104           HG1      LYS 104  15.201  -0.775  -1.478
  368    HD2  LYS 104           HD2      LYS 104  17.361   0.311  -1.469
  369    HD3  LYS 104           HD1      LYS 104  16.173   1.359  -2.248
  370    HE2  LYS 104           HE2      LYS 104  15.957   2.668  -0.210
  371    HE3  LYS 104           HE1      LYS 104  17.092   1.600   0.615
  372    HZ1  LYS 104           HZ1      LYS 104  18.822   2.290  -0.905
  373    HZ2  LYS 104           HZ2      LYS 104  18.149   3.644  -0.145
  374    HZ3  LYS 104           HZ3      LYS 104  17.738   3.280  -1.753
  375    H    ARG 105           HN       ARG 105  13.037   1.098   2.076
  376    HA   ARG 105           HA       ARG 105  14.349  -0.927   3.509
  377    HB2  ARG 105           HB2      ARG 105  12.439   1.113   4.658
  378    HB3  ARG 105           HB1      ARG 105  13.754   0.296   5.498
  379    HG2  ARG 105           HG2      ARG 105  15.345   1.377   3.968
  380    HG3  ARG 105           HG1      ARG 105  14.009   2.267   3.244
  381    HD2  ARG 105           HD2      ARG 105  13.517   3.190   5.520
  382    HD3  ARG 105           HD1      ARG 105  15.025   2.453   6.069
  383    HE   ARG 105           HE       ARG 105  16.113   3.852   4.269
  384   HH11  ARG 105          HH11      ARG 105  13.206   4.824   5.947
  385   HH12  ARG 105          HH12      ARG 105  13.415   6.517   5.616
  386   HH21  ARG 105          HH21      ARG 105  16.392   6.080   3.805
  387   HH22  ARG 105          HH22      ARG 105  15.210   7.229   4.364
  388    H    HIS 106           HN       HIS 106  10.976  -0.281   2.926
  389    HA   HIS 106           HA       HIS 106   9.995  -2.417   4.580
  390    HB2  HIS 106           HB2      HIS 106   8.564  -0.485   4.118
  391    HB3  HIS 106           HB1      HIS 106   8.625  -0.830   2.393
  392    HD1  HIS 106           HD1      HIS 106   7.104  -2.171   5.605
  393    HD2  HIS 106           HD2      HIS 106   6.966  -2.744   1.496
  394    HE1  HIS 106           HE1      HIS 106   5.174  -3.750   5.173
  395    H    GLN 107           HN       GLN 107  11.380  -2.303   1.467
  396    HA   GLN 107           HA       GLN 107   9.964  -4.625   0.469
  397    HB2  GLN 107           HB2      GLN 107  12.463  -3.414  -0.724
  398    HB3  GLN 107           HB1      GLN 107  11.252  -4.378  -1.542
  399    HG2  GLN 107           HG2      GLN 107   9.810  -2.206  -0.791
  400    HG3  GLN 107           HG1      GLN 107  11.389  -1.518  -1.012
  401   HE21  GLN 107          HE21      GLN 107   8.777  -3.146  -2.578
  402   HE22  GLN 107          HE22      GLN 107   9.270  -2.782  -4.207
  403    H    LEU 108           HN       LEU 108  12.715  -3.609   2.124
  404    HA   LEU 108           HA       LEU 108  14.336  -5.955   1.795
  405    HB2  LEU 108           HB2      LEU 108  14.511  -3.401   3.305
  406    HB3  LEU 108           HB1      LEU 108  15.611  -4.715   3.665
  407    HG   LEU 108           HG       LEU 108  16.854  -4.392   1.796
  408   HD11  LEU 108          HD11      LEU 108  15.048  -4.996   0.270
  409   HD12  LEU 108          HD12      LEU 108  15.994  -3.643  -0.354
  410   HD13  LEU 108          HD13      LEU 108  14.407  -3.356   0.372
  411   HD21  LEU 108          HD21      LEU 108  16.976  -2.007   1.224
  412   HD22  LEU 108          HD22      LEU 108  16.851  -2.271   2.965
  413   HD23  LEU 108          HD23      LEU 108  15.433  -1.746   2.048
  414    H    VAL 109           HN       VAL 109  11.804  -5.031   3.846
  415    HA   VAL 109           HA       VAL 109  12.673  -6.747   5.963
  416    HB   VAL 109           HB       VAL 109  10.547  -6.304   6.983
  417   HG11  VAL 109          HG11      VAL 109  11.510  -3.830   5.587
  418   HG12  VAL 109          HG12      VAL 109  12.187  -4.495   7.078
  419   HG13  VAL 109          HG13      VAL 109  10.535  -3.874   7.056
  420   HG21  VAL 109          HG21      VAL 109   9.132  -6.609   5.068
  421   HG22  VAL 109          HG22      VAL 109   9.784  -5.142   4.336
  422   HG23  VAL 109          HG23      VAL 109   8.800  -5.038   5.802
  423    H    HIS 110           HN       HIS 110  11.113  -6.971   2.951
  424    HA   HIS 110           HA       HIS 110   9.975  -9.612   3.497
  425    HB2  HIS 110           HB2      HIS 110  10.102  -7.876   1.044
  426    HB3  HIS 110           HB1      HIS 110   9.439  -9.489   1.018
  427    HD1  HIS 110           HD1      HIS 110   7.017  -9.753   1.892
  428    HD2  HIS 110           HD2      HIS 110   8.665  -5.987   2.370
  429    HE1  HIS 110           HE1      HIS 110   5.087  -8.188   2.383
  430    H    SER 111           HN       SER 111  12.937  -8.300   2.653
  431    HA   SER 111           HA       SER 111  13.985 -10.901   1.833
  432    HB2  SER 111           HB2      SER 111  15.324  -9.721   0.019
  433    HB3  SER 111           HB1      SER 111  13.596  -9.876  -0.297
  434    HG   SER 111           HG       SER 111  13.460  -7.783  -0.347
  435    H    GLY 112           HN       GLY 112  14.158  -9.618   4.283
  436    HA2  GLY 112           HA2      GLY 112  16.979  -9.027   4.570
  437    HA3  GLY 112           HA1      GLY 112  15.888  -7.660   4.833
  Start of MODEL    4
    1    H    LYS  58           HT1      LYS  58 -11.723 -11.412  -5.612
    2    HA   LYS  58           HA       LYS  58 -11.622 -11.224  -3.195
    3    HB2  LYS  58           HB2      LYS  58  -9.587 -11.802  -4.432
    4    HB3  LYS  58           HB1      LYS  58  -9.225 -10.096  -4.666
    5    HG2  LYS  58           HG2      LYS  58  -9.119  -9.873  -2.170
    6    HG3  LYS  58           HG1      LYS  58  -9.239 -11.629  -2.074
    7    HD2  LYS  58           HD2      LYS  58  -7.108 -10.269  -3.698
    8    HD3  LYS  58           HD1      LYS  58  -6.907 -10.571  -1.975
    9    HE2  LYS  58           HE2      LYS  58  -5.872 -12.385  -3.041
   10    HE3  LYS  58           HE1      LYS  58  -7.430 -13.001  -2.497
   11    HZ1  LYS  58           HZ1      LYS  58  -6.773 -13.647  -4.794
   12    HZ2  LYS  58           HZ2      LYS  58  -6.945 -12.022  -5.255
   13    HZ3  LYS  58           HZ3      LYS  58  -8.284 -12.891  -4.684
   14    HA   PRO  59           HA       PRO  59 -12.399  -7.058  -1.634
   15    HB2  PRO  59           HB2      PRO  59 -12.010  -8.519   0.911
   16    HB3  PRO  59           HB1      PRO  59 -13.350  -7.486   0.402
   17    HG2  PRO  59           HG2      PRO  59 -13.616 -10.142   0.538
   18    HG3  PRO  59           HG1      PRO  59 -14.412  -9.191  -0.730
   19    HD2  PRO  59           HD2      PRO  59 -11.950 -10.875  -0.891
   20    HD3  PRO  59           HD1      PRO  59 -13.247 -10.655  -2.072
   21    H    TYR  60           HN       TYR  60 -10.811  -5.760  -1.654
   22    HA   TYR  60           HA       TYR  60  -8.131  -6.573  -0.798
   23    HB2  TYR  60           HB2      TYR  60  -9.059  -4.140  -2.346
   24    HB3  TYR  60           HB1      TYR  60  -7.380  -4.535  -1.986
   25    HD1  TYR  60           HD2      TYR  60  -6.874  -7.148  -2.667
   26    HD2  TYR  60           HD1      TYR  60  -9.676  -4.539  -4.501
   27    HE1  TYR  60           HE2      TYR  60  -6.760  -8.481  -4.722
   28    HE2  TYR  60           HE1      TYR  60  -9.574  -5.863  -6.557
   29    HH   TYR  60           HH       TYR  60  -8.262  -8.943  -6.705
   30    H    GLY  61           HN       GLY  61  -7.916  -6.253   1.372
   31    HA2  GLY  61           HA2      GLY  61  -9.121  -3.800   2.437
   32    HA3  GLY  61           HA1      GLY  61  -9.032  -5.308   3.331
   33    H    CYS  62           HN       CYS  62  -8.162  -2.587   3.822
   34    HA   CYS  62           HA       CYS  62  -5.388  -2.278   3.799
   35    HB2  CYS  62           HB2      CYS  62  -7.536  -0.783   4.553
   36    HB3  CYS  62           HB1      CYS  62  -6.841  -1.181   6.116
   37    H    GLU  63           HN       GLU  63  -3.804  -3.120   5.010
   38    HA   GLU  63           HA       GLU  63  -4.351  -5.249   6.844
   39    HB2  GLU  63           HB2      GLU  63  -2.413  -5.178   5.283
   40    HB3  GLU  63           HB1      GLU  63  -1.737  -3.859   6.224
   41    HG2  GLU  63           HG2      GLU  63  -1.828  -5.477   8.205
   42    HG3  GLU  63           HG1      GLU  63  -2.067  -6.735   6.991
   43    H    GLU  64           HN       GLU  64  -4.076  -1.890   7.166
   44    HA   GLU  64           HA       GLU  64  -2.987  -1.960   9.862
   45    HB2  GLU  64           HB2      GLU  64  -3.545   0.630   9.467
   46    HB3  GLU  64           HB1      GLU  64  -2.065  -0.135   8.920
   47    HG2  GLU  64           HG2      GLU  64  -2.704  -0.127   6.724
   48    HG3  GLU  64           HG1      GLU  64  -4.428  -0.126   7.121
   49    H    CYS  65           HN       CYS  65  -6.057  -1.340   8.264
   50    HA   CYS  65           HA       CYS  65  -7.230  -0.706  10.877
   51    HB2  CYS  65           HB2      CYS  65  -8.717   0.905   9.503
   52    HB3  CYS  65           HB1      CYS  65  -7.069   1.410   9.869
   53    H    GLY  66           HN       GLY  66  -7.086  -2.737   8.389
   54    HA2  GLY  66           HA2      GLY  66  -8.260  -4.559   7.818
   55    HA3  GLY  66           HA1      GLY  66  -9.099  -4.350   9.347
   56    H    LYS  67           HN       LYS  67  -9.173  -2.169   6.571
   57    HA   LYS  67           HA       LYS  67 -12.061  -2.694   6.336
   58    HB2  LYS  67           HB2      LYS  67 -10.479  -0.215   5.610
   59    HB3  LYS  67           HB1      LYS  67 -12.203  -0.422   5.330
   60    HG2  LYS  67           HG2      LYS  67 -10.900  -0.519   8.042
   61    HG3  LYS  67           HG1      LYS  67 -11.666   0.910   7.344
   62    HD2  LYS  67           HD2      LYS  67 -13.798  -0.115   7.344
   63    HD3  LYS  67           HD1      LYS  67 -13.114  -1.708   7.671
   64    HE2  LYS  67           HE2      LYS  67 -12.917   0.615   9.574
   65    HE3  LYS  67           HE1      LYS  67 -14.210  -0.583   9.628
   66    HZ1  LYS  67           HZ1      LYS  67 -12.600  -2.306  10.027
   67    HZ2  LYS  67           HZ2      LYS  67 -12.393  -1.079  11.178
   68    HZ3  LYS  67           HZ3      LYS  67 -11.315  -1.211   9.878
   69    H    SER  68           HN       SER  68 -12.621  -3.858   4.611
   70    HA   SER  68           HA       SER  68 -10.741  -4.168   2.438
   71    HB2  SER  68           HB2      SER  68 -13.189  -5.528   1.906
   72    HB3  SER  68           HB1      SER  68 -11.603  -6.206   2.288
   73    HG   SER  68           HG       SER  68 -12.978  -6.905   3.859
   74    H    TYR  69           HN       TYR  69 -10.948  -3.539   0.409
   75    HA   TYR  69           HA       TYR  69 -13.402  -2.093  -0.352
   76    HB2  TYR  69           HB2      TYR  69 -10.519  -1.522  -0.986
   77    HB3  TYR  69           HB1      TYR  69 -11.800  -0.955  -2.047
   78    HD1  TYR  69           HD2      TYR  69 -10.452  -0.773   1.371
   79    HD2  TYR  69           HD1      TYR  69 -13.103   0.924  -1.469
   80    HE1  TYR  69           HE2      TYR  69 -10.775   1.154   2.854
   81    HE2  TYR  69           HE1      TYR  69 -13.434   2.862  -0.015
   82    HH   TYR  69           HH       TYR  69 -11.452   3.593   2.592
   83    H    ARG  70           HN       ARG  70 -14.284  -2.518  -2.317
   84    HA   ARG  70           HA       ARG  70 -13.837  -5.137  -3.300
   85    HB2  ARG  70           HB2      ARG  70 -15.444  -4.173  -5.203
   86    HB3  ARG  70           HB1      ARG  70 -16.029  -4.694  -3.629
   87    HG2  ARG  70           HG2      ARG  70 -15.984  -2.353  -2.877
   88    HG3  ARG  70           HG1      ARG  70 -15.450  -1.866  -4.488
   89    HD2  ARG  70           HD2      ARG  70 -17.500  -2.807  -5.440
   90    HD3  ARG  70           HD1      ARG  70 -18.029  -3.289  -3.830
   91    HE   ARG  70           HE       ARG  70 -17.597  -0.601  -3.623
   92   HH11  ARG  70          HH11      ARG  70 -19.564  -2.634  -5.693
   93   HH12  ARG  70          HH12      ARG  70 -20.780  -1.411  -5.947
   94   HH21  ARG  70          HH21      ARG  70 -19.205   0.990  -3.931
   95   HH22  ARG  70          HH22      ARG  70 -20.572   0.655  -4.952
   96    H    LEU  71           HN       LEU  71 -12.385  -2.150  -4.130
   97    HA   LEU  71           HA       LEU  71 -11.334  -3.419  -6.571
   98    HB2  LEU  71           HB2      LEU  71 -11.839  -0.463  -6.279
   99    HB3  LEU  71           HB1      LEU  71 -11.366  -1.333  -7.733
  100    HG   LEU  71           HG       LEU  71 -13.982  -1.720  -6.312
  101   HD11  LEU  71          HD11      LEU  71 -14.990  -0.450  -8.128
  102   HD12  LEU  71          HD12      LEU  71 -13.384  -0.094  -8.769
  103   HD13  LEU  71          HD13      LEU  71 -13.865   0.532  -7.192
  104   HD21  LEU  71          HD21      LEU  71 -14.653  -2.838  -8.371
  105   HD22  LEU  71          HD22      LEU  71 -13.295  -3.643  -7.590
  106   HD23  LEU  71          HD23      LEU  71 -13.024  -2.631  -9.009
  107    H    ILE  72           HN       ILE  72  -9.283  -2.484  -7.300
  108    HA   ILE  72           HA       ILE  72  -7.443  -2.388  -5.105
  109    HB   ILE  72           HB       ILE  72  -7.071  -2.238  -8.085
  110   HG12  ILE  72          HG12      ILE  72  -7.516  -4.409  -6.915
  111   HG13  ILE  72          HG11      ILE  72  -5.997  -4.364  -7.805
  112   HG21  ILE  72          HG21      ILE  72  -5.423  -0.724  -7.124
  113   HG22  ILE  72          HG22      ILE  72  -4.652  -2.189  -7.732
  114   HG23  ILE  72          HG23      ILE  72  -4.914  -1.985  -6.001
  115   HD11  ILE  72          HD11      ILE  72  -6.307  -3.993  -4.835
  116   HD12  ILE  72          HD12      ILE  72  -4.787  -3.977  -5.729
  117   HD13  ILE  72          HD13      ILE  72  -5.745  -5.457  -5.642
  118    H    SER  73           HN       SER  73  -8.330  -0.080  -7.685
  119    HA   SER  73           HA       SER  73  -6.781   2.037  -6.662
  120    HB2  SER  73           HB2      SER  73  -9.315   2.245  -8.302
  121    HB3  SER  73           HB1      SER  73  -8.050   3.465  -8.162
  122    HG   SER  73           HG       SER  73  -6.951   2.450  -9.631
  123    H    LEU  74           HN       LEU  74  -9.915   0.844  -5.882
  124    HA   LEU  74           HA       LEU  74 -10.931   2.864  -4.299
  125    HB2  LEU  74           HB2      LEU  74 -11.290   0.000  -4.700
  126    HB3  LEU  74           HB1      LEU  74 -11.604   0.490  -3.038
  127    HG   LEU  74           HG       LEU  74 -12.934   1.611  -5.492
  128   HD11  LEU  74          HD11      LEU  74 -13.934  -0.167  -3.269
  129   HD12  LEU  74          HD12      LEU  74 -13.753  -0.608  -4.974
  130   HD13  LEU  74          HD13      LEU  74 -14.952   0.596  -4.490
  131   HD21  LEU  74          HD21      LEU  74 -12.657   3.333  -3.959
  132   HD22  LEU  74          HD22      LEU  74 -12.970   2.273  -2.590
  133   HD23  LEU  74          HD23      LEU  74 -14.295   2.735  -3.670
  134    H    LEU  75           HN       LEU  75  -9.089   0.069  -3.283
  135    HA   LEU  75           HA       LEU  75  -8.744   0.989  -0.612
  136    HB2  LEU  75           HB2      LEU  75  -8.730  -1.316  -0.862
  137    HB3  LEU  75           HB1      LEU  75  -7.719  -1.253  -2.299
  138    HG   LEU  75           HG       LEU  75  -5.888  -0.414  -0.674
  139   HD11  LEU  75          HD11      LEU  75  -6.099  -1.289   1.584
  140   HD12  LEU  75          HD12      LEU  75  -7.750  -1.806   1.241
  141   HD13  LEU  75          HD13      LEU  75  -7.345  -0.088   1.250
  142   HD21  LEU  75          HD21      LEU  75  -5.284  -2.758  -0.260
  143   HD22  LEU  75          HD22      LEU  75  -5.823  -2.448  -1.917
  144   HD23  LEU  75          HD23      LEU  75  -6.912  -3.232  -0.764
  145    H    ASN  76           HN       ASN  76  -7.181   1.377  -3.599
  146    HA   ASN  76           HA       ASN  76  -4.587   2.130  -2.720
  147    HB2  ASN  76           HB2      ASN  76  -5.796   1.680  -5.147
  148    HB3  ASN  76           HB1      ASN  76  -5.593   3.432  -5.163
  149   HD21  ASN  76          HD21      ASN  76  -4.048   0.351  -5.200
  150   HD22  ASN  76          HD22      ASN  76  -2.451   0.912  -5.589
  151    H    LEU  77           HN       LEU  77  -7.602   3.823  -3.382
  152    HA   LEU  77           HA       LEU  77  -6.511   6.391  -2.729
  153    HB2  LEU  77           HB2      LEU  77  -9.079   5.265  -3.646
  154    HB3  LEU  77           HB1      LEU  77  -9.177   6.744  -2.716
  155    HG   LEU  77           HG       LEU  77  -9.090   6.942  -5.257
  156   HD11  LEU  77          HD11      LEU  77  -7.726   8.958  -5.121
  157   HD12  LEU  77          HD12      LEU  77  -7.071   8.403  -3.579
  158   HD13  LEU  77          HD13      LEU  77  -8.783   8.797  -3.718
  159   HD21  LEU  77          HD21      LEU  77  -7.284   5.335  -5.646
  160   HD22  LEU  77          HD22      LEU  77  -6.173   6.380  -4.761
  161   HD23  LEU  77          HD23      LEU  77  -6.887   6.934  -6.275
  162    H    HIS  78           HN       HIS  78  -8.078   3.798  -1.086
  163    HA   HIS  78           HA       HIS  78  -8.690   5.190   1.312
  164    HB2  HIS  78           HB2      HIS  78  -9.675   3.021   0.960
  165    HB3  HIS  78           HB1      HIS  78  -8.087   2.278   0.747
  166    HD1  HIS  78           HD1      HIS  78 -10.439   3.496   3.424
  167    HD2  HIS  78           HD2      HIS  78  -6.728   1.663   3.072
  168    HE1  HIS  78           HE1      HIS  78  -9.810   2.713   5.742
  169    H    LYS  79           HN       LYS  79  -5.864   3.494   0.080
  170    HA   LYS  79           HA       LYS  79  -4.308   3.821   2.460
  171    HB2  LYS  79           HB2      LYS  79  -4.048   2.162   0.413
  172    HB3  LYS  79           HB1      LYS  79  -3.065   3.463  -0.241
  173    HG2  LYS  79           HG2      LYS  79  -1.584   1.974   0.832
  174    HG3  LYS  79           HG1      LYS  79  -1.726   3.377   1.891
  175    HD2  LYS  79           HD2      LYS  79  -1.824   1.363   3.224
  176    HD3  LYS  79           HD1      LYS  79  -3.406   2.147   3.235
  177    HE2  LYS  79           HE2      LYS  79  -3.773  -0.192   2.947
  178    HE3  LYS  79           HE1      LYS  79  -4.100   0.588   1.403
  179    HZ1  LYS  79           HZ1      LYS  79  -1.661  -0.938   2.151
  180    HZ2  LYS  79           HZ2      LYS  79  -1.825  -0.058   0.710
  181    HZ3  LYS  79           HZ3      LYS  79  -2.834  -1.378   1.012
  182    H    LYS  80           HN       LYS  80  -4.678   5.477  -0.604
  183    HA   LYS  80           HA       LYS  80  -2.831   7.552  -0.225
  184    HB2  LYS  80           HB2      LYS  80  -3.883   7.029  -2.384
  185    HB3  LYS  80           HB1      LYS  80  -5.443   7.529  -1.756
  186    HG2  LYS  80           HG2      LYS  80  -4.776   9.796  -1.681
  187    HG3  LYS  80           HG1      LYS  80  -3.091   9.389  -1.962
  188    HD2  LYS  80           HD2      LYS  80  -5.313   8.858  -3.929
  189    HD3  LYS  80           HD1      LYS  80  -4.294  10.300  -3.960
  190    HE2  LYS  80           HE2      LYS  80  -2.328   8.973  -4.288
  191    HE3  LYS  80           HE1      LYS  80  -3.245   7.489  -4.066
  192    HZ1  LYS  80           HZ1      LYS  80  -4.420   7.891  -6.102
  193    HZ2  LYS  80           HZ2      LYS  80  -2.758   7.994  -6.416
  194    HZ3  LYS  80           HZ3      LYS  80  -3.686   9.407  -6.294
  195    H    ARG  81           HN       ARG  81  -6.078   7.033   0.975
  196    HA   ARG  81           HA       ARG  81  -6.572   9.661   1.875
  197    HB2  ARG  81           HB2      ARG  81  -8.278   7.833   1.646
  198    HB3  ARG  81           HB1      ARG  81  -7.611   7.105   3.101
  199    HG2  ARG  81           HG2      ARG  81  -9.603   8.390   3.612
  200    HG3  ARG  81           HG1      ARG  81  -8.180   9.115   4.368
  201    HD2  ARG  81           HD2      ARG  81  -9.597  10.829   3.367
  202    HD3  ARG  81           HD1      ARG  81  -8.039  10.741   2.544
  203    HE   ARG  81           HE       ARG  81 -10.301   9.271   1.400
  204   HH11  ARG  81          HH11      ARG  81  -8.010  11.906   1.193
  205   HH12  ARG  81          HH12      ARG  81  -8.443  12.328  -0.432
  206   HH21  ARG  81          HH21      ARG  81 -10.833   9.767  -0.737
  207   HH22  ARG  81          HH22      ARG  81 -10.050  11.089  -1.552
  208    H    HIS  82           HN       HIS  82  -5.059   6.862   3.453
  209    HA   HIS  82           HA       HIS  82  -4.788   8.164   5.984
  210    HB2  HIS  82           HB2      HIS  82  -3.555   5.662   4.852
  211    HB3  HIS  82           HB1      HIS  82  -3.213   6.241   6.460
  212    HD1  HIS  82           HD1      HIS  82  -5.056   5.878   8.256
  213    HD2  HIS  82           HD2      HIS  82  -6.001   4.548   4.442
  214    HE1  HIS  82           HE1      HIS  82  -7.005   4.290   8.516
  215    H    SER  83           HN       SER  83  -2.526   7.407   3.338
  216    HA   SER  83           HA       SER  83  -0.349   8.618   4.816
  217    HB2  SER  83           HB2      SER  83  -0.368   7.327   2.082
  218    HB3  SER  83           HB1      SER  83   1.068   7.779   3.002
  219    HG   SER  83           HG       SER  83  -0.038   6.335   4.691
  220    H    GLY  84           HN       GLY  84  -2.699  10.088   3.318
  221    HA2  GLY  84           HA2      GLY  84  -2.796  12.297   2.565
  222    HA3  GLY  84           HA1      GLY  84  -1.038  12.308   2.457
  223    H    GLU  85           HN       GLU  85  -0.291  10.518   0.773
  224    HA   GLU  85           HA       GLU  85  -2.111  10.422  -1.501
  225    HB2  GLU  85           HB2      GLU  85  -0.256  10.807  -3.029
  226    HB3  GLU  85           HB1      GLU  85  -0.402  12.164  -1.922
  227    HG2  GLU  85           HG2      GLU  85   1.424  10.004  -1.112
  228    HG3  GLU  85           HG1      GLU  85   1.910  10.967  -2.501
  229    H    ALA  86           HN       ALA  86  -0.962   8.814  -3.121
  230    HA   ALA  86           HA       ALA  86   0.317   6.602  -1.708
  231    HB1  ALA  86           HB1      ALA  86  -1.148   4.944  -2.700
  232    HB2  ALA  86           HB2      ALA  86  -2.073   6.208  -3.507
  233    HB3  ALA  86           HB3      ALA  86  -2.098   6.083  -1.748
  234    H    ARG  87           HN       ARG  87   2.182   6.451  -2.735
  235    HA   ARG  87           HA       ARG  87   2.264   7.190  -5.554
  236    HB2  ARG  87           HB2      ARG  87   4.616   6.885  -3.710
  237    HB3  ARG  87           HB1      ARG  87   4.533   7.781  -5.221
  238    HG2  ARG  87           HG2      ARG  87   2.864   8.490  -2.841
  239    HG3  ARG  87           HG1      ARG  87   4.522   9.059  -3.041
  240    HD2  ARG  87           HD2      ARG  87   2.352   9.460  -5.091
  241    HD3  ARG  87           HD1      ARG  87   2.716  10.637  -3.829
  242    HE   ARG  87           HE       ARG  87   5.074   9.988  -5.250
  243   HH11  ARG  87          HH11      ARG  87   2.068  11.754  -5.615
  244   HH12  ARG  87          HH12      ARG  87   2.723  12.890  -6.752
  245   HH21  ARG  87          HH21      ARG  87   5.938  11.487  -6.736
  246   HH22  ARG  87          HH22      ARG  87   4.926  12.748  -7.385
  247    H    TYR  88           HN       TYR  88   4.488   5.192  -3.766
  248    HA   TYR  88           HA       TYR  88   4.383   3.171  -5.864
  249    HB2  TYR  88           HB2      TYR  88   6.192   3.430  -3.453
  250    HB3  TYR  88           HB1      TYR  88   6.362   2.261  -4.752
  251    HD1  TYR  88           HD1      TYR  88   6.277   5.931  -4.141
  252    HD2  TYR  88           HD2      TYR  88   7.708   2.747  -6.556
  253    HE1  TYR  88           HE1      TYR  88   7.717   7.506  -5.360
  254    HE2  TYR  88           HE2      TYR  88   9.146   4.294  -7.774
  255    HH   TYR  88           HH       TYR  88   9.906   7.332  -6.678
  256    H    ARG  89           HN       ARG  89   3.931   0.970  -5.400
  257    HA   ARG  89           HA       ARG  89   3.220   0.430  -2.611
  258    HB2  ARG  89           HB2      ARG  89   1.543  -1.087  -3.178
  259    HB3  ARG  89           HB1      ARG  89   1.253   0.271  -4.246
  260    HG2  ARG  89           HG2      ARG  89   2.392  -0.958  -6.061
  261    HG3  ARG  89           HG1      ARG  89   2.557  -2.337  -4.965
  262    HD2  ARG  89           HD2      ARG  89   0.065  -2.214  -4.638
  263    HD3  ARG  89           HD1      ARG  89   0.041  -1.071  -5.979
  264    HE   ARG  89           HE       ARG  89   1.040  -3.837  -6.266
  265   HH11  ARG  89          HH11      ARG  89  -0.838  -1.106  -7.383
  266   HH12  ARG  89          HH12      ARG  89  -1.407  -1.916  -8.817
  267   HH21  ARG  89          HH21      ARG  89   0.272  -4.922  -8.119
  268   HH22  ARG  89          HH22      ARG  89  -0.789  -4.103  -9.222
  269    H    CYS  90           HN       CYS  90   3.807  -1.546  -1.863
  270    HA   CYS  90           HA       CYS  90   6.199  -2.694  -2.824
  271    HB2  CYS  90           HB2      CYS  90   5.267  -2.771  -0.482
  272    HB3  CYS  90           HB1      CYS  90   4.115  -3.952  -1.050
  273    H    GLU  91           HN       GLU  91   6.373  -3.872  -4.627
  274    HA   GLU  91           HA       GLU  91   4.268  -4.881  -6.142
  275    HB2  GLU  91           HB2      GLU  91   5.977  -6.052  -7.434
  276    HB3  GLU  91           HB1      GLU  91   6.496  -4.412  -7.044
  277    HG2  GLU  91           HG2      GLU  91   7.909  -5.189  -5.309
  278    HG3  GLU  91           HG1      GLU  91   7.263  -6.811  -5.468
  279    H    ASP  92           HN       ASP  92   5.106  -5.982  -3.190
  280    HA   ASP  92           HA       ASP  92   4.575  -8.777  -3.900
  281    HB2  ASP  92           HB2      ASP  92   6.297  -9.396  -2.614
  282    HB3  ASP  92           HB1      ASP  92   6.725  -7.693  -2.485
  283    H    CYS  93           HN       CYS  93   3.790  -6.166  -1.556
  284    HA   CYS  93           HA       CYS  93   1.594  -7.889  -0.706
  285    HB2  CYS  93           HB2      CYS  93   2.081  -7.607   1.578
  286    HB3  CYS  93           HB1      CYS  93   3.629  -7.930   0.825
  287    H    GLY  94           HN       GLY  94   2.518  -4.969  -1.908
  288    HA2  GLY  94           HA2      GLY  94   1.215  -3.352  -2.774
  289    HA3  GLY  94           HA1      GLY  94  -0.194  -4.164  -2.118
  290    H    LYS  95           HN       LYS  95   2.564  -2.907  -0.321
  291    HA   LYS  95           HA       LYS  95   0.786  -1.137   1.133
  292    HB2  LYS  95           HB2      LYS  95   3.726  -1.697   1.496
  293    HB3  LYS  95           HB1      LYS  95   2.697  -0.790   2.604
  294    HG2  LYS  95           HG2      LYS  95   1.290  -2.947   2.619
  295    HG3  LYS  95           HG1      LYS  95   2.757  -3.698   2.002
  296    HD2  LYS  95           HD2      LYS  95   3.964  -3.239   3.890
  297    HD3  LYS  95           HD1      LYS  95   2.886  -1.939   4.407
  298    HE2  LYS  95           HE2      LYS  95   1.120  -3.639   4.790
  299    HE3  LYS  95           HE1      LYS  95   2.294  -4.896   4.410
  300    HZ1  LYS  95           HZ1      LYS  95   3.575  -4.327   6.309
  301    HZ2  LYS  95           HZ2      LYS  95   1.962  -4.471   6.822
  302    HZ3  LYS  95           HZ3      LYS  95   2.653  -2.938   6.608
  303    H    LEU  96           HN       LEU  96   0.791   1.051   0.869
  304    HA   LEU  96           HA       LEU  96   2.223   1.981  -1.479
  305    HB2  LEU  96           HB2      LEU  96  -0.091   3.075   0.079
  306    HB3  LEU  96           HB1      LEU  96   0.746   4.045  -1.125
  307    HG   LEU  96           HG       LEU  96  -1.252   3.112  -2.097
  308   HD11  LEU  96          HD11      LEU  96   0.683   3.291  -3.549
  309   HD12  LEU  96          HD12      LEU  96  -0.299   1.890  -3.985
  310   HD13  LEU  96          HD13      LEU  96   1.200   1.670  -3.077
  311   HD21  LEU  96          HD21      LEU  96  -0.153   0.415  -1.329
  312   HD22  LEU  96          HD22      LEU  96  -1.592   0.700  -2.313
  313   HD23  LEU  96          HD23      LEU  96  -1.565   1.202  -0.620
  314    H    PHE  97           HN       PHE  97   4.009   3.059  -1.340
  315    HA   PHE  97           HA       PHE  97   4.524   4.624   1.107
  316    HB2  PHE  97           HB2      PHE  97   6.559   3.324  -0.718
  317    HB3  PHE  97           HB1      PHE  97   6.928   4.322   0.678
  318    HD1  PHE  97           HD2      PHE  97   5.561   1.078  -0.401
  319    HD2  PHE  97           HD1      PHE  97   6.748   3.487   2.901
  320    HE1  PHE  97           HE2      PHE  97   5.426  -0.887   1.086
  321    HE2  PHE  97           HE1      PHE  97   6.620   1.524   4.382
  322    HZ   PHE  97           HZ       PHE  97   5.966  -0.662   3.468
  323    H    THR  98           HN       THR  98   5.044   6.679   0.915
  324    HA   THR  98           HA       THR  98   4.612   7.907  -1.665
  325    HB   THR  98           HB       THR  98   4.580   9.994  -0.383
  326    HG1  THR  98           HG1      THR  98   5.865   9.930   1.337
  327   HG21  THR  98          HG21      THR  98   2.673   9.394   1.085
  328   HG22  THR  98          HG22      THR  98   3.102   7.687   0.889
  329   HG23  THR  98          HG23      THR  98   2.569   8.631  -0.505
  330    H    THR  99           HN       THR  99   7.153   6.630  -0.065
  331    HA   THR  99           HA       THR  99   9.047   8.147  -1.695
  332    HB   THR  99           HB       THR  99   9.353   7.300   1.192
  333    HG1  THR  99           HG1      THR  99   9.506   9.441   1.583
  334   HG21  THR  99          HG21      THR  99  11.666   8.011   1.063
  335   HG22  THR  99          HG22      THR  99  11.476   8.362  -0.657
  336   HG23  THR  99          HG23      THR  99  11.349   6.703  -0.073
  337    H    SER 100           HN       SER 100  10.251   6.832  -2.935
  338    HA   SER 100           HA       SER 100   9.705   4.082  -3.093
  339    HB2  SER 100           HB2      SER 100  11.551   4.139  -4.819
  340    HB3  SER 100           HB1      SER 100  10.234   5.287  -5.089
  341    HG   SER 100           HG       SER 100  12.180   6.361  -5.342
  342    H    GLY 101           HN       GLY 101  12.129   5.944  -1.446
  343    HA2  GLY 101           HA2      GLY 101  13.905   3.788  -0.890
  344    HA3  GLY 101           HA1      GLY 101  13.830   5.309  -0.030
  345    H    ASN 102           HN       ASN 102  11.311   5.320   1.046
  346    HA   ASN 102           HA       ASN 102  11.354   3.590   3.236
  347    HB2  ASN 102           HB2      ASN 102   9.005   4.889   1.842
  348    HB3  ASN 102           HB1      ASN 102   8.864   4.006   3.348
  349   HD21  ASN 102          HD21      ASN 102  11.407   4.990   4.386
  350   HD22  ASN 102          HD22      ASN 102  11.121   6.631   4.840
  351    H    LEU 103           HN       LEU 103   9.993   3.368   0.055
  352    HA   LEU 103           HA       LEU 103   8.536   1.011   0.436
  353    HB2  LEU 103           HB2      LEU 103   8.001   2.368  -1.400
  354    HB3  LEU 103           HB1      LEU 103   9.683   2.471  -1.913
  355    HG   LEU 103           HG       LEU 103   9.558   0.017  -2.452
  356   HD11  LEU 103          HD11      LEU 103   6.587   0.433  -2.364
  357   HD12  LEU 103          HD12      LEU 103   7.489  -0.256  -0.999
  358   HD13  LEU 103          HD13      LEU 103   7.502  -1.080  -2.562
  359   HD21  LEU 103          HD21      LEU 103   9.528   1.625  -4.167
  360   HD22  LEU 103          HD22      LEU 103   7.860   2.056  -3.813
  361   HD23  LEU 103          HD23      LEU 103   8.230   0.478  -4.525
  362    H    LYS 104           HN       LYS 104  11.653   1.728  -0.985
  363    HA   LYS 104           HA       LYS 104  12.515  -0.731  -1.784
  364    HB2  LYS 104           HB2      LYS 104  13.570   1.370  -2.346
  365    HB3  LYS 104           HB1      LYS 104  14.073   1.593  -0.679
  366    HG2  LYS 104           HG2      LYS 104  15.553  -0.286  -0.817
  367    HG3  LYS 104           HG1      LYS 104  14.982  -0.658  -2.450
  368    HD2  LYS 104           HD2      LYS 104  16.269   1.953  -1.690
  369    HD3  LYS 104           HD1      LYS 104  17.170   0.576  -2.336
  370    HE2  LYS 104           HE2      LYS 104  15.788   0.624  -4.355
  371    HE3  LYS 104           HE1      LYS 104  14.878   1.986  -3.701
  372    HZ1  LYS 104           HZ1      LYS 104  16.610   2.640  -5.299
  373    HZ2  LYS 104           HZ2      LYS 104  17.797   2.030  -4.250
  374    HZ3  LYS 104           HZ3      LYS 104  16.833   3.339  -3.769
  375    H    ARG 105           HN       ARG 105  13.101   0.780   1.422
  376    HA   ARG 105           HA       ARG 105  14.583  -1.468   2.321
  377    HB2  ARG 105           HB2      ARG 105  14.482  -0.519   4.521
  378    HB3  ARG 105           HB1      ARG 105  14.777   0.762   3.357
  379    HG2  ARG 105           HG2      ARG 105  12.437   1.424   3.480
  380    HG3  ARG 105           HG1      ARG 105  12.136   0.126   4.647
  381    HD2  ARG 105           HD2      ARG 105  13.848   1.130   6.122
  382    HD3  ARG 105           HD1      ARG 105  13.991   2.473   4.989
  383    HE   ARG 105           HE       ARG 105  11.296   2.022   5.887
  384   HH11  ARG 105          HH11      ARG 105  14.337   3.597   6.638
  385   HH12  ARG 105          HH12      ARG 105  13.611   4.785   7.673
  386   HH21  ARG 105          HH21      ARG 105  10.331   3.597   7.238
  387   HH22  ARG 105          HH22      ARG 105  11.338   4.776   8.032
  388    H    HIS 106           HN       HIS 106  11.201  -0.718   2.195
  389    HA   HIS 106           HA       HIS 106  10.391  -2.945   3.826
  390    HB2  HIS 106           HB2      HIS 106   8.919  -1.011   3.649
  391    HB3  HIS 106           HB1      HIS 106   8.843  -1.198   1.896
  392    HD1  HIS 106           HD1      HIS 106   7.531  -2.750   5.081
  393    HD2  HIS 106           HD2      HIS 106   7.137  -3.074   0.970
  394    HE1  HIS 106           HE1      HIS 106   5.567  -4.288   4.686
  395    H    GLN 107           HN       GLN 107  11.486  -2.579   0.648
  396    HA   GLN 107           HA       GLN 107  10.059  -4.836  -0.464
  397    HB2  GLN 107           HB2      GLN 107  12.442  -3.328  -1.583
  398    HB3  GLN 107           HB1      GLN 107  11.400  -4.422  -2.471
  399    HG2  GLN 107           HG2      GLN 107   9.923  -2.240  -1.323
  400    HG3  GLN 107           HG1      GLN 107  11.250  -1.686  -2.328
  401   HE21  GLN 107          HE21      GLN 107   8.227  -3.348  -2.295
  402   HE22  GLN 107          HE22      GLN 107   8.025  -3.398  -4.023
  403    H    LEU 108           HN       LEU 108  12.859  -3.891   1.141
  404    HA   LEU 108           HA       LEU 108  14.515  -6.160   0.559
  405    HB2  LEU 108           HB2      LEU 108  14.727  -3.717   2.248
  406    HB3  LEU 108           HB1      LEU 108  15.862  -5.037   2.463
  407    HG   LEU 108           HG       LEU 108  17.036  -4.524   0.613
  408   HD11  LEU 108          HD11      LEU 108  14.493  -3.590  -0.711
  409   HD12  LEU 108          HD12      LEU 108  15.271  -5.161  -0.923
  410   HD13  LEU 108          HD13      LEU 108  16.080  -3.694  -1.481
  411   HD21  LEU 108          HD21      LEU 108  15.522  -1.932   0.832
  412   HD22  LEU 108          HD22      LEU 108  17.169  -2.167   0.237
  413   HD23  LEU 108          HD23      LEU 108  16.797  -2.437   1.942
  414    H    VAL 109           HN       VAL 109  12.170  -5.320   2.931
  415    HA   VAL 109           HA       VAL 109  13.157  -7.150   4.871
  416    HB   VAL 109           HB       VAL 109  11.089  -6.793   6.026
  417   HG11  VAL 109          HG11      VAL 109  10.961  -4.369   6.122
  418   HG12  VAL 109          HG12      VAL 109  11.828  -4.263   4.590
  419   HG13  VAL 109          HG13      VAL 109  12.642  -4.900   6.025
  420   HG21  VAL 109          HG21      VAL 109   9.568  -7.147   4.199
  421   HG22  VAL 109          HG22      VAL 109  10.113  -5.650   3.439
  422   HG23  VAL 109          HG23      VAL 109   9.218  -5.593   4.962
  423    H    HIS 110           HN       HIS 110  11.385  -7.331   1.949
  424    HA   HIS 110           HA       HIS 110  10.440 -10.045   2.553
  425    HB2  HIS 110           HB2      HIS 110  10.090  -8.285   0.138
  426    HB3  HIS 110           HB1      HIS 110   9.406  -9.882   0.292
  427    HD1  HIS 110           HD1      HIS 110   7.324 -10.090   1.929
  428    HD2  HIS 110           HD2      HIS 110   8.882  -6.301   1.382
  429    HE1  HIS 110           HE1      HIS 110   5.511  -8.462   2.633
  430    H    SER 111           HN       SER 111  13.252  -8.692   1.580
  431    HA   SER 111           HA       SER 111  14.213 -11.168   0.410
  432    HB2  SER 111           HB2      SER 111  14.485  -8.535  -1.074
  433    HB3  SER 111           HB1      SER 111  15.168 -10.084  -1.571
  434    HG   SER 111           HG       SER 111  12.520 -10.325  -1.108
  435    H    GLY 112           HN       GLY 112  14.645  -9.971   2.870
  436    HA2  GLY 112           HA2      GLY 112  17.453  -9.133   2.731
  437    HA3  GLY 112           HA1      GLY 112  16.273  -8.056   3.490
  Start of MODEL    5
    1    H    LYS  58           HT1      LYS  58 -18.617  -7.849  -5.324
    2    HA   LYS  58           HA       LYS  58 -18.129  -9.190  -2.734
    3    HB2  LYS  58           HB2      LYS  58 -16.363  -8.574  -5.097
    4    HB3  LYS  58           HB1      LYS  58 -15.702  -8.849  -3.492
    5    HG2  LYS  58           HG2      LYS  58 -16.653 -11.082  -3.461
    6    HG3  LYS  58           HG1      LYS  58 -17.385 -10.804  -5.044
    7    HD2  LYS  58           HD2      LYS  58 -15.217 -10.599  -6.068
    8    HD3  LYS  58           HD1      LYS  58 -14.421 -10.681  -4.497
    9    HE2  LYS  58           HE2      LYS  58 -16.084 -12.885  -5.707
   10    HE3  LYS  58           HE1      LYS  58 -14.324 -12.807  -5.758
   11    HZ1  LYS  58           HZ1      LYS  58 -15.046 -14.225  -3.968
   12    HZ2  LYS  58           HZ2      LYS  58 -16.001 -12.989  -3.313
   13    HZ3  LYS  58           HZ3      LYS  58 -14.313 -12.838  -3.323
   14    HA   PRO  59           HA       PRO  59 -17.618  -4.927  -1.373
   15    HB2  PRO  59           HB2      PRO  59 -17.243  -6.177   1.238
   16    HB3  PRO  59           HB1      PRO  59 -18.505  -5.056   0.719
   17    HG2  PRO  59           HG2      PRO  59 -18.987  -7.668   1.268
   18    HG3  PRO  59           HG1      PRO  59 -19.920  -6.746   0.075
   19    HD2  PRO  59           HD2      PRO  59 -17.696  -8.700  -0.362
   20    HD3  PRO  59           HD1      PRO  59 -19.186  -8.458  -1.281
   21    H    TYR  60           HN       TYR  60 -15.709  -4.128  -1.698
   22    HA   TYR  60           HA       TYR  60 -13.324  -5.750  -1.326
   23    HB2  TYR  60           HB2      TYR  60 -13.629  -2.996  -2.547
   24    HB3  TYR  60           HB1      TYR  60 -12.170  -3.987  -2.572
   25    HD1  TYR  60           HD2      TYR  60 -12.796  -6.521  -3.463
   26    HD2  TYR  60           HD1      TYR  60 -14.684  -2.877  -4.567
   27    HE1  TYR  60           HE2      TYR  60 -13.474  -7.525  -5.590
   28    HE2  TYR  60           HE1      TYR  60 -15.365  -3.876  -6.700
   29    HH   TYR  60           HH       TYR  60 -14.716  -5.676  -8.183
   30    H    GLY  61           HN       GLY  61 -12.869  -5.752   0.838
   31    HA2  GLY  61           HA2      GLY  61 -12.866  -3.143   2.170
   32    HA3  GLY  61           HA1      GLY  61 -13.148  -4.677   2.975
   33    H    CYS  62           HN       CYS  62 -11.310  -2.467   3.364
   34    HA   CYS  62           HA       CYS  62  -8.651  -3.131   2.843
   35    HB2  CYS  62           HB2      CYS  62  -9.564  -0.949   3.748
   36    HB3  CYS  62           HB1      CYS  62  -9.703  -1.740   5.313
   37    H    GLU  63           HN       GLU  63  -7.491  -4.802   3.516
   38    HA   GLU  63           HA       GLU  63  -8.393  -6.674   5.445
   39    HB2  GLU  63           HB2      GLU  63  -5.519  -6.388   4.599
   40    HB3  GLU  63           HB1      GLU  63  -6.392  -7.846   5.030
   41    HG2  GLU  63           HG2      GLU  63  -6.332  -8.125   2.790
   42    HG3  GLU  63           HG1      GLU  63  -7.812  -7.173   2.895
   43    H    GLU  64           HN       GLU  64  -6.817  -3.717   5.702
   44    HA   GLU  64           HA       GLU  64  -5.223  -4.298   8.010
   45    HB2  GLU  64           HB2      GLU  64  -4.156  -2.715   6.780
   46    HB3  GLU  64           HB1      GLU  64  -5.650  -2.054   6.136
   47    HG2  GLU  64           HG2      GLU  64  -5.985  -1.154   8.531
   48    HG3  GLU  64           HG1      GLU  64  -4.240  -1.411   8.680
   49    H    CYS  65           HN       CYS  65  -8.238  -2.487   7.347
   50    HA   CYS  65           HA       CYS  65  -8.435  -2.034  10.233
   51    HB2  CYS  65           HB2      CYS  65  -9.570   0.158   9.580
   52    HB3  CYS  65           HB1      CYS  65  -7.829   0.065   9.318
   53    H    GLY  66           HN       GLY  66  -9.955  -2.876   7.267
   54    HA2  GLY  66           HA2      GLY  66 -11.566  -4.521   7.181
   55    HA3  GLY  66           HA1      GLY  66 -11.994  -4.169   8.850
   56    H    LYS  67           HN       LYS  67 -11.797  -1.866   6.176
   57    HA   LYS  67           HA       LYS  67 -14.701  -1.436   6.428
   58    HB2  LYS  67           HB2      LYS  67 -12.636   0.466   5.300
   59    HB3  LYS  67           HB1      LYS  67 -14.337   0.810   5.580
   60    HG2  LYS  67           HG2      LYS  67 -13.976   0.498   7.995
   61    HG3  LYS  67           HG1      LYS  67 -12.255   0.256   7.680
   62    HD2  LYS  67           HD2      LYS  67 -12.154   2.505   6.673
   63    HD3  LYS  67           HD1      LYS  67 -13.859   2.735   7.068
   64    HE2  LYS  67           HE2      LYS  67 -11.636   2.245   9.049
   65    HE3  LYS  67           HE1      LYS  67 -12.395   3.800   8.716
   66    HZ1  LYS  67           HZ1      LYS  67 -13.270   2.713  10.714
   67    HZ2  LYS  67           HZ2      LYS  67 -13.822   1.420   9.775
   68    HZ3  LYS  67           HZ3      LYS  67 -14.477   2.967   9.549
   69    H    SER  68           HN       SER  68 -15.909  -2.159   4.762
   70    HA   SER  68           HA       SER  68 -14.542  -3.010   2.349
   71    HB2  SER  68           HB2      SER  68 -17.382  -3.420   2.211
   72    HB3  SER  68           HB1      SER  68 -16.086  -4.620   2.283
   73    HG   SER  68           HG       SER  68 -17.370  -3.330   4.475
   74    H    TYR  69           HN       TYR  69 -14.679  -2.112   0.416
   75    HA   TYR  69           HA       TYR  69 -16.398   0.264   0.140
   76    HB2  TYR  69           HB2      TYR  69 -13.674  -0.375  -0.938
   77    HB3  TYR  69           HB1      TYR  69 -14.693   0.802  -1.752
   78    HD1  TYR  69           HD2      TYR  69 -13.087  -0.018   1.475
   79    HD2  TYR  69           HD1      TYR  69 -14.879   2.968  -0.946
   80    HE1  TYR  69           HE2      TYR  69 -12.343   1.691   3.060
   81    HE2  TYR  69           HE1      TYR  69 -14.144   4.705   0.629
   82    HH   TYR  69           HH       TYR  69 -13.547   4.848   3.058
   83    H    ARG  70           HN       ARG  70 -17.132   0.754  -2.045
   84    HA   ARG  70           HA       ARG  70 -18.340  -1.556  -3.249
   85    HB2  ARG  70           HB2      ARG  70 -19.594   0.530  -3.003
   86    HB3  ARG  70           HB1      ARG  70 -18.419   1.374  -4.001
   87    HG2  ARG  70           HG2      ARG  70 -20.421   0.922  -5.262
   88    HG3  ARG  70           HG1      ARG  70 -19.067   0.007  -5.922
   89    HD2  ARG  70           HD2      ARG  70 -20.962  -1.218  -3.941
   90    HD3  ARG  70           HD1      ARG  70 -21.347  -1.165  -5.660
   91    HE   ARG  70           HE       ARG  70 -18.754  -2.277  -5.099
   92   HH11  ARG  70          HH11      ARG  70 -22.163  -2.953  -5.413
   93   HH12  ARG  70          HH12      ARG  70 -21.938  -4.646  -5.730
   94   HH21  ARG  70          HH21      ARG  70 -18.434  -4.498  -5.498
   95   HH22  ARG  70          HH22      ARG  70 -19.798  -5.527  -5.788
   96    H    LEU  71           HN       LEU  71 -15.901   0.837  -4.170
   97    HA   LEU  71           HA       LEU  71 -15.389  -0.663  -6.628
   98    HB2  LEU  71           HB2      LEU  71 -14.934   2.155  -5.746
   99    HB3  LEU  71           HB1      LEU  71 -13.910   1.476  -6.999
  100    HG   LEU  71           HG       LEU  71 -15.718   1.211  -8.484
  101   HD11  LEU  71          HD11      LEU  71 -17.367   0.346  -6.896
  102   HD12  LEU  71          HD12      LEU  71 -18.035   1.599  -7.944
  103   HD13  LEU  71          HD13      LEU  71 -17.601   1.981  -6.277
  104   HD21  LEU  71          HD21      LEU  71 -16.595   3.470  -8.687
  105   HD22  LEU  71          HD22      LEU  71 -14.881   3.493  -8.269
  106   HD23  LEU  71          HD23      LEU  71 -16.098   3.811  -7.029
  107    H    ILE  72           HN       ILE  72 -13.379  -1.394  -7.144
  108    HA   ILE  72           HA       ILE  72 -11.517  -2.020  -5.124
  109    HB   ILE  72           HB       ILE  72 -11.397  -2.009  -8.125
  110   HG12  ILE  72          HG12      ILE  72 -12.498  -3.834  -6.817
  111   HG13  ILE  72          HG11      ILE  72 -11.188  -4.388  -7.849
  112   HG21  ILE  72          HG21      ILE  72  -9.126  -2.899  -8.060
  113   HG22  ILE  72          HG22      ILE  72  -9.065  -2.623  -6.321
  114   HG23  ILE  72          HG23      ILE  72  -9.187  -1.253  -7.425
  115   HD11  ILE  72          HD11      ILE  72 -11.097  -5.495  -5.709
  116   HD12  ILE  72          HD12      ILE  72 -11.064  -3.941  -4.874
  117   HD13  ILE  72          HD13      ILE  72  -9.704  -4.431  -5.886
  118    H    SER  73           HN       SER  73 -11.588   0.561  -7.558
  119    HA   SER  73           HA       SER  73  -9.225   1.855  -6.824
  120    HB2  SER  73           HB2      SER  73 -11.611   3.409  -7.750
  121    HB3  SER  73           HB1      SER  73  -9.922   3.561  -8.241
  122    HG   SER  73           HG       SER  73 -10.270   2.164  -9.772
  123    H    LEU  74           HN       LEU  74 -12.513   2.169  -5.617
  124    HA   LEU  74           HA       LEU  74 -12.222   4.311  -3.914
  125    HB2  LEU  74           HB2      LEU  74 -14.135   2.318  -4.513
  126    HB3  LEU  74           HB1      LEU  74 -13.902   2.283  -2.770
  127    HG   LEU  74           HG       LEU  74 -14.751   4.639  -4.433
  128   HD11  LEU  74          HD11      LEU  74 -16.774   4.515  -3.070
  129   HD12  LEU  74          HD12      LEU  74 -16.135   3.089  -2.248
  130   HD13  LEU  74          HD13      LEU  74 -16.519   3.018  -3.969
  131   HD21  LEU  74          HD21      LEU  74 -14.830   5.776  -2.232
  132   HD22  LEU  74          HD22      LEU  74 -13.207   5.353  -2.793
  133   HD23  LEU  74          HD23      LEU  74 -13.988   4.373  -1.559
  134    H    LEU  75           HN       LEU  75 -11.811   0.903  -3.278
  135    HA   LEU  75           HA       LEU  75 -11.017   1.210  -0.576
  136    HB2  LEU  75           HB2      LEU  75 -11.858  -0.869  -1.032
  137    HB3  LEU  75           HB1      LEU  75 -11.089  -0.948  -2.615
  138    HG   LEU  75           HG       LEU  75  -8.895  -1.190  -1.352
  139   HD11  LEU  75          HD11      LEU  75  -9.512  -0.507   0.830
  140   HD12  LEU  75          HD12      LEU  75  -9.169  -2.238   0.899
  141   HD13  LEU  75          HD13      LEU  75 -10.841  -1.670   0.888
  142   HD21  LEU  75          HD21      LEU  75 -11.024  -3.304  -1.249
  143   HD22  LEU  75          HD22      LEU  75  -9.283  -3.597  -1.104
  144   HD23  LEU  75          HD23      LEU  75  -9.950  -2.932  -2.602
  145    H    ASN  76           HN       ASN  76  -9.431   1.208  -3.647
  146    HA   ASN  76           HA       ASN  76  -6.781   0.779  -2.663
  147    HB2  ASN  76           HB2      ASN  76  -8.012   1.577  -5.250
  148    HB3  ASN  76           HB1      ASN  76  -6.311   1.966  -5.012
  149   HD21  ASN  76          HD21      ASN  76  -7.411   0.191  -6.939
  150   HD22  ASN  76          HD22      ASN  76  -6.795  -1.400  -6.596
  151    H    LEU  77           HN       LEU  77  -8.836   3.529  -3.295
  152    HA   LEU  77           HA       LEU  77  -6.780   5.448  -2.776
  153    HB2  LEU  77           HB2      LEU  77  -9.678   5.446  -3.433
  154    HB3  LEU  77           HB1      LEU  77  -9.018   6.876  -2.672
  155    HG   LEU  77           HG       LEU  77  -9.170   6.685  -5.279
  156   HD11  LEU  77          HD11      LEU  77  -6.775   7.701  -3.778
  157   HD12  LEU  77          HD12      LEU  77  -8.283   8.561  -4.066
  158   HD13  LEU  77          HD13      LEU  77  -7.215   8.182  -5.418
  159   HD21  LEU  77          HD21      LEU  77  -6.532   5.325  -4.726
  160   HD22  LEU  77          HD22      LEU  77  -7.080   5.915  -6.296
  161   HD23  LEU  77          HD23      LEU  77  -7.937   4.592  -5.505
  162    H    HIS  78           HN       HIS  78  -9.153   3.721  -1.016
  163    HA   HIS  78           HA       HIS  78  -9.035   5.157   1.421
  164    HB2  HIS  78           HB2      HIS  78 -10.780   3.565   1.237
  165    HB3  HIS  78           HB1      HIS  78  -9.674   2.297   0.701
  166    HD1  HIS  78           HD1      HIS  78 -11.162   3.789   3.762
  167    HD2  HIS  78           HD2      HIS  78  -8.159   1.092   2.758
  168    HE1  HIS  78           HE1      HIS  78 -10.536   2.590   5.901
  169    H    LYS  79           HN       LYS  79  -7.211   2.435   0.098
  170    HA   LYS  79           HA       LYS  79  -5.561   2.250   2.449
  171    HB2  LYS  79           HB2      LYS  79  -5.728   0.753  -0.137
  172    HB3  LYS  79           HB1      LYS  79  -4.255   0.620   0.824
  173    HG2  LYS  79           HG2      LYS  79  -5.724  -0.015   2.765
  174    HG3  LYS  79           HG1      LYS  79  -7.059  -0.113   1.622
  175    HD2  LYS  79           HD2      LYS  79  -4.505  -1.684   1.333
  176    HD3  LYS  79           HD1      LYS  79  -5.929  -2.295   2.172
  177    HE2  LYS  79           HE2      LYS  79  -7.219  -1.905   0.050
  178    HE3  LYS  79           HE1      LYS  79  -5.683  -1.552  -0.740
  179    HZ1  LYS  79           HZ1      LYS  79  -6.360  -3.866  -1.056
  180    HZ2  LYS  79           HZ2      LYS  79  -6.357  -4.117   0.621
  181    HZ3  LYS  79           HZ3      LYS  79  -4.909  -3.769  -0.191
  182    H    LYS  80           HN       LYS  80  -5.495   3.883  -0.564
  183    HA   LYS  80           HA       LYS  80  -2.797   4.749  -0.471
  184    HB2  LYS  80           HB2      LYS  80  -3.717   5.127  -2.553
  185    HB3  LYS  80           HB1      LYS  80  -5.281   5.587  -1.896
  186    HG2  LYS  80           HG2      LYS  80  -4.507   7.760  -1.372
  187    HG3  LYS  80           HG1      LYS  80  -2.836   7.326  -1.688
  188    HD2  LYS  80           HD2      LYS  80  -5.014   7.292  -3.767
  189    HD3  LYS  80           HD1      LYS  80  -3.945   8.670  -3.487
  190    HE2  LYS  80           HE2      LYS  80  -2.018   7.259  -3.946
  191    HE3  LYS  80           HE1      LYS  80  -3.083   5.885  -4.226
  192    HZ1  LYS  80           HZ1      LYS  80  -4.055   7.077  -6.102
  193    HZ2  LYS  80           HZ2      LYS  80  -2.387   6.889  -6.311
  194    HZ3  LYS  80           HZ3      LYS  80  -3.014   8.387  -5.832
  195    H    ARG  81           HN       ARG  81  -5.848   5.996   0.837
  196    HA   ARG  81           HA       ARG  81  -4.795   8.509   1.607
  197    HB2  ARG  81           HB2      ARG  81  -7.225   7.997   1.308
  198    HB3  ARG  81           HB1      ARG  81  -7.179   7.127   2.837
  199    HG2  ARG  81           HG2      ARG  81  -8.051   9.383   3.127
  200    HG3  ARG  81           HG1      ARG  81  -6.526   9.171   3.994
  201    HD2  ARG  81           HD2      ARG  81  -5.390  10.166   1.955
  202    HD3  ARG  81           HD1      ARG  81  -6.999  10.611   1.392
  203    HE   ARG  81           HE       ARG  81  -6.722  11.577   3.994
  204   HH11  ARG  81          HH11      ARG  81  -5.303  12.100   0.831
  205   HH12  ARG  81          HH12      ARG  81  -4.872  13.752   1.153
  206   HH21  ARG  81          HH21      ARG  81  -6.182  13.762   4.419
  207   HH22  ARG  81          HH22      ARG  81  -5.399  14.707   3.183
  208    H    HIS  82           HN       HIS  82  -4.841   5.408   3.249
  209    HA   HIS  82           HA       HIS  82  -4.323   6.282   5.862
  210    HB2  HIS  82           HB2      HIS  82  -3.717   3.737   4.404
  211    HB3  HIS  82           HB1      HIS  82  -3.101   3.989   6.017
  212    HD1  HIS  82           HD1      HIS  82  -4.861   4.004   7.957
  213    HD2  HIS  82           HD2      HIS  82  -6.355   3.192   4.174
  214    HE1  HIS  82           HE1      HIS  82  -7.132   2.960   8.298
  215    H    SER  83           HN       SER  83  -2.280   6.186   3.075
  216    HA   SER  83           HA       SER  83   0.014   6.970   4.750
  217    HB2  SER  83           HB2      SER  83   0.105   5.670   2.016
  218    HB3  SER  83           HB1      SER  83   1.487   6.048   3.045
  219    HG   SER  83           HG       SER  83  -0.484   4.497   4.211
  220    H    GLY  84           HN       GLY  84  -2.223   8.536   3.492
  221    HA2  GLY  84           HA2      GLY  84  -2.360  10.662   2.574
  222    HA3  GLY  84           HA1      GLY  84  -0.620  10.626   2.308
  223    H    GLU  85           HN       GLU  85  -0.036   8.775   0.666
  224    HA   GLU  85           HA       GLU  85  -1.985   8.371  -1.408
  225    HB2  GLU  85           HB2      GLU  85  -0.813   9.416  -3.183
  226    HB3  GLU  85           HB1      GLU  85  -0.884  10.612  -1.903
  227    HG2  GLU  85           HG2      GLU  85   1.442   9.686  -1.260
  228    HG3  GLU  85           HG1      GLU  85   1.422   9.039  -2.891
  229    H    ALA  86           HN       ALA  86  -1.528   6.541  -2.557
  230    HA   ALA  86           HA       ALA  86   0.646   4.927  -1.536
  231    HB1  ALA  86           HB1      ALA  86  -1.584   3.927  -1.638
  232    HB2  ALA  86           HB2      ALA  86  -0.438   3.064  -2.664
  233    HB3  ALA  86           HB3      ALA  86  -1.607   4.169  -3.385
  234    H    ARG  87           HN       ARG  87   2.455   5.672  -2.469
  235    HA   ARG  87           HA       ARG  87   2.591   6.154  -5.286
  236    HB2  ARG  87           HB2      ARG  87   4.769   6.129  -3.218
  237    HB3  ARG  87           HB1      ARG  87   4.906   6.758  -4.856
  238    HG2  ARG  87           HG2      ARG  87   3.053   7.755  -2.735
  239    HG3  ARG  87           HG1      ARG  87   4.606   8.459  -3.167
  240    HD2  ARG  87           HD2      ARG  87   2.226   8.144  -4.980
  241    HD3  ARG  87           HD1      ARG  87   2.747   9.655  -4.232
  242    HE   ARG  87           HE       ARG  87   4.471   8.199  -6.142
  243   HH11  ARG  87          HH11      ARG  87   2.817  11.118  -5.096
  244   HH12  ARG  87          HH12      ARG  87   3.609  12.130  -6.271
  245   HH21  ARG  87          HH21      ARG  87   5.499   9.538  -7.693
  246   HH22  ARG  87          HH22      ARG  87   5.122  11.234  -7.748
  247    H    TYR  88           HN       TYR  88   5.141   4.560  -3.642
  248    HA   TYR  88           HA       TYR  88   5.257   2.510  -5.695
  249    HB2  TYR  88           HB2      TYR  88   7.096   3.136  -3.380
  250    HB3  TYR  88           HB1      TYR  88   7.420   1.975  -4.653
  251    HD1  TYR  88           HD1      TYR  88   6.710   5.578  -4.112
  252    HD2  TYR  88           HD2      TYR  88   8.588   2.648  -6.548
  253    HE1  TYR  88           HE1      TYR  88   7.735   7.357  -5.433
  254    HE2  TYR  88           HE2      TYR  88   9.626   4.426  -7.891
  255    HH   TYR  88           HH       TYR  88   9.324   6.755  -8.424
  256    H    ARG  89           HN       ARG  89   5.252   0.302  -5.259
  257    HA   ARG  89           HA       ARG  89   4.431  -0.491  -2.548
  258    HB2  ARG  89           HB2      ARG  89   3.878  -1.601  -5.229
  259    HB3  ARG  89           HB1      ARG  89   4.309  -2.777  -4.010
  260    HG2  ARG  89           HG2      ARG  89   2.488  -2.176  -2.651
  261    HG3  ARG  89           HG1      ARG  89   2.120  -0.779  -3.671
  262    HD2  ARG  89           HD2      ARG  89   1.634  -2.253  -5.531
  263    HD3  ARG  89           HD1      ARG  89   2.023  -3.641  -4.523
  264    HE   ARG  89           HE       ARG  89   0.081  -2.641  -3.079
  265   HH11  ARG  89          HH11      ARG  89   0.239  -2.795  -6.581
  266   HH12  ARG  89          HH12      ARG  89  -1.466  -3.083  -6.764
  267   HH21  ARG  89          HH21      ARG  89  -2.146  -2.969  -3.316
  268   HH22  ARG  89          HH22      ARG  89  -2.841  -3.133  -4.900
  269    H    CYS  90           HN       CYS  90   5.582  -2.151  -1.614
  270    HA   CYS  90           HA       CYS  90   8.303  -2.589  -2.356
  271    HB2  CYS  90           HB2      CYS  90   7.106  -2.868  -0.050
  272    HB3  CYS  90           HB1      CYS  90   6.672  -4.445  -0.651
  273    H    GLU  91           HN       GLU  91   8.957  -3.962  -3.947
  274    HA   GLU  91           HA       GLU  91   7.112  -5.197  -5.638
  275    HB2  GLU  91           HB2      GLU  91   9.125  -6.285  -6.659
  276    HB3  GLU  91           HB1      GLU  91   9.204  -4.528  -6.536
  277    HG2  GLU  91           HG2      GLU  91  10.558  -4.706  -4.592
  278    HG3  GLU  91           HG1      GLU  91  10.437  -6.456  -4.599
  279    H    ASP  92           HN       ASP  92   7.897  -6.185  -2.629
  280    HA   ASP  92           HA       ASP  92   7.691  -9.036  -3.316
  281    HB2  ASP  92           HB2      ASP  92   8.904  -9.383  -1.095
  282    HB3  ASP  92           HB1      ASP  92   9.857  -8.748  -2.433
  283    H    CYS  93           HN       CYS  93   6.608  -6.462  -1.090
  284    HA   CYS  93           HA       CYS  93   4.712  -8.416  -0.051
  285    HB2  CYS  93           HB2      CYS  93   5.154  -7.847   2.181
  286    HB3  CYS  93           HB1      CYS  93   6.740  -8.020   1.447
  287    H    GLY  94           HN       GLY  94   5.066  -5.678  -1.707
  288    HA2  GLY  94           HA2      GLY  94   3.651  -4.127  -2.449
  289    HA3  GLY  94           HA1      GLY  94   2.354  -5.140  -1.835
  290    H    LYS  95           HN       LYS  95   4.821  -3.591   0.158
  291    HA   LYS  95           HA       LYS  95   2.857  -2.031   1.554
  292    HB2  LYS  95           HB2      LYS  95   5.865  -2.126   1.642
  293    HB3  LYS  95           HB1      LYS  95   4.917  -1.010   2.622
  294    HG2  LYS  95           HG2      LYS  95   3.777  -2.986   3.590
  295    HG3  LYS  95           HG1      LYS  95   4.944  -4.010   2.743
  296    HD2  LYS  95           HD2      LYS  95   6.184  -3.753   4.593
  297    HD3  LYS  95           HD1      LYS  95   6.553  -2.174   3.917
  298    HE2  LYS  95           HE2      LYS  95   5.910  -1.836   6.184
  299    HE3  LYS  95           HE1      LYS  95   4.589  -1.263   5.165
  300    HZ1  LYS  95           HZ1      LYS  95   4.707  -3.857   6.610
  301    HZ2  LYS  95           HZ2      LYS  95   3.459  -3.400   5.560
  302    HZ3  LYS  95           HZ3      LYS  95   3.717  -2.533   6.994
  303    H    LEU  96           HN       LEU  96   2.522   0.174   1.357
  304    HA   LEU  96           HA       LEU  96   3.508   1.270  -1.171
  305    HB2  LEU  96           HB2      LEU  96   1.218   2.043   0.602
  306    HB3  LEU  96           HB1      LEU  96   1.727   3.028  -0.759
  307    HG   LEU  96           HG       LEU  96  -0.164   1.729  -1.439
  308   HD11  LEU  96          HD11      LEU  96   1.558   1.966  -3.118
  309   HD12  LEU  96          HD12      LEU  96   0.775   0.389  -3.269
  310   HD13  LEU  96          HD13      LEU  96   2.373   0.515  -2.521
  311   HD21  LEU  96          HD21      LEU  96   1.362  -0.662  -0.442
  312   HD22  LEU  96          HD22      LEU  96  -0.146  -0.733  -1.359
  313   HD23  LEU  96          HD23      LEU  96  -0.121   0.007   0.242
  314    H    PHE  97           HN       PHE  97   5.217   2.454  -1.083
  315    HA   PHE  97           HA       PHE  97   5.564   4.254   1.230
  316    HB2  PHE  97           HB2      PHE  97   7.724   3.181  -0.606
  317    HB3  PHE  97           HB1      PHE  97   7.971   4.292   0.730
  318    HD1  PHE  97           HD2      PHE  97   7.046   0.814  -0.114
  319    HD2  PHE  97           HD1      PHE  97   8.019   3.580   2.979
  320    HE1  PHE  97           HE2      PHE  97   7.227  -1.053   1.510
  321    HE2  PHE  97           HE1      PHE  97   8.226   1.723   4.580
  322    HZ   PHE  97           HZ       PHE  97   7.831  -0.588   3.841
  323    H    THR  98           HN       THR  98   5.766   6.333   0.922
  324    HA   THR  98           HA       THR  98   4.968   7.402  -1.627
  325    HB   THR  98           HB       THR  98   4.834   9.518  -0.449
  326    HG1  THR  98           HG1      THR  98   6.196   9.875   1.142
  327   HG21  THR  98          HG21      THR  98   3.017   7.965  -0.061
  328   HG22  THR  98          HG22      THR  98   3.355   8.835   1.437
  329   HG23  THR  98          HG23      THR  98   3.928   7.175   1.228
  330    H    THR  99           HN       THR  99   7.820   6.620  -0.077
  331    HA   THR  99           HA       THR  99   9.386   8.297  -1.906
  332    HB   THR  99           HB       THR  99  10.000   7.449   0.932
  333    HG1  THR  99           HG1      THR  99   9.180   9.341   1.351
  334   HG21  THR  99          HG21      THR  99  12.128   8.472   0.718
  335   HG22  THR  99          HG22      THR  99  11.742   9.087  -0.890
  336   HG23  THR  99          HG23      THR  99  11.943   7.353  -0.633
  337    H    SER 100           HN       SER 100  10.642   7.166  -3.247
  338    HA   SER 100           HA       SER 100  10.524   4.350  -3.336
  339    HB2  SER 100           HB2      SER 100  12.227   4.665  -5.194
  340    HB3  SER 100           HB1      SER 100  10.699   5.535  -5.390
  341    HG   SER 100           HG       SER 100  12.266   7.015  -5.811
  342    H    GLY 101           HN       GLY 101  12.814   6.612  -1.982
  343    HA2  GLY 101           HA2      GLY 101  14.862   4.677  -1.491
  344    HA3  GLY 101           HA1      GLY 101  14.725   6.252  -0.749
  345    H    ASN 102           HN       ASN 102  12.257   6.051   0.543
  346    HA   ASN 102           HA       ASN 102  12.740   4.530   2.851
  347    HB2  ASN 102           HB2      ASN 102  10.159   5.527   1.637
  348    HB3  ASN 102           HB1      ASN 102  10.204   4.638   3.149
  349   HD21  ASN 102          HD21      ASN 102   9.418   6.311   4.368
  350   HD22  ASN 102          HD22      ASN 102  10.330   7.737   4.722
  351    H    LEU 103           HN       LEU 103  11.149   3.912  -0.161
  352    HA   LEU 103           HA       LEU 103  10.063   1.431   0.492
  353    HB2  LEU 103           HB2      LEU 103   9.214   2.523  -1.383
  354    HB3  LEU 103           HB1      LEU 103  10.819   2.874  -2.010
  355    HG   LEU 103           HG       LEU 103  11.068   0.413  -2.454
  356   HD11  LEU 103          HD11      LEU 103   8.088   0.288  -2.274
  357   HD12  LEU 103          HD12      LEU 103   9.083  -0.041  -0.841
  358   HD13  LEU 103          HD13      LEU 103   9.282  -1.033  -2.292
  359   HD21  LEU 103          HD21      LEU 103  10.661   1.911  -4.223
  360   HD22  LEU 103          HD22      LEU 103   8.975   2.097  -3.751
  361   HD23  LEU 103          HD23      LEU 103   9.532   0.567  -4.438
  362    H    LYS 104           HN       LYS 104  12.904   2.349  -1.360
  363    HA   LYS 104           HA       LYS 104  14.084  -0.013  -1.940
  364    HB2  LYS 104           HB2      LYS 104  14.731   2.168  -2.751
  365    HB3  LYS 104           HB1      LYS 104  15.355   2.596  -1.169
  366    HG2  LYS 104           HG2      LYS 104  17.030   0.834  -1.354
  367    HG3  LYS 104           HG1      LYS 104  16.412   0.422  -2.962
  368    HD2  LYS 104           HD2      LYS 104  17.482   3.126  -2.177
  369    HD3  LYS 104           HD1      LYS 104  18.426   1.886  -3.005
  370    HE2  LYS 104           HE2      LYS 104  16.760   1.923  -4.842
  371    HE3  LYS 104           HE1      LYS 104  15.934   3.248  -4.021
  372    HZ1  LYS 104           HZ1      LYS 104  17.376   4.121  -5.707
  373    HZ2  LYS 104           HZ2      LYS 104  18.708   3.283  -5.077
  374    HZ3  LYS 104           HZ3      LYS 104  18.001   4.541  -4.188
  375    H    ARG 105           HN       ARG 105  14.705   1.918   1.049
  376    HA   ARG 105           HA       ARG 105  16.552   0.067   2.089
  377    HB2  ARG 105           HB2      ARG 105  16.149   1.183   4.258
  378    HB3  ARG 105           HB1      ARG 105  16.486   2.298   2.943
  379    HG2  ARG 105           HG2      ARG 105  14.747   3.369   3.827
  380    HG3  ARG 105           HG1      ARG 105  13.843   2.280   2.787
  381    HD2  ARG 105           HD2      ARG 105  12.774   2.130   4.869
  382    HD3  ARG 105           HD1      ARG 105  13.791   0.689   4.760
  383    HE   ARG 105           HE       ARG 105  15.263   2.698   6.040
  384   HH11  ARG 105          HH11      ARG 105  12.459   0.679   6.616
  385   HH12  ARG 105          HH12      ARG 105  12.616   0.735   8.345
  386   HH21  ARG 105          HH21      ARG 105  15.477   2.770   8.308
  387   HH22  ARG 105          HH22      ARG 105  14.330   1.928   9.310
  388    H    HIS 106           HN       HIS 106  13.067   0.177   2.120
  389    HA   HIS 106           HA       HIS 106  12.784  -1.982   4.010
  390    HB2  HIS 106           HB2      HIS 106  10.978  -0.334   3.778
  391    HB3  HIS 106           HB1      HIS 106  10.784  -0.771   2.082
  392    HD1  HIS 106           HD1      HIS 106  10.174  -2.171   5.560
  393    HD2  HIS 106           HD2      HIS 106   9.347  -2.981   1.577
  394    HE1  HIS 106           HE1      HIS 106   8.562  -4.127   5.554
  395    H    GLN 107           HN       GLN 107  13.472  -1.748   0.679
  396    HA   GLN 107           HA       GLN 107  12.369  -4.312  -0.044
  397    HB2  GLN 107           HB2      GLN 107  14.419  -2.820  -1.666
  398    HB3  GLN 107           HB1      GLN 107  13.137  -3.860  -2.239
  399    HG2  GLN 107           HG2      GLN 107  11.594  -1.973  -1.407
  400    HG3  GLN 107           HG1      GLN 107  13.048  -1.028  -1.363
  401   HE21  GLN 107          HE21      GLN 107  10.863  -2.775  -3.399
  402   HE22  GLN 107          HE22      GLN 107  11.364  -2.059  -4.899
  403    H    LEU 108           HN       LEU 108  15.123  -2.813   1.160
  404    HA   LEU 108           HA       LEU 108  17.053  -4.836   0.540
  405    HB2  LEU 108           HB2      LEU 108  17.027  -2.295   2.080
  406    HB3  LEU 108           HB1      LEU 108  18.380  -3.405   2.229
  407    HG   LEU 108           HG       LEU 108  19.257  -2.825   0.242
  408   HD11  LEU 108          HD11      LEU 108  17.966  -2.326  -1.769
  409   HD12  LEU 108          HD12      LEU 108  16.469  -2.407  -0.833
  410   HD13  LEU 108          HD13      LEU 108  17.464  -3.852  -1.038
  411   HD21  LEU 108          HD21      LEU 108  17.341  -0.534   0.567
  412   HD22  LEU 108          HD22      LEU 108  18.904  -0.504  -0.258
  413   HD23  LEU 108          HD23      LEU 108  18.829  -0.747   1.489
  414    H    VAL 109           HN       VAL 109  14.831  -4.244   3.078
  415    HA   VAL 109           HA       VAL 109  16.275  -5.824   4.955
  416    HB   VAL 109           HB       VAL 109  14.329  -5.691   6.338
  417   HG11  VAL 109          HG11      VAL 109  14.545  -3.134   4.775
  418   HG12  VAL 109          HG12      VAL 109  15.615  -3.613   6.096
  419   HG13  VAL 109          HG13      VAL 109  13.908  -3.301   6.412
  420   HG21  VAL 109          HG21      VAL 109  12.197  -4.801   5.484
  421   HG22  VAL 109          HG22      VAL 109  12.675  -6.314   4.706
  422   HG23  VAL 109          HG23      VAL 109  12.909  -4.778   3.865
  423    H    HIS 110           HN       HIS 110  14.315  -6.334   2.229
  424    HA   HIS 110           HA       HIS 110  13.715  -9.110   2.914
  425    HB2  HIS 110           HB2      HIS 110  13.214  -7.420   0.478
  426    HB3  HIS 110           HB1      HIS 110  12.808  -9.113   0.547
  427    HD1  HIS 110           HD1      HIS 110  10.617  -9.721   1.760
  428    HD2  HIS 110           HD2      HIS 110  11.732  -5.745   2.007
  429    HE1  HIS 110           HE1      HIS 110   8.585  -8.457   2.593
  430    H    SER 111           HN       SER 111  16.282  -7.371   1.616
  431    HA   SER 111           HA       SER 111  17.544  -9.798   0.571
  432    HB2  SER 111           HB2      SER 111  18.381  -8.465  -1.398
  433    HB3  SER 111           HB1      SER 111  16.640  -8.750  -1.417
  434    HG   SER 111           HG       SER 111  16.870  -6.604  -1.838
  435    H    GLY 112           HN       GLY 112  17.881  -8.438   3.002
  436    HA2  GLY 112           HA2      GLY 112  20.605  -7.414   2.795
  437    HA3  GLY 112           HA1      GLY 112  19.360  -6.315   3.407
  Start of MODEL    6
    1    H    LYS  58           HT1      LYS  58 -15.998  -7.125  -5.218
    2    HA   LYS  58           HA       LYS  58 -14.816  -9.149  -4.677
    3    HB2  LYS  58           HB2      LYS  58 -12.468  -7.774  -6.009
    4    HB3  LYS  58           HB1      LYS  58 -12.425  -9.319  -5.175
    5    HG2  LYS  58           HG2      LYS  58 -14.022  -8.769  -7.664
    6    HG3  LYS  58           HG1      LYS  58 -12.421  -9.505  -7.639
    7    HD2  LYS  58           HD2      LYS  58 -13.354 -11.310  -6.195
    8    HD3  LYS  58           HD1      LYS  58 -14.954 -10.603  -6.423
    9    HE2  LYS  58           HE2      LYS  58 -14.737 -10.915  -8.846
   10    HE3  LYS  58           HE1      LYS  58 -13.145 -11.632  -8.606
   11    HZ1  LYS  58           HZ1      LYS  58 -14.212 -13.382  -7.277
   12    HZ2  LYS  58           HZ2      LYS  58 -14.773 -13.349  -8.880
   13    HZ3  LYS  58           HZ3      LYS  58 -15.732 -12.710  -7.634
   14    HA   PRO  59           HA       PRO  59 -14.027  -6.520  -1.166
   15    HB2  PRO  59           HB2      PRO  59 -13.409  -8.481   0.615
   16    HB3  PRO  59           HB1      PRO  59 -15.066  -8.099   0.135
   17    HG2  PRO  59           HG2      PRO  59 -13.266 -10.275  -0.830
   18    HG3  PRO  59           HG1      PRO  59 -14.995 -10.343  -0.447
   19    HD2  PRO  59           HD2      PRO  59 -14.062 -10.159  -2.979
   20    HD3  PRO  59           HD1      PRO  59 -15.600  -9.443  -2.476
   21    H    TYR  60           HN       TYR  60 -12.310  -5.403  -1.186
   22    HA   TYR  60           HA       TYR  60  -9.667  -6.679  -0.889
   23    HB2  TYR  60           HB2      TYR  60 -10.381  -4.178  -2.438
   24    HB3  TYR  60           HB1      TYR  60  -8.729  -4.694  -2.095
   25    HD1  TYR  60           HD2      TYR  60  -8.375  -7.311  -2.712
   26    HD2  TYR  60           HD1      TYR  60 -11.119  -4.643  -4.558
   27    HE1  TYR  60           HE2      TYR  60  -8.367  -8.708  -4.722
   28    HE2  TYR  60           HE1      TYR  60 -11.120  -6.035  -6.571
   29    HH   TYR  60           HH       TYR  60  -9.747  -9.178  -6.642
   30    H    GLY  61           HN       GLY  61  -9.081  -6.340   1.187
   31    HA2  GLY  61           HA2      GLY  61 -10.076  -3.888   2.436
   32    HA3  GLY  61           HA1      GLY  61  -9.763  -5.391   3.289
   33    H    CYS  62           HN       CYS  62  -8.892  -2.972   4.097
   34    HA   CYS  62           HA       CYS  62  -6.116  -2.574   3.485
   35    HB2  CYS  62           HB2      CYS  62  -7.667  -0.742   4.167
   36    HB3  CYS  62           HB1      CYS  62  -7.773  -1.471   5.763
   37    H    GLU  63           HN       GLU  63  -4.373  -3.201   4.663
   38    HA   GLU  63           HA       GLU  63  -4.731  -5.348   6.574
   39    HB2  GLU  63           HB2      GLU  63  -2.952  -5.481   4.880
   40    HB3  GLU  63           HB1      GLU  63  -2.232  -4.006   5.507
   41    HG2  GLU  63           HG2      GLU  63  -2.189  -5.411   7.744
   42    HG3  GLU  63           HG1      GLU  63  -2.192  -6.756   6.604
   43    H    GLU  64           HN       GLU  64  -4.176  -1.955   6.581
   44    HA   GLU  64           HA       GLU  64  -2.701  -1.983   9.047
   45    HB2  GLU  64           HB2      GLU  64  -1.692  -0.341   7.970
   46    HB3  GLU  64           HB1      GLU  64  -2.911  -0.340   6.719
   47    HG2  GLU  64           HG2      GLU  64  -3.619   0.993   9.223
   48    HG3  GLU  64           HG1      GLU  64  -2.359   1.762   8.263
   49    H    CYS  65           HN       CYS  65  -5.882  -1.000   7.894
   50    HA   CYS  65           HA       CYS  65  -6.575  -0.348  10.689
   51    HB2  CYS  65           HB2      CYS  65  -8.459   0.984   9.717
   52    HB3  CYS  65           HB1      CYS  65  -6.866   1.603   9.296
   53    H    GLY  66           HN       GLY  66  -7.314  -2.085   7.810
   54    HA2  GLY  66           HA2      GLY  66  -8.020  -4.265   7.780
   55    HA3  GLY  66           HA1      GLY  66  -8.544  -4.099   9.451
   56    H    LYS  67           HN       LYS  67  -9.534  -1.957   6.830
   57    HA   LYS  67           HA       LYS  67 -12.238  -3.106   7.022
   58    HB2  LYS  67           HB2      LYS  67 -11.983  -0.689   7.656
   59    HB3  LYS  67           HB1      LYS  67 -11.494  -0.363   6.000
   60    HG2  LYS  67           HG2      LYS  67 -13.839   0.185   6.351
   61    HG3  LYS  67           HG1      LYS  67 -13.659  -1.135   5.192
   62    HD2  LYS  67           HD2      LYS  67 -14.139  -2.749   6.989
   63    HD3  LYS  67           HD1      LYS  67 -14.372  -1.409   8.112
   64    HE2  LYS  67           HE2      LYS  67 -15.979  -1.869   5.601
   65    HE3  LYS  67           HE1      LYS  67 -16.498  -2.310   7.228
   66    HZ1  LYS  67           HZ1      LYS  67 -15.934   0.440   6.248
   67    HZ2  LYS  67           HZ2      LYS  67 -16.358   0.042   7.843
   68    HZ3  LYS  67           HZ3      LYS  67 -17.461  -0.219   6.580
   69    H    SER  68           HN       SER  68 -13.239  -3.828   5.211
   70    HA   SER  68           HA       SER  68 -11.533  -4.230   2.892
   71    HB2  SER  68           HB2      SER  68 -14.153  -5.408   2.631
   72    HB3  SER  68           HB1      SER  68 -12.577  -6.206   2.754
   73    HG   SER  68           HG       SER  68 -14.460  -6.261   4.535
   74    H    TYR  69           HN       TYR  69 -11.854  -3.400   0.916
   75    HA   TYR  69           HA       TYR  69 -14.165  -1.613   0.584
   76    HB2  TYR  69           HB2      TYR  69 -11.363  -1.456  -0.445
   77    HB3  TYR  69           HB1      TYR  69 -12.666  -0.735  -1.386
   78    HD1  TYR  69           HD2      TYR  69 -11.276  -0.805   2.065
   79    HD2  TYR  69           HD1      TYR  69 -13.351   1.376  -0.919
   80    HE1  TYR  69           HE2      TYR  69 -11.215   1.181   3.495
   81    HE2  TYR  69           HE1      TYR  69 -13.302   3.385   0.499
   82    HH   TYR  69           HH       TYR  69 -13.053   4.006   2.801
   83    H    ARG  70           HN       ARG  70 -14.792  -1.291  -1.716
   84    HA   ARG  70           HA       ARG  70 -15.637  -3.848  -2.729
   85    HB2  ARG  70           HB2      ARG  70 -17.098  -1.809  -2.485
   86    HB3  ARG  70           HB1      ARG  70 -16.198  -1.081  -3.810
   87    HG2  ARG  70           HG2      ARG  70 -18.227  -1.963  -4.682
   88    HG3  ARG  70           HG1      ARG  70 -16.902  -2.985  -5.245
   89    HD2  ARG  70           HD2      ARG  70 -17.393  -4.593  -3.470
   90    HD3  ARG  70           HD1      ARG  70 -18.713  -3.573  -2.903
   91    HE   ARG  70           HE       ARG  70 -18.676  -4.852  -5.565
   92   HH11  ARG  70          HH11      ARG  70 -20.329  -3.810  -2.670
   93   HH12  ARG  70          HH12      ARG  70 -21.860  -4.485  -3.135
   94   HH21  ARG  70          HH21      ARG  70 -20.669  -5.749  -6.202
   95   HH22  ARG  70          HH22      ARG  70 -22.064  -5.581  -5.166
   96    H    LEU  71           HN       LEU  71 -13.631  -1.160  -3.854
   97    HA   LEU  71           HA       LEU  71 -12.872  -2.742  -6.204
   98    HB2  LEU  71           HB2      LEU  71 -13.250   0.186  -5.742
   99    HB3  LEU  71           HB1      LEU  71 -12.099  -0.347  -6.955
  100    HG   LEU  71           HG       LEU  71 -13.812  -1.423  -8.216
  101   HD11  LEU  71          HD11      LEU  71 -16.146  -1.424  -7.581
  102   HD12  LEU  71          HD12      LEU  71 -15.731  -0.665  -6.044
  103   HD13  LEU  71          HD13      LEU  71 -15.157  -2.294  -6.407
  104   HD21  LEU  71          HD21      LEU  71 -15.206   0.470  -8.821
  105   HD22  LEU  71          HD22      LEU  71 -13.542   0.985  -8.543
  106   HD23  LEU  71          HD23      LEU  71 -14.777   1.273  -7.312
  107    H    ILE  72           HN       ILE  72 -10.712  -2.581  -6.939
  108    HA   ILE  72           HA       ILE  72  -8.683  -2.578  -4.969
  109    HB   ILE  72           HB       ILE  72  -8.607  -2.459  -7.975
  110   HG12  ILE  72          HG12      ILE  72  -9.074  -4.590  -6.772
  111   HG13  ILE  72          HG11      ILE  72  -7.615  -4.653  -7.760
  112   HG21  ILE  72          HG21      ILE  72  -6.750  -1.071  -7.269
  113   HG22  ILE  72          HG22      ILE  72  -6.152  -2.614  -7.881
  114   HG23  ILE  72          HG23      ILE  72  -6.216  -2.317  -6.144
  115   HD11  ILE  72          HD11      ILE  72  -7.673  -4.178  -4.785
  116   HD12  ILE  72          HD12      ILE  72  -6.239  -4.371  -5.798
  117   HD13  ILE  72          HD13      ILE  72  -7.344  -5.726  -5.565
  118    H    SER  73           HN       SER  73  -9.577  -0.164  -7.425
  119    HA   SER  73           HA       SER  73  -7.665   1.751  -6.591
  120    HB2  SER  73           HB2      SER  73  -8.780   1.712  -8.841
  121    HB3  SER  73           HB1      SER  73 -10.262   2.267  -8.067
  122    HG   SER  73           HG       SER  73  -8.914   3.943  -9.022
  123    H    LEU  74           HN       LEU  74 -10.885   0.987  -5.520
  124    HA   LEU  74           HA       LEU  74 -11.413   3.245  -3.998
  125    HB2  LEU  74           HB2      LEU  74 -12.552   0.705  -4.477
  126    HB3  LEU  74           HB1      LEU  74 -12.353   0.840  -2.734
  127    HG   LEU  74           HG       LEU  74 -13.908   2.672  -4.539
  128   HD11  LEU  74          HD11      LEU  74 -15.024   0.588  -3.894
  129   HD12  LEU  74          HD12      LEU  74 -15.784   1.996  -3.150
  130   HD13  LEU  74          HD13      LEU  74 -14.722   0.959  -2.196
  131   HD21  LEU  74          HD21      LEU  74 -13.047   2.917  -1.689
  132   HD22  LEU  74          HD22      LEU  74 -14.379   3.858  -2.380
  133   HD23  LEU  74          HD23      LEU  74 -12.740   4.025  -3.023
  134    H    LEU  75           HN       LEU  75  -9.981   0.167  -3.099
  135    HA   LEU  75           HA       LEU  75  -9.348   0.943  -0.446
  136    HB2  LEU  75           HB2      LEU  75  -9.621  -1.350  -0.886
  137    HB3  LEU  75           HB1      LEU  75  -8.539  -1.292  -2.275
  138    HG   LEU  75           HG       LEU  75  -6.711  -0.722  -0.569
  139   HD11  LEU  75          HD11      LEU  75  -8.204  -0.256   1.310
  140   HD12  LEU  75          HD12      LEU  75  -7.082  -1.566   1.677
  141   HD13  LEU  75          HD13      LEU  75  -8.762  -1.929   1.276
  142   HD21  LEU  75          HD21      LEU  75  -8.014  -3.422  -0.690
  143   HD22  LEU  75          HD22      LEU  75  -6.352  -3.111  -0.180
  144   HD23  LEU  75          HD23      LEU  75  -6.853  -2.752  -1.841
  145    H    ASN  76           HN       ASN  76  -7.859   1.183  -3.522
  146    HA   ASN  76           HA       ASN  76  -5.180   1.635  -2.701
  147    HB2  ASN  76           HB2      ASN  76  -6.491   1.293  -5.103
  148    HB3  ASN  76           HB1      ASN  76  -6.038   3.000  -5.158
  149   HD21  ASN  76          HD21      ASN  76  -4.930  -0.272  -5.061
  150   HD22  ASN  76          HD22      ASN  76  -3.275   0.048  -5.472
  151    H    LEU  77           HN       LEU  77  -7.966   3.714  -3.325
  152    HA   LEU  77           HA       LEU  77  -6.485   6.108  -2.787
  153    HB2  LEU  77           HB2      LEU  77  -9.248   5.352  -3.524
  154    HB3  LEU  77           HB1      LEU  77  -9.054   6.860  -2.660
  155    HG   LEU  77           HG       LEU  77  -9.096   6.920  -5.223
  156   HD11  LEU  77          HD11      LEU  77  -7.509   8.761  -5.239
  157   HD12  LEU  77          HD12      LEU  77  -6.821   8.185  -3.720
  158   HD13  LEU  77          HD13      LEU  77  -8.479   8.778  -3.767
  159   HD21  LEU  77          HD21      LEU  77  -7.521   5.077  -5.596
  160   HD22  LEU  77          HD22      LEU  77  -6.249   6.017  -4.815
  161   HD23  LEU  77          HD23      LEU  77  -6.959   6.579  -6.328
  162    H    HIS  78           HN       HIS  78  -8.255   3.774  -1.045
  163    HA   HIS  78           HA       HIS  78  -8.615   5.223   1.364
  164    HB2  HIS  78           HB2      HIS  78  -9.846   3.192   1.103
  165    HB3  HIS  78           HB1      HIS  78  -8.380   2.275   0.745
  166    HD1  HIS  78           HD1      HIS  78 -10.399   3.623   3.601
  167    HD2  HIS  78           HD2      HIS  78  -6.899   1.470   2.957
  168    HE1  HIS  78           HE1      HIS  78  -9.690   2.728   5.852
  169    H    LYS  79           HN       LYS  79  -6.021   3.174   0.101
  170    HA   LYS  79           HA       LYS  79  -4.460   3.500   2.510
  171    HB2  LYS  79           HB2      LYS  79  -2.744   2.157   1.300
  172    HB3  LYS  79           HB1      LYS  79  -4.307   1.367   1.423
  173    HG2  LYS  79           HG2      LYS  79  -4.789   2.011  -0.897
  174    HG3  LYS  79           HG1      LYS  79  -3.179   2.730  -1.006
  175    HD2  LYS  79           HD2      LYS  79  -3.263   0.455  -1.958
  176    HD3  LYS  79           HD1      LYS  79  -2.150   0.580  -0.597
  177    HE2  LYS  79           HE2      LYS  79  -3.908  -0.364   0.873
  178    HE3  LYS  79           HE1      LYS  79  -4.945  -0.557  -0.541
  179    HZ1  LYS  79           HZ1      LYS  79  -2.277  -1.834  -0.254
  180    HZ2  LYS  79           HZ2      LYS  79  -3.408  -2.118  -1.480
  181    HZ3  LYS  79           HZ3      LYS  79  -3.741  -2.607   0.110
  182    H    LYS  80           HN       LYS  80  -4.775   5.009  -0.569
  183    HA   LYS  80           HA       LYS  80  -2.447   6.636  -0.389
  184    HB2  LYS  80           HB2      LYS  80  -3.552   6.449  -2.518
  185    HB3  LYS  80           HB1      LYS  80  -5.079   6.987  -1.837
  186    HG2  LYS  80           HG2      LYS  80  -4.266   9.210  -1.590
  187    HG3  LYS  80           HG1      LYS  80  -2.624   8.725  -1.977
  188    HD2  LYS  80           HD2      LYS  80  -4.896   8.390  -3.912
  189    HD3  LYS  80           HD1      LYS  80  -3.973   9.891  -3.797
  190    HE2  LYS  80           HE2      LYS  80  -1.914   8.659  -4.239
  191    HE3  LYS  80           HE1      LYS  80  -2.836   7.162  -4.345
  192    HZ1  LYS  80           HZ1      LYS  80  -2.279   8.189  -6.525
  193    HZ2  LYS  80           HZ2      LYS  80  -3.289   9.494  -6.128
  194    HZ3  LYS  80           HZ3      LYS  80  -3.937   7.936  -6.290
  195    H    ARG  81           HN       ARG  81  -5.763   6.867   0.787
  196    HA   ARG  81           HA       ARG  81  -5.739   9.523   1.650
  197    HB2  ARG  81           HB2      ARG  81  -7.760   8.169   1.473
  198    HB3  ARG  81           HB1      ARG  81  -7.226   7.175   2.821
  199    HG2  ARG  81           HG2      ARG  81  -7.482   8.968   4.353
  200    HG3  ARG  81           HG1      ARG  81  -7.722  10.131   3.048
  201    HD2  ARG  81           HD2      ARG  81  -9.784   8.985   2.417
  202    HD3  ARG  81           HD1      ARG  81  -9.554   7.839   3.736
  203    HE   ARG  81           HE       ARG  81  -9.560  10.109   5.093
  204   HH11  ARG  81          HH11      ARG  81 -11.671   9.049   2.499
  205   HH12  ARG  81          HH12      ARG  81 -13.022  10.014   3.033
  206   HH21  ARG  81          HH21      ARG  81 -11.348  11.366   5.804
  207   HH22  ARG  81          HH22      ARG  81 -12.834  11.312   4.914
  208    H    HIS  82           HN       HIS  82  -4.725   6.587   3.397
  209    HA   HIS  82           HA       HIS  82  -4.311   7.884   5.881
  210    HB2  HIS  82           HB2      HIS  82  -3.196   5.305   4.786
  211    HB3  HIS  82           HB1      HIS  82  -2.918   5.857   6.417
  212    HD1  HIS  82           HD1      HIS  82  -5.062   5.850   8.020
  213    HD2  HIS  82           HD2      HIS  82  -5.485   4.038   4.307
  214    HE1  HIS  82           HE1      HIS  82  -7.070   4.337   8.187
  215    H    SER  83           HN       SER  83  -2.357   7.579   3.021
  216    HA   SER  83           HA       SER  83   0.016   8.488   4.494
  217    HB2  SER  83           HB2      SER  83  -0.119   7.298   1.717
  218    HB3  SER  83           HB1      SER  83   1.337   7.616   2.661
  219    HG   SER  83           HG       SER  83  -0.235   5.451   2.682
  220    H    GLY  84           HN       GLY  84  -2.411   9.960   3.122
  221    HA2  GLY  84           HA2      GLY  84  -2.603  12.114   2.271
  222    HA3  GLY  84           HA1      GLY  84  -0.848  12.192   2.157
  223    H    GLU  85           HN       GLU  85   0.016  10.483   0.485
  224    HA   GLU  85           HA       GLU  85  -1.814  10.246  -1.782
  225    HB2  GLU  85           HB2      GLU  85   0.025  10.714  -3.320
  226    HB3  GLU  85           HB1      GLU  85  -0.223  12.079  -2.242
  227    HG2  GLU  85           HG2      GLU  85   1.734  10.096  -1.336
  228    HG3  GLU  85           HG1      GLU  85   2.164  10.980  -2.794
  229    H    ALA  86           HN       ALA  86  -0.168   8.798  -3.420
  230    HA   ALA  86           HA       ALA  86   0.953   6.580  -1.947
  231    HB1  ALA  86           HB1      ALA  86  -1.454   6.039  -1.969
  232    HB2  ALA  86           HB2      ALA  86  -0.499   4.893  -2.911
  233    HB3  ALA  86           HB3      ALA  86  -1.436   6.136  -3.731
  234    H    ARG  87           HN       ARG  87   2.845   6.658  -2.969
  235    HA   ARG  87           HA       ARG  87   2.868   7.336  -5.787
  236    HB2  ARG  87           HB2      ARG  87   5.234   7.049  -3.959
  237    HB3  ARG  87           HB1      ARG  87   5.164   7.890  -5.500
  238    HG2  ARG  87           HG2      ARG  87   3.504   8.710  -3.156
  239    HG3  ARG  87           HG1      ARG  87   5.165   9.256  -3.389
  240    HD2  ARG  87           HD2      ARG  87   4.499  10.107  -5.631
  241    HD3  ARG  87           HD1      ARG  87   2.836   9.653  -5.260
  242    HE   ARG  87           HE       ARG  87   3.323  11.255  -3.230
  243   HH11  ARG  87          HH11      ARG  87   4.286  11.669  -6.555
  244   HH12  ARG  87          HH12      ARG  87   4.115  13.396  -6.534
  245   HH21  ARG  87          HH21      ARG  87   3.124  13.525  -3.151
  246   HH22  ARG  87          HH22      ARG  87   3.472  14.457  -4.589
  247    H    TYR  88           HN       TYR  88   5.063   5.340  -3.966
  248    HA   TYR  88           HA       TYR  88   5.174   3.378  -6.122
  249    HB2  TYR  88           HB2      TYR  88   6.724   3.588  -3.534
  250    HB3  TYR  88           HB1      TYR  88   7.054   2.466  -4.838
  251    HD1  TYR  88           HD1      TYR  88   6.758   6.127  -4.218
  252    HD2  TYR  88           HD2      TYR  88   8.687   3.011  -6.365
  253    HE1  TYR  88           HE1      TYR  88   8.275   7.771  -5.236
  254    HE2  TYR  88           HE2      TYR  88  10.209   4.629  -7.381
  255    HH   TYR  88           HH       TYR  88  10.414   7.903  -6.281
  256    H    ARG  89           HN       ARG  89   4.639   1.161  -5.765
  257    HA   ARG  89           HA       ARG  89   3.707   0.573  -3.044
  258    HB2  ARG  89           HB2      ARG  89   2.062  -0.899  -3.745
  259    HB3  ARG  89           HB1      ARG  89   1.883   0.432  -4.867
  260    HG2  ARG  89           HG2      ARG  89   3.250  -0.885  -6.506
  261    HG3  ARG  89           HG1      ARG  89   3.157  -2.236  -5.366
  262    HD2  ARG  89           HD2      ARG  89   0.676  -2.002  -5.430
  263    HD3  ARG  89           HD1      ARG  89   0.882  -0.844  -6.745
  264    HE   ARG  89           HE       ARG  89   1.614  -3.704  -6.872
  265   HH11  ARG  89          HH11      ARG  89   0.875  -0.667  -8.447
  266   HH12  ARG  89          HH12      ARG  89   0.569  -1.398 -10.000
  267   HH21  ARG  89          HH21      ARG  89   1.236  -4.673  -8.888
  268   HH22  ARG  89          HH22      ARG  89   0.736  -3.702 -10.243
  269    H    CYS  90           HN       CYS  90   4.247  -1.359  -2.244
  270    HA   CYS  90           HA       CYS  90   6.535  -2.759  -3.189
  271    HB2  CYS  90           HB2      CYS  90   5.506  -2.691  -0.835
  272    HB3  CYS  90           HB1      CYS  90   4.332  -3.822  -1.430
  273    H    GLU  91           HN       GLU  91   6.393  -3.767  -5.187
  274    HA   GLU  91           HA       GLU  91   3.917  -4.644  -6.254
  275    HB2  GLU  91           HB2      GLU  91   5.269  -5.671  -8.050
  276    HB3  GLU  91           HB1      GLU  91   5.643  -3.971  -7.771
  277    HG2  GLU  91           HG2      GLU  91   7.548  -4.670  -6.429
  278    HG3  GLU  91           HG1      GLU  91   7.207  -6.346  -6.825
  279    H    ASP  92           HN       ASP  92   5.148  -5.760  -3.700
  280    HA   ASP  92           HA       ASP  92   4.871  -8.608  -4.291
  281    HB2  ASP  92           HB2      ASP  92   6.696  -8.838  -3.011
  282    HB3  ASP  92           HB1      ASP  92   6.718  -7.107  -2.702
  283    H    CYS  93           HN       CYS  93   3.862  -6.017  -1.988
  284    HA   CYS  93           HA       CYS  93   1.593  -7.748  -1.341
  285    HB2  CYS  93           HB2      CYS  93   1.892  -7.428   0.989
  286    HB3  CYS  93           HB1      CYS  93   3.471  -7.831   0.350
  287    H    GLY  94           HN       GLY  94   2.666  -4.768  -2.355
  288    HA2  GLY  94           HA2      GLY  94   1.456  -3.146  -3.337
  289    HA3  GLY  94           HA1      GLY  94  -0.022  -3.919  -2.796
  290    H    LYS  95           HN       LYS  95   2.654  -2.754  -0.826
  291    HA   LYS  95           HA       LYS  95   0.859  -0.918   0.523
  292    HB2  LYS  95           HB2      LYS  95   3.740  -1.609   1.083
  293    HB3  LYS  95           HB1      LYS  95   2.681  -0.654   2.120
  294    HG2  LYS  95           HG2      LYS  95   1.177  -2.731   2.051
  295    HG3  LYS  95           HG1      LYS  95   2.632  -3.564   1.509
  296    HD2  LYS  95           HD2      LYS  95   3.758  -3.168   3.467
  297    HD3  LYS  95           HD1      LYS  95   2.706  -1.828   3.936
  298    HE2  LYS  95           HE2      LYS  95   0.850  -3.439   4.212
  299    HE3  LYS  95           HE1      LYS  95   1.966  -4.754   3.854
  300    HZ1  LYS  95           HZ1      LYS  95   3.222  -4.228   5.818
  301    HZ2  LYS  95           HZ2      LYS  95   1.590  -4.426   6.244
  302    HZ3  LYS  95           HZ3      LYS  95   2.255  -2.872   6.133
  303    H    LEU  96           HN       LEU  96   0.932   1.239   0.211
  304    HA   LEU  96           HA       LEU  96   2.609   2.106  -2.005
  305    HB2  LEU  96           HB2      LEU  96   0.081   3.149  -0.786
  306    HB3  LEU  96           HB1      LEU  96   1.051   4.163  -1.852
  307    HG   LEU  96           HG       LEU  96  -0.786   3.127  -3.082
  308   HD11  LEU  96          HD11      LEU  96   0.486   2.101  -4.877
  309   HD12  LEU  96          HD12      LEU  96   1.867   1.904  -3.793
  310   HD13  LEU  96          HD13      LEU  96   1.320   3.523  -4.247
  311   HD21  LEU  96          HD21      LEU  96  -0.910   0.723  -3.416
  312   HD22  LEU  96          HD22      LEU  96  -1.093   1.132  -1.710
  313   HD23  LEU  96          HD23      LEU  96   0.440   0.491  -2.305
  314    H    PHE  97           HN       PHE  97   4.416   3.073  -1.588
  315    HA   PHE  97           HA       PHE  97   4.638   4.678   0.872
  316    HB2  PHE  97           HB2      PHE  97   6.836   3.407  -0.784
  317    HB3  PHE  97           HB1      PHE  97   7.080   4.398   0.646
  318    HD1  PHE  97           HD2      PHE  97   5.877   1.157  -0.578
  319    HD2  PHE  97           HD1      PHE  97   6.631   3.557   2.858
  320    HE1  PHE  97           HE2      PHE  97   5.595  -0.822   0.871
  321    HE2  PHE  97           HE1      PHE  97   6.356   1.580   4.299
  322    HZ   PHE  97           HZ       PHE  97   5.842  -0.608   3.299
  323    H    THR  98           HN       THR  98   5.344   6.735   0.776
  324    HA   THR  98           HA       THR  98   5.147   7.974  -1.858
  325    HB   THR  98           HB       THR  98   4.850  10.063  -0.632
  326    HG1  THR  98           HG1      THR  98   5.056  10.165   1.558
  327   HG21  THR  98          HG21      THR  98   2.922   8.652  -1.041
  328   HG22  THR  98          HG22      THR  98   2.755   9.439   0.533
  329   HG23  THR  98          HG23      THR  98   3.248   7.742   0.436
  330    H    THR  99           HN       THR  99   7.430   6.528  -0.396
  331    HA   THR  99           HA       THR  99   9.500   8.174  -1.568
  332    HB   THR  99           HB       THR  99   9.482   7.274   1.320
  333    HG1  THR  99           HG1      THR  99   8.734   9.506   0.266
  334   HG21  THR  99          HG21      THR  99  11.785   8.459  -0.221
  335   HG22  THR  99          HG22      THR  99  11.618   6.757   0.204
  336   HG23  THR  99          HG23      THR  99  11.780   7.970   1.476
  337    H    SER 100           HN       SER 100  10.832   6.873  -2.676
  338    HA   SER 100           HA       SER 100  10.322   4.119  -2.888
  339    HB2  SER 100           HB2      SER 100  12.314   4.122  -4.393
  340    HB3  SER 100           HB1      SER 100  11.121   5.364  -4.798
  341    HG   SER 100           HG       SER 100  13.643   5.750  -4.410
  342    H    GLY 101           HN       GLY 101  12.647   5.996  -1.051
  343    HA2  GLY 101           HA2      GLY 101  14.270   3.816  -0.233
  344    HA3  GLY 101           HA1      GLY 101  14.117   5.352   0.593
  345    H    ASN 102           HN       ASN 102  11.420   5.345   1.289
  346    HA   ASN 102           HA       ASN 102  11.223   3.659   3.530
  347    HB2  ASN 102           HB2      ASN 102   9.063   4.986   1.872
  348    HB3  ASN 102           HB1      ASN 102   8.738   4.113   3.358
  349   HD21  ASN 102          HD21      ASN 102   7.901   5.939   4.360
  350   HD22  ASN 102          HD22      ASN 102   8.909   7.234   4.900
  351    H    LEU 103           HN       LEU 103  10.222   3.418   0.226
  352    HA   LEU 103           HA       LEU 103   8.707   1.087   0.464
  353    HB2  LEU 103           HB2      LEU 103   8.442   2.477  -1.426
  354    HB3  LEU 103           HB1      LEU 103  10.171   2.454  -1.768
  355    HG   LEU 103           HG       LEU 103   9.951   0.034  -2.329
  356   HD11  LEU 103          HD11      LEU 103   7.849  -0.967  -2.595
  357   HD12  LEU 103          HD12      LEU 103   6.997   0.581  -2.406
  358   HD13  LEU 103          HD13      LEU 103   7.795  -0.182  -1.012
  359   HD21  LEU 103          HD21      LEU 103   8.464   2.173  -3.781
  360   HD22  LEU 103          HD22      LEU 103   8.714   0.562  -4.470
  361   HD23  LEU 103          HD23      LEU 103  10.100   1.586  -4.071
  362    H    LYS 104           HN       LYS 104  11.964   1.703  -0.681
  363    HA   LYS 104           HA       LYS 104  12.920  -0.785  -1.221
  364    HB2  LYS 104           HB2      LYS 104  14.131   1.756  -0.269
  365    HB3  LYS 104           HB1      LYS 104  15.147   0.322  -0.329
  366    HG2  LYS 104           HG2      LYS 104  14.627   0.056  -2.707
  367    HG3  LYS 104           HG1      LYS 104  13.607   1.500  -2.628
  368    HD2  LYS 104           HD2      LYS 104  15.518   2.870  -2.096
  369    HD3  LYS 104           HD1      LYS 104  16.558   1.446  -2.004
  370    HE2  LYS 104           HE2      LYS 104  16.254   1.017  -4.358
  371    HE3  LYS 104           HE1      LYS 104  15.086   2.329  -4.484
  372    HZ1  LYS 104           HZ1      LYS 104  17.354   2.883  -5.273
  373    HZ2  LYS 104           HZ2      LYS 104  17.915   2.721  -3.681
  374    HZ3  LYS 104           HZ3      LYS 104  16.781   3.918  -4.064
  375    H    ARG 105           HN       ARG 105  13.121   0.841   1.981
  376    HA   ARG 105           HA       ARG 105  14.456  -1.321   3.172
  377    HB2  ARG 105           HB2      ARG 105  13.857  -0.307   5.309
  378    HB3  ARG 105           HB1      ARG 105  14.489   0.866   4.168
  379    HG2  ARG 105           HG2      ARG 105  12.761   2.067   4.858
  380    HG3  ARG 105           HG1      ARG 105  11.877   1.111   3.678
  381    HD2  ARG 105           HD2      ARG 105  11.185  -0.446   5.382
  382    HD3  ARG 105           HD1      ARG 105  12.150   0.398   6.590
  383    HE   ARG 105           HE       ARG 105  10.474   2.326   5.689
  384   HH11  ARG 105          HH11      ARG 105  10.008  -0.892   6.981
  385   HH12  ARG 105          HH12      ARG 105   8.423  -0.560   7.613
  386   HH21  ARG 105          HH21      ARG 105   8.390   2.781   6.536
  387   HH22  ARG 105          HH22      ARG 105   7.491   1.529   7.339
  388    H    HIS 106           HN       HIS 106  11.093  -0.700   2.543
  389    HA   HIS 106           HA       HIS 106  10.135  -2.938   4.096
  390    HB2  HIS 106           HB2      HIS 106   8.649  -1.050   3.771
  391    HB3  HIS 106           HB1      HIS 106   8.801  -1.183   2.021
  392    HD1  HIS 106           HD1      HIS 106   7.211  -2.962   4.979
  393    HD2  HIS 106           HD2      HIS 106   7.167  -2.962   0.825
  394    HE1  HIS 106           HE1      HIS 106   5.310  -4.479   4.290
  395    H    GLN 107           HN       GLN 107  11.544  -2.576   1.034
  396    HA   GLN 107           HA       GLN 107  10.209  -4.801  -0.218
  397    HB2  GLN 107           HB2      GLN 107  12.684  -3.311  -1.143
  398    HB3  GLN 107           HB1      GLN 107  11.680  -4.369  -2.119
  399    HG2  GLN 107           HG2      GLN 107  10.178  -2.184  -1.010
  400    HG3  GLN 107           HG1      GLN 107  11.571  -1.627  -1.922
  401   HE21  GLN 107          HE21      GLN 107   8.510  -3.189  -2.096
  402   HE22  GLN 107          HE22      GLN 107   8.402  -3.225  -3.830
  403    H    LEU 108           HN       LEU 108  12.863  -3.973   1.680
  404    HA   LEU 108           HA       LEU 108  14.477  -6.303   1.173
  405    HB2  LEU 108           HB2      LEU 108  14.660  -3.981   3.048
  406    HB3  LEU 108           HB1      LEU 108  15.754  -5.347   3.170
  407    HG   LEU 108           HG       LEU 108  17.039  -4.642   1.478
  408   HD11  LEU 108          HD11      LEU 108  14.584  -3.636   0.044
  409   HD12  LEU 108          HD12      LEU 108  15.386  -5.186  -0.213
  410   HD13  LEU 108          HD13      LEU 108  16.224  -3.686  -0.614
  411   HD21  LEU 108          HD21      LEU 108  15.453  -2.119   1.907
  412   HD22  LEU 108          HD22      LEU 108  17.066  -2.222   1.199
  413   HD23  LEU 108          HD23      LEU 108  16.811  -2.674   2.888
  414    H    VAL 109           HN       VAL 109  12.064  -5.284   3.474
  415    HA   VAL 109           HA       VAL 109  12.772  -7.158   5.453
  416    HB   VAL 109           HB       VAL 109  10.624  -6.750   6.414
  417   HG11  VAL 109          HG11      VAL 109  12.205  -4.863   6.474
  418   HG12  VAL 109          HG12      VAL 109  10.520  -4.343   6.504
  419   HG13  VAL 109          HG13      VAL 109  11.450  -4.234   5.007
  420   HG21  VAL 109          HG21      VAL 109   8.853  -5.558   5.163
  421   HG22  VAL 109          HG22      VAL 109   9.248  -7.144   4.496
  422   HG23  VAL 109          HG23      VAL 109   9.869  -5.682   3.721
  423    H    HIS 110           HN       HIS 110  11.240  -7.361   2.384
  424    HA   HIS 110           HA       HIS 110  10.027  -9.960   2.952
  425    HB2  HIS 110           HB2      HIS 110  10.196  -8.261   0.487
  426    HB3  HIS 110           HB1      HIS 110   9.478  -9.850   0.483
  427    HD1  HIS 110           HD1      HIS 110   7.170 -10.088   1.756
  428    HD2  HIS 110           HD2      HIS 110   8.778  -6.275   1.523
  429    HE1  HIS 110           HE1      HIS 110   5.254  -8.473   2.164
  430    H    SER 111           HN       SER 111  13.113  -9.014   2.367
  431    HA   SER 111           HA       SER 111  13.964 -11.662   1.675
  432    HB2  SER 111           HB2      SER 111  13.290 -10.579  -0.551
  433    HB3  SER 111           HB1      SER 111  14.657  -9.491  -0.319
  434    HG   SER 111           HG       SER 111  15.954 -11.026  -0.918
  435    H    GLY 112           HN       GLY 112  14.334 -10.047   3.840
  436    HA2  GLY 112           HA2      GLY 112  17.183  -9.362   3.746
  437    HA3  GLY 112           HA1      GLY 112  16.002  -8.153   4.276
  Start of MODEL    7
    1    H    LYS  58           HT1      LYS  58 -17.475  -3.568  -6.051
    2    HA   LYS  58           HA       LYS  58 -18.465  -6.216  -5.168
    3    HB2  LYS  58           HB2      LYS  58 -16.096  -5.461  -6.896
    4    HB3  LYS  58           HB1      LYS  58 -16.396  -7.069  -6.253
    5    HG2  LYS  58           HG2      LYS  58 -18.520  -7.134  -7.511
    6    HG3  LYS  58           HG1      LYS  58 -18.111  -5.569  -8.217
    7    HD2  LYS  58           HD2      LYS  58 -17.507  -7.324  -9.759
    8    HD3  LYS  58           HD1      LYS  58 -16.039  -6.570  -9.132
    9    HE2  LYS  58           HE2      LYS  58 -15.795  -8.987  -9.192
   10    HE3  LYS  58           HE1      LYS  58 -15.790  -8.407  -7.528
   11    HZ1  LYS  58           HZ1      LYS  58 -17.155 -10.396  -7.802
   12    HZ2  LYS  58           HZ2      LYS  58 -18.142  -9.577  -8.918
   13    HZ3  LYS  58           HZ3      LYS  58 -18.090  -9.073  -7.301
   14    HA   PRO  59           HA       PRO  59 -16.050  -5.461  -1.567
   15    HB2  PRO  59           HB2      PRO  59 -15.218  -7.993  -0.989
   16    HB3  PRO  59           HB1      PRO  59 -16.850  -7.400  -0.651
   17    HG2  PRO  59           HG2      PRO  59 -15.868  -9.046  -2.943
   18    HG3  PRO  59           HG1      PRO  59 -17.362  -9.216  -2.004
   19    HD2  PRO  59           HD2      PRO  59 -17.317  -8.050  -4.433
   20    HD3  PRO  59           HD1      PRO  59 -18.421  -7.512  -3.155
   21    H    TYR  60           HN       TYR  60 -14.278  -4.442  -1.834
   22    HA   TYR  60           HA       TYR  60 -11.873  -5.899  -2.700
   23    HB2  TYR  60           HB2      TYR  60 -12.591  -3.025  -3.320
   24    HB3  TYR  60           HB1      TYR  60 -10.996  -3.723  -3.582
   25    HD1  TYR  60           HD2      TYR  60 -11.272  -6.165  -4.876
   26    HD2  TYR  60           HD1      TYR  60 -13.783  -2.757  -5.242
   27    HE1  TYR  60           HE2      TYR  60 -11.986  -6.929  -7.093
   28    HE2  TYR  60           HE1      TYR  60 -14.504  -3.514  -7.453
   29    HH   TYR  60           HH       TYR  60 -13.895  -6.635  -8.619
   30    H    GLY  61           HN       GLY  61 -10.984  -6.279  -0.749
   31    HA2  GLY  61           HA2      GLY  61 -11.190  -4.147   1.233
   32    HA3  GLY  61           HA1      GLY  61 -10.974  -5.851   1.591
   33    H    CYS  62           HN       CYS  62  -9.540  -3.536   2.456
   34    HA   CYS  62           HA       CYS  62  -6.903  -3.663   1.340
   35    HB2  CYS  62           HB2      CYS  62  -8.156  -1.817   2.851
   36    HB3  CYS  62           HB1      CYS  62  -7.365  -2.720   4.134
   37    H    GLU  63           HN       GLU  63  -6.136  -5.753   1.436
   38    HA   GLU  63           HA       GLU  63  -6.412  -7.499   3.646
   39    HB2  GLU  63           HB2      GLU  63  -4.225  -7.448   1.556
   40    HB3  GLU  63           HB1      GLU  63  -4.666  -8.812   2.569
   41    HG2  GLU  63           HG2      GLU  63  -6.467  -7.539   0.518
   42    HG3  GLU  63           HG1      GLU  63  -5.503  -8.991   0.255
   43    H    GLU  64           HN       GLU  64  -4.835  -4.692   3.354
   44    HA   GLU  64           HA       GLU  64  -2.427  -5.201   4.820
   45    HB2  GLU  64           HB2      GLU  64  -2.014  -3.519   3.390
   46    HB3  GLU  64           HB1      GLU  64  -3.701  -3.057   3.288
   47    HG2  GLU  64           HG2      GLU  64  -3.268  -2.072   5.662
   48    HG3  GLU  64           HG1      GLU  64  -1.579  -2.111   5.134
   49    H    CYS  65           HN       CYS  65  -5.626  -3.793   5.475
   50    HA   CYS  65           HA       CYS  65  -4.858  -3.614   8.295
   51    HB2  CYS  65           HB2      CYS  65  -6.425  -1.565   8.345
   52    HB3  CYS  65           HB1      CYS  65  -4.795  -1.363   7.702
   53    H    GLY  66           HN       GLY  66  -7.091  -4.576   5.936
   54    HA2  GLY  66           HA2      GLY  66  -8.522  -6.333   6.290
   55    HA3  GLY  66           HA1      GLY  66  -8.539  -5.955   8.007
   56    H    LYS  67           HN       LYS  67  -9.121  -3.436   5.683
   57    HA   LYS  67           HA       LYS  67 -11.996  -3.548   6.325
   58    HB2  LYS  67           HB2      LYS  67 -10.276  -1.187   5.557
   59    HB3  LYS  67           HB1      LYS  67 -12.027  -1.126   5.690
   60    HG2  LYS  67           HG2      LYS  67 -11.725  -1.908   8.084
   61    HG3  LYS  67           HG1      LYS  67 -10.010  -1.554   7.870
   62    HD2  LYS  67           HD2      LYS  67 -11.189   0.333   8.894
   63    HD3  LYS  67           HD1      LYS  67 -10.547   0.759   7.305
   64    HE2  LYS  67           HE2      LYS  67 -12.738   0.435   6.306
   65    HE3  LYS  67           HE1      LYS  67 -13.392  -0.077   7.858
   66    HZ1  LYS  67           HZ1      LYS  67 -13.927   2.230   7.338
   67    HZ2  LYS  67           HZ2      LYS  67 -12.276   2.615   7.284
   68    HZ3  LYS  67           HZ3      LYS  67 -12.984   2.109   8.741
   69    H    SER  68           HN       SER  68 -13.256  -4.232   4.706
   70    HA   SER  68           HA       SER  68 -12.252  -4.199   1.987
   71    HB2  SER  68           HB2      SER  68 -15.018  -5.079   2.333
   72    HB3  SER  68           HB1      SER  68 -13.641  -5.930   1.626
   73    HG   SER  68           HG       SER  68 -12.954  -6.477   3.725
   74    H    TYR  69           HN       TYR  69 -12.975  -2.968   0.350
   75    HA   TYR  69           HA       TYR  69 -15.032  -0.963   1.009
   76    HB2  TYR  69           HB2      TYR  69 -12.543  -0.735  -0.646
   77    HB3  TYR  69           HB1      TYR  69 -13.918   0.311  -0.974
   78    HD1  TYR  69           HD2      TYR  69 -11.585  -0.757   1.684
   79    HD2  TYR  69           HD1      TYR  69 -14.310   2.206   0.347
   80    HE1  TYR  69           HE2      TYR  69 -10.844   0.712   3.495
   81    HE2  TYR  69           HE1      TYR  69 -13.575   3.702   2.139
   82    HH   TYR  69           HH       TYR  69 -10.755   3.121   3.979
   83    H    ARG  70           HN       ARG  70 -15.928   0.004  -1.175
   84    HA   ARG  70           HA       ARG  70 -17.282  -2.305  -2.347
   85    HB2  ARG  70           HB2      ARG  70 -18.114   0.565  -2.685
   86    HB3  ARG  70           HB1      ARG  70 -19.102  -0.883  -2.818
   87    HG2  ARG  70           HG2      ARG  70 -17.961   0.305  -0.302
   88    HG3  ARG  70           HG1      ARG  70 -19.653   0.284  -0.796
   89    HD2  ARG  70           HD2      ARG  70 -18.003  -2.182  -0.249
   90    HD3  ARG  70           HD1      ARG  70 -19.056  -1.409   0.935
   91    HE   ARG  70           HE       ARG  70 -20.605  -1.920  -1.320
   92   HH11  ARG  70          HH11      ARG  70 -18.782  -3.748   1.057
   93   HH12  ARG  70          HH12      ARG  70 -19.849  -5.123   1.007
   94   HH21  ARG  70          HH21      ARG  70 -22.000  -3.742  -1.404
   95   HH22  ARG  70          HH22      ARG  70 -21.671  -5.115  -0.395
   96    H    LEU  71           HN       LEU  71 -15.504   0.612  -3.305
   97    HA   LEU  71           HA       LEU  71 -15.503  -0.410  -6.058
   98    HB2  LEU  71           HB2      LEU  71 -14.902   2.395  -5.105
   99    HB3  LEU  71           HB1      LEU  71 -14.905   1.853  -6.774
  100    HG   LEU  71           HG       LEU  71 -16.941   2.775  -6.782
  101   HD11  LEU  71          HD11      LEU  71 -18.751   1.267  -6.384
  102   HD12  LEU  71          HD12      LEU  71 -17.744   0.302  -5.304
  103   HD13  LEU  71          HD13      LEU  71 -17.376   0.369  -7.030
  104   HD21  LEU  71          HD21      LEU  71 -16.646   3.717  -4.528
  105   HD22  LEU  71          HD22      LEU  71 -17.343   2.239  -3.865
  106   HD23  LEU  71          HD23      LEU  71 -18.312   3.283  -4.901
  107    H    ILE  72           HN       ILE  72 -13.477  -0.140  -7.270
  108    HA   ILE  72           HA       ILE  72 -11.179  -0.913  -5.802
  109    HB   ILE  72           HB       ILE  72 -11.580  -0.027  -8.648
  110   HG12  ILE  72          HG12      ILE  72 -12.213  -2.316  -7.882
  111   HG13  ILE  72          HG11      ILE  72 -10.995  -2.309  -9.154
  112   HG21  ILE  72          HG21      ILE  72  -9.416   0.874  -8.015
  113   HG22  ILE  72          HG22      ILE  72  -9.213  -0.512  -9.088
  114   HG23  ILE  72          HG23      ILE  72  -8.943  -0.693  -7.355
  115   HD11  ILE  72          HD11      ILE  72 -10.481  -2.691  -6.208
  116   HD12  ILE  72          HD12      ILE  72  -9.257  -2.698  -7.481
  117   HD13  ILE  72          HD13      ILE  72 -10.491  -3.958  -7.435
  118    H    SER  73           HN       SER  73 -12.132   2.146  -7.336
  119    HA   SER  73           HA       SER  73  -9.880   3.622  -6.553
  120    HB2  SER  73           HB2      SER  73 -11.493   4.387  -8.267
  121    HB3  SER  73           HB1      SER  73 -12.710   4.607  -7.012
  122    HG   SER  73           HG       SER  73 -10.303   6.048  -7.416
  123    H    LEU  74           HN       LEU  74 -12.906   2.948  -4.889
  124    HA   LEU  74           HA       LEU  74 -12.675   4.542  -2.669
  125    HB2  LEU  74           HB2      LEU  74 -14.118   2.203  -3.484
  126    HB3  LEU  74           HB1      LEU  74 -13.555   1.975  -1.834
  127    HG   LEU  74           HG       LEU  74 -15.337   4.165  -2.864
  128   HD11  LEU  74          HD11      LEU  74 -15.753   2.060  -0.743
  129   HD12  LEU  74          HD12      LEU  74 -16.375   1.962  -2.390
  130   HD13  LEU  74          HD13      LEU  74 -16.936   3.239  -1.307
  131   HD21  LEU  74          HD21      LEU  74 -15.271   4.890  -0.460
  132   HD22  LEU  74          HD22      LEU  74 -13.802   5.172  -1.401
  133   HD23  LEU  74          HD23      LEU  74 -13.877   3.815  -0.277
  134    H    LEU  75           HN       LEU  75 -11.508   1.285  -3.071
  135    HA   LEU  75           HA       LEU  75 -10.226   1.142  -0.567
  136    HB2  LEU  75           HB2      LEU  75 -10.903  -0.865  -1.572
  137    HB3  LEU  75           HB1      LEU  75 -10.180  -0.428  -3.116
  138    HG   LEU  75           HG       LEU  75  -7.939  -0.617  -1.993
  139   HD11  LEU  75          HD11      LEU  75  -9.623  -1.910   0.146
  140   HD12  LEU  75          HD12      LEU  75  -8.687  -0.417   0.306
  141   HD13  LEU  75          HD13      LEU  75  -7.859  -1.959   0.054
  142   HD21  LEU  75          HD21      LEU  75  -8.823  -2.254  -3.506
  143   HD22  LEU  75          HD22      LEU  75  -9.742  -3.010  -2.200
  144   HD23  LEU  75          HD23      LEU  75  -7.972  -3.064  -2.185
  145    H    ASN  76           HN       ASN  76  -9.418   2.186  -3.726
  146    HA   ASN  76           HA       ASN  76  -6.578   2.055  -3.512
  147    HB2  ASN  76           HB2      ASN  76  -8.352   2.455  -5.570
  148    HB3  ASN  76           HB1      ASN  76  -7.690   4.072  -5.342
  149   HD21  ASN  76          HD21      ASN  76  -7.035   0.795  -6.209
  150   HD22  ASN  76          HD22      ASN  76  -5.459   1.066  -6.879
  151    H    LEU  77           HN       LEU  77  -9.035   4.551  -3.103
  152    HA   LEU  77           HA       LEU  77  -7.057   6.529  -2.489
  153    HB2  LEU  77           HB2      LEU  77  -9.992   6.412  -2.825
  154    HB3  LEU  77           HB1      LEU  77  -9.343   7.709  -1.845
  155    HG   LEU  77           HG       LEU  77  -9.707   8.354  -4.208
  156   HD11  LEU  77          HD11      LEU  77  -6.828   8.298  -3.363
  157   HD12  LEU  77          HD12      LEU  77  -8.039   9.446  -2.800
  158   HD13  LEU  77          HD13      LEU  77  -7.562   9.430  -4.499
  159   HD21  LEU  77          HD21      LEU  77  -9.214   6.217  -5.284
  160   HD22  LEU  77          HD22      LEU  77  -7.528   6.344  -4.785
  161   HD23  LEU  77          HD23      LEU  77  -8.196   7.500  -5.939
  162    H    HIS  78           HN       HIS  78  -8.998   4.238  -0.777
  163    HA   HIS  78           HA       HIS  78  -8.660   5.280   1.836
  164    HB2  HIS  78           HB2      HIS  78 -10.169   3.495   1.741
  165    HB3  HIS  78           HB1      HIS  78  -9.125   2.543   0.682
  166    HD1  HIS  78           HD1      HIS  78  -9.411   3.558   4.344
  167    HD2  HIS  78           HD2      HIS  78  -7.513   0.752   1.929
  168    HE1  HIS  78           HE1      HIS  78  -8.322   1.895   5.905
  169    H    LYS  79           HN       LYS  79  -6.713   3.178  -0.219
  170    HA   LYS  79           HA       LYS  79  -4.611   2.797   1.632
  171    HB2  LYS  79           HB2      LYS  79  -5.180   1.445  -0.447
  172    HB3  LYS  79           HB1      LYS  79  -4.410   2.726  -1.372
  173    HG2  LYS  79           HG2      LYS  79  -2.305   2.215  -0.574
  174    HG3  LYS  79           HG1      LYS  79  -2.938   1.370   0.842
  175    HD2  LYS  79           HD2      LYS  79  -3.278   0.426  -1.999
  176    HD3  LYS  79           HD1      LYS  79  -2.015  -0.143  -0.905
  177    HE2  LYS  79           HE2      LYS  79  -4.893  -0.258  -0.096
  178    HE3  LYS  79           HE1      LYS  79  -4.213  -1.503  -1.135
  179    HZ1  LYS  79           HZ1      LYS  79  -2.615  -2.051   0.536
  180    HZ2  LYS  79           HZ2      LYS  79  -4.146  -2.045   1.262
  181    HZ3  LYS  79           HZ3      LYS  79  -3.085  -0.748   1.512
  182    H    LYS  80           HN       LYS  80  -5.323   5.212  -0.825
  183    HA   LYS  80           HA       LYS  80  -3.023   6.788  -0.553
  184    HB2  LYS  80           HB2      LYS  80  -5.744   7.147  -1.569
  185    HB3  LYS  80           HB1      LYS  80  -5.054   8.619  -0.901
  186    HG2  LYS  80           HG2      LYS  80  -4.582   8.617  -3.203
  187    HG3  LYS  80           HG1      LYS  80  -3.070   8.235  -2.375
  188    HD2  LYS  80           HD2      LYS  80  -3.429   5.853  -2.850
  189    HD3  LYS  80           HD1      LYS  80  -4.931   6.253  -3.692
  190    HE2  LYS  80           HE2      LYS  80  -3.620   7.689  -5.221
  191    HE3  LYS  80           HE1      LYS  80  -2.149   7.122  -4.434
  192    HZ1  LYS  80           HZ1      LYS  80  -2.873   4.822  -5.082
  193    HZ2  LYS  80           HZ2      LYS  80  -2.432   5.835  -6.365
  194    HZ3  LYS  80           HZ3      LYS  80  -4.071   5.543  -6.047
  195    H    ARG  81           HN       ARG  81  -6.084   6.806   1.283
  196    HA   ARG  81           HA       ARG  81  -5.651   9.074   2.820
  197    HB2  ARG  81           HB2      ARG  81  -7.083   6.529   3.588
  198    HB3  ARG  81           HB1      ARG  81  -7.229   8.059   4.426
  199    HG2  ARG  81           HG2      ARG  81  -7.989   7.547   1.579
  200    HG3  ARG  81           HG1      ARG  81  -9.106   7.663   2.937
  201    HD2  ARG  81           HD2      ARG  81  -7.247   9.878   2.097
  202    HD3  ARG  81           HD1      ARG  81  -8.908   9.732   1.527
  203    HE   ARG  81           HE       ARG  81  -9.244   9.685   4.188
  204   HH11  ARG  81          HH11      ARG  81  -7.278  11.798   2.187
  205   HH12  ARG  81          HH12      ARG  81  -7.550  13.191   3.187
  206   HH21  ARG  81          HH21      ARG  81  -9.581  11.520   5.503
  207   HH22  ARG  81          HH22      ARG  81  -8.843  13.034   5.073
  208    H    HIS  82           HN       HIS  82  -4.254   5.923   3.149
  209    HA   HIS  82           HA       HIS  82  -3.437   6.085   5.843
  210    HB2  HIS  82           HB2      HIS  82  -2.516   4.452   3.511
  211    HB3  HIS  82           HB1      HIS  82  -1.651   4.390   5.027
  212    HD1  HIS  82           HD1      HIS  82  -2.965   3.353   7.068
  213    HD2  HIS  82           HD2      HIS  82  -4.832   3.095   3.381
  214    HE1  HIS  82           HE1      HIS  82  -4.777   1.635   7.317
  215    H    SER  83           HN       SER  83  -1.747   7.022   2.843
  216    HA   SER  83           HA       SER  83   0.208   8.423   4.538
  217    HB2  SER  83           HB2      SER  83   1.886   7.771   2.653
  218    HB3  SER  83           HB1      SER  83   1.475   6.584   3.891
  219    HG   SER  83           HG       SER  83   0.388   6.774   1.266
  220    H    GLY  84           HN       GLY  84  -2.115   9.474   3.164
  221    HA2  GLY  84           HA2      GLY  84  -2.562  11.455   2.038
  222    HA3  GLY  84           HA1      GLY  84  -0.845  11.604   1.681
  223    H    GLU  85           HN       GLU  85  -0.098   9.660   0.217
  224    HA   GLU  85           HA       GLU  85  -2.141   8.976  -1.742
  225    HB2  GLU  85           HB2      GLU  85  -0.467   9.316  -3.554
  226    HB3  GLU  85           HB1      GLU  85  -0.953  10.804  -2.760
  227    HG2  GLU  85           HG2      GLU  85   1.480   9.380  -1.837
  228    HG3  GLU  85           HG1      GLU  85   1.542  10.349  -3.304
  229    H    ALA  86           HN       ALA  86  -0.707   7.450  -3.379
  230    HA   ALA  86           HA       ALA  86   0.883   5.562  -1.838
  231    HB1  ALA  86           HB1      ALA  86  -1.409   4.752  -1.555
  232    HB2  ALA  86           HB2      ALA  86  -0.465   3.646  -2.551
  233    HB3  ALA  86           HB3      ALA  86  -1.627   4.738  -3.305
  234    H    ARG  87           HN       ARG  87   2.662   5.701  -3.060
  235    HA   ARG  87           HA       ARG  87   2.378   6.106  -5.928
  236    HB2  ARG  87           HB2      ARG  87   4.898   6.334  -4.317
  237    HB3  ARG  87           HB1      ARG  87   4.553   7.037  -5.889
  238    HG2  ARG  87           HG2      ARG  87   3.047   7.759  -3.404
  239    HG3  ARG  87           HG1      ARG  87   4.538   8.557  -3.898
  240    HD2  ARG  87           HD2      ARG  87   2.062   8.351  -5.602
  241    HD3  ARG  87           HD1      ARG  87   2.448   9.737  -4.586
  242    HE   ARG  87           HE       ARG  87   4.651   9.425  -6.179
  243   HH11  ARG  87          HH11      ARG  87   1.216   9.788  -6.755
  244   HH12  ARG  87          HH12      ARG  87   1.421  10.676  -8.240
  245   HH21  ARG  87          HH21      ARG  87   4.933  10.592  -8.138
  246   HH22  ARG  87          HH22      ARG  87   3.535  11.158  -9.007
  247    H    TYR  88           HN       TYR  88   5.007   4.641  -4.181
  248    HA   TYR  88           HA       TYR  88   5.296   2.573  -6.201
  249    HB2  TYR  88           HB2      TYR  88   6.899   3.153  -3.705
  250    HB3  TYR  88           HB1      TYR  88   7.337   2.018  -4.967
  251    HD1  TYR  88           HD1      TYR  88   6.513   5.625  -4.547
  252    HD2  TYR  88           HD2      TYR  88   8.828   2.692  -6.562
  253    HE1  TYR  88           HE1      TYR  88   7.735   7.403  -5.694
  254    HE2  TYR  88           HE2      TYR  88  10.071   4.465  -7.723
  255    HH   TYR  88           HH       TYR  88   9.829   6.798  -8.343
  256    H    ARG  89           HN       ARG  89   5.271   0.295  -5.674
  257    HA   ARG  89           HA       ARG  89   4.331  -0.255  -2.944
  258    HB2  ARG  89           HB2      ARG  89   2.975  -2.029  -3.628
  259    HB3  ARG  89           HB1      ARG  89   2.628  -0.739  -4.772
  260    HG2  ARG  89           HG2      ARG  89   4.143  -1.819  -6.395
  261    HG3  ARG  89           HG1      ARG  89   4.384  -3.134  -5.237
  262    HD2  ARG  89           HD2      ARG  89   1.896  -3.442  -5.243
  263    HD3  ARG  89           HD1      ARG  89   1.845  -2.322  -6.607
  264    HE   ARG  89           HE       ARG  89   3.620  -4.100  -7.493
  265   HH11  ARG  89          HH11      ARG  89   0.502  -4.606  -5.944
  266   HH12  ARG  89          HH12      ARG  89   0.225  -6.124  -6.747
  267   HH21  ARG  89          HH21      ARG  89   3.240  -6.078  -8.531
  268   HH22  ARG  89          HH22      ARG  89   1.783  -6.963  -8.209
  269    H    CYS  90           HN       CYS  90   5.160  -1.979  -1.948
  270    HA   CYS  90           HA       CYS  90   7.737  -2.949  -2.498
  271    HB2  CYS  90           HB2      CYS  90   6.414  -3.017  -0.324
  272    HB3  CYS  90           HB1      CYS  90   5.546  -4.364  -0.992
  273    H    GLU  91           HN       GLU  91   8.353  -4.395  -4.035
  274    HA   GLU  91           HA       GLU  91   6.420  -5.554  -5.765
  275    HB2  GLU  91           HB2      GLU  91   8.386  -6.618  -6.856
  276    HB3  GLU  91           HB1      GLU  91   8.505  -4.868  -6.688
  277    HG2  GLU  91           HG2      GLU  91   9.981  -5.063  -4.848
  278    HG3  GLU  91           HG1      GLU  91   9.716  -6.798  -4.788
  279    H    ASP  92           HN       ASP  92   7.010  -6.397  -2.769
  280    HA   ASP  92           HA       ASP  92   6.898  -9.277  -3.326
  281    HB2  ASP  92           HB2      ASP  92   8.463  -9.643  -1.771
  282    HB3  ASP  92           HB1      ASP  92   8.731  -7.905  -1.739
  283    H    CYS  93           HN       CYS  93   5.562  -6.644  -1.273
  284    HA   CYS  93           HA       CYS  93   3.433  -8.529  -0.602
  285    HB2  CYS  93           HB2      CYS  93   3.579  -8.059   1.686
  286    HB3  CYS  93           HB1      CYS  93   5.248  -8.214   1.181
  287    H    GLY  94           HN       GLY  94   4.227  -5.718  -2.018
  288    HA2  GLY  94           HA2      GLY  94   2.932  -4.212  -3.069
  289    HA3  GLY  94           HA1      GLY  94   1.515  -5.084  -2.494
  290    H    LYS  95           HN       LYS  95   3.970  -3.659  -0.448
  291    HA   LYS  95           HA       LYS  95   2.110  -1.973   0.879
  292    HB2  LYS  95           HB2      LYS  95   4.943  -2.801   1.107
  293    HB3  LYS  95           HB1      LYS  95   4.486  -1.284   1.843
  294    HG2  LYS  95           HG2      LYS  95   2.886  -3.715   2.344
  295    HG3  LYS  95           HG1      LYS  95   4.397  -3.439   3.230
  296    HD2  LYS  95           HD2      LYS  95   3.558  -1.692   4.374
  297    HD3  LYS  95           HD1      LYS  95   2.639  -1.135   2.976
  298    HE2  LYS  95           HE2      LYS  95   1.183  -1.816   4.859
  299    HE3  LYS  95           HE1      LYS  95   0.915  -2.789   3.415
  300    HZ1  LYS  95           HZ1      LYS  95   1.034  -4.048   5.553
  301    HZ2  LYS  95           HZ2      LYS  95   2.682  -3.647   5.640
  302    HZ3  LYS  95           HZ3      LYS  95   2.101  -4.587   4.349
  303    H    LEU  96           HN       LEU  96   1.703   0.106   0.364
  304    HA   LEU  96           HA       LEU  96   3.144   1.205  -1.902
  305    HB2  LEU  96           HB2      LEU  96   0.603   2.009  -0.521
  306    HB3  LEU  96           HB1      LEU  96   1.367   3.030  -1.734
  307    HG   LEU  96           HG       LEU  96  -0.414   1.782  -2.766
  308   HD11  LEU  96          HD11      LEU  96   0.784   0.609  -4.526
  309   HD12  LEU  96          HD12      LEU  96   2.237   0.581  -3.525
  310   HD13  LEU  96          HD13      LEU  96   1.594   2.120  -4.109
  311   HD21  LEU  96          HD21      LEU  96  -0.385  -0.672  -2.858
  312   HD22  LEU  96          HD22      LEU  96  -0.608  -0.056  -1.220
  313   HD23  LEU  96          HD23      LEU  96   0.966  -0.675  -1.723
  314    H    PHE  97           HN       PHE  97   4.629   2.671  -1.789
  315    HA   PHE  97           HA       PHE  97   4.783   4.350   0.634
  316    HB2  PHE  97           HB2      PHE  97   7.118   3.225  -0.936
  317    HB3  PHE  97           HB1      PHE  97   7.247   4.357   0.403
  318    HD1  PHE  97           HD2      PHE  97   6.335   0.923  -0.527
  319    HD2  PHE  97           HD1      PHE  97   6.991   3.660   2.663
  320    HE1  PHE  97           HE2      PHE  97   6.411  -0.952   1.066
  321    HE2  PHE  97           HE1      PHE  97   7.087   1.783   4.259
  322    HZ   PHE  97           HZ       PHE  97   6.553  -0.494   3.487
  323    H    THR  98           HN       THR  98   5.249   6.460   0.366
  324    HA   THR  98           HA       THR  98   4.754   7.493  -2.297
  325    HB   THR  98           HB       THR  98   4.456   9.635  -1.130
  326    HG1  THR  98           HG1      THR  98   4.476   9.150   1.365
  327   HG21  THR  98          HG21      THR  98   2.613   8.033  -1.285
  328   HG22  THR  98          HG22      THR  98   2.529   8.940   0.230
  329   HG23  THR  98          HG23      THR  98   3.140   7.280   0.221
  330    H    THR  99           HN       THR  99   7.327   6.440  -0.757
  331    HA   THR  99           HA       THR  99   9.136   8.136  -2.270
  332    HB   THR  99           HB       THR  99   9.351   7.526   0.681
  333    HG1  THR  99           HG1      THR  99   8.450   9.630  -0.718
  334   HG21  THR  99          HG21      THR  99  11.478   7.199  -0.547
  335   HG22  THR  99          HG22      THR  99  11.532   8.485   0.662
  336   HG23  THR  99          HG23      THR  99  11.395   8.886  -1.052
  337    H    SER 100           HN       SER 100  10.578   6.913  -3.310
  338    HA   SER 100           HA       SER 100  10.359   4.101  -3.290
  339    HB2  SER 100           HB2      SER 100  12.394   4.296  -4.839
  340    HB3  SER 100           HB1      SER 100  10.906   5.107  -5.348
  341    HG   SER 100           HG       SER 100  13.093   6.279  -5.352
  342    H    GLY 101           HN       GLY 101  12.532   6.344  -1.728
  343    HA2  GLY 101           HA2      GLY 101  14.410   4.377  -0.868
  344    HA3  GLY 101           HA1      GLY 101  14.219   5.985  -0.206
  345    H    ASN 102           HN       ASN 102  11.579   5.895   0.681
  346    HA   ASN 102           HA       ASN 102  11.675   4.492   3.110
  347    HB2  ASN 102           HB2      ASN 102   9.291   5.421   1.496
  348    HB3  ASN 102           HB1      ASN 102   9.169   4.735   3.103
  349   HD21  ASN 102          HD21      ASN 102  11.701   6.072   3.922
  350   HD22  ASN 102          HD22      ASN 102  11.262   7.724   4.201
  351    H    LEU 103           HN       LEU 103  10.492   3.782  -0.052
  352    HA   LEU 103           HA       LEU 103   9.182   1.386   0.524
  353    HB2  LEU 103           HB2      LEU 103   8.660   2.436  -1.483
  354    HB3  LEU 103           HB1      LEU 103  10.352   2.704  -1.888
  355    HG   LEU 103           HG       LEU 103  10.551   0.216  -2.214
  356   HD11  LEU 103          HD11      LEU 103   8.667  -1.131  -2.336
  357   HD12  LEU 103          HD12      LEU 103   7.562   0.261  -2.414
  358   HD13  LEU 103          HD13      LEU 103   8.378  -0.149  -0.894
  359   HD21  LEU 103          HD21      LEU 103   8.733   1.919  -3.868
  360   HD22  LEU 103          HD22      LEU 103   9.385   0.374  -4.416
  361   HD23  LEU 103          HD23      LEU 103  10.471   1.716  -4.045
  362    H    LYS 104           HN       LYS 104  12.344   2.158  -0.789
  363    HA   LYS 104           HA       LYS 104  13.474  -0.298  -1.156
  364    HB2  LYS 104           HB2      LYS 104  14.467   1.806  -1.852
  365    HB3  LYS 104           HB1      LYS 104  14.698   2.287  -0.180
  366    HG2  LYS 104           HG2      LYS 104  16.197   0.284   0.071
  367    HG3  LYS 104           HG1      LYS 104  16.118   0.119  -1.688
  368    HD2  LYS 104           HD2      LYS 104  16.916   2.685  -0.343
  369    HD3  LYS 104           HD1      LYS 104  18.090   1.426  -0.729
  370    HE2  LYS 104           HE2      LYS 104  16.247   2.654  -2.767
  371    HE3  LYS 104           HE1      LYS 104  17.862   3.274  -2.427
  372    HZ1  LYS 104           HZ1      LYS 104  17.936   1.801  -4.303
  373    HZ2  LYS 104           HZ2      LYS 104  17.194   0.554  -3.426
  374    HZ3  LYS 104           HZ3      LYS 104  18.751   1.077  -3.006
  375    H    ARG 105           HN       ARG 105  13.550   1.669   1.833
  376    HA   ARG 105           HA       ARG 105  15.069  -0.093   3.367
  377    HB2  ARG 105           HB2      ARG 105  12.785   1.628   4.358
  378    HB3  ARG 105           HB1      ARG 105  14.111   0.995   5.324
  379    HG2  ARG 105           HG2      ARG 105  14.283   3.060   3.143
  380    HG3  ARG 105           HG1      ARG 105  14.485   3.317   4.874
  381    HD2  ARG 105           HD2      ARG 105  16.292   1.805   3.001
  382    HD3  ARG 105           HD1      ARG 105  16.656   3.277   3.902
  383    HE   ARG 105           HE       ARG 105  16.026   0.880   5.445
  384   HH11  ARG 105          HH11      ARG 105  18.411   3.172   4.316
  385   HH12  ARG 105          HH12      ARG 105  19.676   2.555   5.330
  386   HH21  ARG 105          HH21      ARG 105  17.675   0.044   6.767
  387   HH22  ARG 105          HH22      ARG 105  19.260   0.770   6.732
  388    H    HIS 106           HN       HIS 106  11.579   0.062   2.851
  389    HA   HIS 106           HA       HIS 106  10.937  -2.142   4.519
  390    HB2  HIS 106           HB2      HIS 106   9.260  -0.476   3.937
  391    HB3  HIS 106           HB1      HIS 106   9.420  -0.874   2.228
  392    HD1  HIS 106           HD1      HIS 106   7.934  -2.201   5.443
  393    HD2  HIS 106           HD2      HIS 106   8.086  -3.071   1.386
  394    HE1  HIS 106           HE1      HIS 106   6.192  -3.989   5.036
  395    H    GLN 107           HN       GLN 107  12.290  -1.966   1.380
  396    HA   GLN 107           HA       GLN 107  11.355  -4.538   0.500
  397    HB2  GLN 107           HB2      GLN 107  13.582  -2.799  -0.595
  398    HB3  GLN 107           HB1      GLN 107  12.815  -4.143  -1.422
  399    HG2  GLN 107           HG2      GLN 107  11.078  -1.941  -0.567
  400    HG3  GLN 107           HG1      GLN 107  12.231  -1.608  -1.857
  401   HE21  GLN 107          HE21      GLN 107  10.751  -1.374  -3.392
  402   HE22  GLN 107          HE22      GLN 107   9.821  -2.682  -4.069
  403    H    LEU 108           HN       LEU 108  13.901  -3.033   2.178
  404    HA   LEU 108           HA       LEU 108  15.847  -5.129   1.935
  405    HB2  LEU 108           HB2      LEU 108  15.676  -2.521   3.369
  406    HB3  LEU 108           HB1      LEU 108  16.955  -3.662   3.751
  407    HG   LEU 108           HG       LEU 108  18.145  -3.159   1.910
  408   HD11  LEU 108          HD11      LEU 108  16.515  -4.227   0.431
  409   HD12  LEU 108          HD12      LEU 108  17.227  -2.785  -0.298
  410   HD13  LEU 108          HD13      LEU 108  15.593  -2.724   0.374
  411   HD21  LEU 108          HD21      LEU 108  17.689  -0.994   2.896
  412   HD22  LEU 108          HD22      LEU 108  16.228  -0.839   1.913
  413   HD23  LEU 108          HD23      LEU 108  17.819  -0.857   1.141
  414    H    VAL 109           HN       VAL 109  13.286  -4.317   4.064
  415    HA   VAL 109           HA       VAL 109  14.337  -5.812   6.247
  416    HB   VAL 109           HB       VAL 109  12.196  -5.503   7.272
  417   HG11  VAL 109          HG11      VAL 109  12.708  -3.101   5.549
  418   HG12  VAL 109          HG12      VAL 109  13.571  -3.476   7.048
  419   HG13  VAL 109          HG13      VAL 109  11.842  -3.121   7.088
  420   HG21  VAL 109          HG21      VAL 109  10.265  -4.654   6.009
  421   HG22  VAL 109          HG22      VAL 109  10.806  -6.241   5.455
  422   HG23  VAL 109          HG23      VAL 109  11.223  -4.795   4.530
  423    H    HIS 110           HN       HIS 110  12.740  -6.483   3.290
  424    HA   HIS 110           HA       HIS 110  11.874  -9.138   4.149
  425    HB2  HIS 110           HB2      HIS 110  11.783  -7.686   1.522
  426    HB3  HIS 110           HB1      HIS 110  11.301  -9.353   1.680
  427    HD1  HIS 110           HD1      HIS 110   9.012  -9.797   2.880
  428    HD2  HIS 110           HD2      HIS 110  10.117  -5.830   2.460
  429    HE1  HIS 110           HE1      HIS 110   6.895  -8.426   3.178
  430    H    SER 111           HN       SER 111  14.770  -7.780   3.191
  431    HA   SER 111           HA       SER 111  15.990 -10.342   2.695
  432    HB2  SER 111           HB2      SER 111  16.941  -9.571   0.453
  433    HB3  SER 111           HB1      SER 111  15.233 -10.011   0.458
  434    HG   SER 111           HG       SER 111  14.710  -7.817   0.539
  435    H    GLY 112           HN       GLY 112  16.369  -8.541   4.711
  436    HA2  GLY 112           HA2      GLY 112  18.845  -7.103   4.009
  437    HA3  GLY 112           HA1      GLY 112  17.667  -6.537   5.196
  Start of MODEL    8
    1    H    LYS  58           HT1      LYS  58 -17.161  -7.541  -6.263
    2    HA   LYS  58           HA       LYS  58 -17.006  -8.603  -4.079
    3    HB2  LYS  58           HB2      LYS  58 -15.483  -9.250  -5.939
    4    HB3  LYS  58           HB1      LYS  58 -14.325  -8.048  -5.386
    5    HG2  LYS  58           HG2      LYS  58 -14.198  -9.272  -3.215
    6    HG3  LYS  58           HG1      LYS  58 -15.204 -10.533  -3.933
    7    HD2  LYS  58           HD2      LYS  58 -13.517 -10.889  -5.666
    8    HD3  LYS  58           HD1      LYS  58 -12.516  -9.620  -4.960
    9    HE2  LYS  58           HE2      LYS  58 -11.654 -11.718  -4.223
   10    HE3  LYS  58           HE1      LYS  58 -12.453 -10.956  -2.848
   11    HZ1  LYS  58           HZ1      LYS  58 -13.557 -13.120  -4.556
   12    HZ2  LYS  58           HZ2      LYS  58 -14.409 -12.356  -3.306
   13    HZ3  LYS  58           HZ3      LYS  58 -13.029 -13.275  -2.954
   14    HA   PRO  59           HA       PRO  59 -15.765  -5.903  -0.747
   15    HB2  PRO  59           HB2      PRO  59 -15.230  -8.447   0.676
   16    HB3  PRO  59           HB1      PRO  59 -16.279  -7.100   1.133
   17    HG2  PRO  59           HG2      PRO  59 -17.283  -9.423   0.260
   18    HG3  PRO  59           HG1      PRO  59 -18.041  -7.870  -0.145
   19    HD2  PRO  59           HD2      PRO  59 -16.308  -9.627  -1.829
   20    HD3  PRO  59           HD1      PRO  59 -17.723  -8.666  -2.282
   21    H    TYR  60           HN       TYR  60 -13.937  -4.987  -0.932
   22    HA   TYR  60           HA       TYR  60 -11.433  -6.540  -0.704
   23    HB2  TYR  60           HB2      TYR  60 -11.900  -3.925  -2.163
   24    HB3  TYR  60           HB1      TYR  60 -10.331  -4.699  -1.953
   25    HD1  TYR  60           HD2      TYR  60 -10.519  -7.350  -2.670
   26    HD2  TYR  60           HD1      TYR  60 -12.735  -4.098  -4.272
   27    HE1  TYR  60           HE2      TYR  60 -10.889  -8.626  -4.732
   28    HE2  TYR  60           HE1      TYR  60 -13.113  -5.365  -6.335
   29    HH   TYR  60           HH       TYR  60 -12.428  -8.712  -6.599
   30    H    GLY  61           HN       GLY  61 -10.938  -6.312   1.436
   31    HA2  GLY  61           HA2      GLY  61 -11.388  -3.638   2.557
   32    HA3  GLY  61           HA1      GLY  61 -11.616  -5.118   3.469
   33    H    CYS  62           HN       CYS  62 -10.054  -2.704   3.816
   34    HA   CYS  62           HA       CYS  62  -7.290  -3.230   3.635
   35    HB2  CYS  62           HB2      CYS  62  -8.665  -1.031   4.114
   36    HB3  CYS  62           HB1      CYS  62  -8.489  -1.526   5.791
   37    H    GLU  63           HN       GLU  63  -6.505  -5.070   4.567
   38    HA   GLU  63           HA       GLU  63  -7.459  -6.256   6.943
   39    HB2  GLU  63           HB2      GLU  63  -4.723  -6.439   5.677
   40    HB3  GLU  63           HB1      GLU  63  -5.344  -7.523   6.909
   41    HG2  GLU  63           HG2      GLU  63  -7.073  -8.295   5.379
   42    HG3  GLU  63           HG1      GLU  63  -6.491  -7.171   4.148
   43    H    GLU  64           HN       GLU  64  -5.908  -3.416   6.520
   44    HA   GLU  64           HA       GLU  64  -4.156  -3.429   8.797
   45    HB2  GLU  64           HB2      GLU  64  -3.224  -2.135   7.183
   46    HB3  GLU  64           HB1      GLU  64  -4.773  -1.711   6.481
   47    HG2  GLU  64           HG2      GLU  64  -5.070  -0.225   8.543
   48    HG3  GLU  64           HG1      GLU  64  -3.323  -0.421   8.747
   49    H    CYS  65           HN       CYS  65  -7.304  -2.016   7.905
   50    HA   CYS  65           HA       CYS  65  -7.546  -1.056  10.662
   51    HB2  CYS  65           HB2      CYS  65  -8.822   0.912   9.604
   52    HB3  CYS  65           HB1      CYS  65  -7.063   0.915   9.482
   53    H    GLY  66           HN       GLY  66  -8.958  -2.552   7.912
   54    HA2  GLY  66           HA2      GLY  66 -10.515  -4.229   8.155
   55    HA3  GLY  66           HA1      GLY  66 -11.023  -3.518   9.680
   56    H    LYS  67           HN       LYS  67 -10.786  -1.550   6.804
   57    HA   LYS  67           HA       LYS  67 -13.724  -1.496   6.638
   58    HB2  LYS  67           HB2      LYS  67 -11.622   0.470   5.742
   59    HB3  LYS  67           HB1      LYS  67 -13.267   0.542   5.137
   60    HG2  LYS  67           HG2      LYS  67 -13.303   2.066   6.853
   61    HG3  LYS  67           HG1      LYS  67 -13.929   0.614   7.634
   62    HD2  LYS  67           HD2      LYS  67 -11.821   0.188   8.684
   63    HD3  LYS  67           HD1      LYS  67 -11.034   1.461   7.740
   64    HE2  LYS  67           HE2      LYS  67 -12.544   3.111   8.818
   65    HE3  LYS  67           HE1      LYS  67 -13.178   1.815   9.830
   66    HZ1  LYS  67           HZ1      LYS  67 -11.055   1.537  10.847
   67    HZ2  LYS  67           HZ2      LYS  67 -11.437   3.187  10.898
   68    HZ3  LYS  67           HZ3      LYS  67 -10.317   2.616   9.764
   69    H    SER  68           HN       SER  68 -14.680  -2.543   4.968
   70    HA   SER  68           HA       SER  68 -12.964  -3.366   2.754
   71    HB2  SER  68           HB2      SER  68 -15.791  -4.265   2.950
   72    HB3  SER  68           HB1      SER  68 -14.387  -5.112   2.314
   73    HG   SER  68           HG       SER  68 -13.957  -5.883   4.219
   74    H    TYR  69           HN       TYR  69 -13.333  -2.916   0.696
   75    HA   TYR  69           HA       TYR  69 -15.424  -0.925   0.091
   76    HB2  TYR  69           HB2      TYR  69 -12.546  -1.044  -0.802
   77    HB3  TYR  69           HB1      TYR  69 -13.749  -0.101  -1.665
   78    HD1  TYR  69           HD2      TYR  69 -12.087  -0.525   1.618
   79    HD2  TYR  69           HD1      TYR  69 -14.359   2.026  -0.898
   80    HE1  TYR  69           HE2      TYR  69 -11.711   1.330   3.172
   81    HE2  TYR  69           HE1      TYR  69 -13.983   3.897   0.644
   82    HH   TYR  69           HH       TYR  69 -13.436   4.226   3.058
   83    H    ARG  70           HN       ARG  70 -16.414  -1.066  -1.914
   84    HA   ARG  70           HA       ARG  70 -16.599  -3.730  -2.933
   85    HB2  ARG  70           HB2      ARG  70 -18.289  -2.756  -4.490
   86    HB3  ARG  70           HB1      ARG  70 -18.618  -2.462  -2.787
   87    HG2  ARG  70           HG2      ARG  70 -17.682  -0.203  -3.022
   88    HG3  ARG  70           HG1      ARG  70 -17.438  -0.509  -4.742
   89    HD2  ARG  70           HD2      ARG  70 -19.809  -0.764  -5.078
   90    HD3  ARG  70           HD1      ARG  70 -20.104  -0.628  -3.344
   91    HE   ARG  70           HE       ARG  70 -18.913   1.693  -3.804
   92   HH11  ARG  70          HH11      ARG  70 -21.420   0.083  -5.665
   93   HH12  ARG  70          HH12      ARG  70 -22.107   1.574  -6.233
   94   HH21  ARG  70          HH21      ARG  70 -19.826   3.623  -4.538
   95   HH22  ARG  70          HH22      ARG  70 -21.211   3.583  -5.599
   96    H    LEU  71           HN       LEU  71 -15.056  -0.745  -4.084
   97    HA   LEU  71           HA       LEU  71 -14.224  -2.206  -6.490
   98    HB2  LEU  71           HB2      LEU  71 -13.970   0.728  -5.833
   99    HB3  LEU  71           HB1      LEU  71 -13.405  -0.029  -7.311
  100    HG   LEU  71           HG       LEU  71 -15.337   0.615  -8.178
  101   HD11  LEU  71          HD11      LEU  71 -16.559  -1.476  -6.415
  102   HD12  LEU  71          HD12      LEU  71 -15.783  -1.768  -7.974
  103   HD13  LEU  71          HD13      LEU  71 -17.268  -0.816  -7.890
  104   HD21  LEU  71          HD21      LEU  71 -15.731   2.161  -6.362
  105   HD22  LEU  71          HD22      LEU  71 -16.501   0.877  -5.433
  106   HD23  LEU  71          HD23      LEU  71 -17.239   1.445  -6.927
  107    H    ILE  72           HN       ILE  72 -12.035  -2.331  -7.073
  108    HA   ILE  72           HA       ILE  72 -10.125  -2.506  -5.001
  109    HB   ILE  72           HB       ILE  72  -9.859  -2.417  -7.997
  110   HG12  ILE  72          HG12      ILE  72 -10.759  -4.439  -6.821
  111   HG13  ILE  72          HG11      ILE  72  -9.304  -4.749  -7.764
  112   HG21  ILE  72          HG21      ILE  72  -7.475  -2.985  -7.716
  113   HG22  ILE  72          HG22      ILE  72  -7.625  -2.661  -5.988
  114   HG23  ILE  72          HG23      ILE  72  -7.860  -1.359  -7.153
  115   HD11  ILE  72          HD11      ILE  72  -9.428  -4.341  -4.783
  116   HD12  ILE  72          HD12      ILE  72  -7.970  -4.663  -5.723
  117   HD13  ILE  72          HD13      ILE  72  -9.239  -5.885  -5.615
  118    H    SER  73           HN       SER  73 -10.650  -0.038  -7.511
  119    HA   SER  73           HA       SER  73  -8.598   1.689  -6.724
  120    HB2  SER  73           HB2      SER  73 -11.222   2.490  -7.995
  121    HB3  SER  73           HB1      SER  73  -9.685   3.348  -8.099
  122    HG   SER  73           HG       SER  73 -10.161   2.052  -9.961
  123    H    LEU  74           HN       LEU  74 -11.800   1.241  -5.489
  124    HA   LEU  74           HA       LEU  74 -12.078   3.490  -3.889
  125    HB2  LEU  74           HB2      LEU  74 -13.277   0.879  -4.216
  126    HB3  LEU  74           HB1      LEU  74 -13.149   1.290  -2.513
  127    HG   LEU  74           HG       LEU  74 -14.602   2.835  -4.642
  128   HD11  LEU  74          HD11      LEU  74 -15.796   0.874  -3.789
  129   HD12  LEU  74          HD12      LEU  74 -16.548   2.368  -3.222
  130   HD13  LEU  74          HD13      LEU  74 -15.528   1.426  -2.136
  131   HD21  LEU  74          HD21      LEU  74 -13.842   3.452  -1.833
  132   HD22  LEU  74          HD22      LEU  74 -15.183   4.266  -2.648
  133   HD23  LEU  74          HD23      LEU  74 -13.537   4.399  -3.284
  134    H    LEU  75           HN       LEU  75 -10.899   0.315  -3.063
  135    HA   LEU  75           HA       LEU  75 -10.092   1.001  -0.425
  136    HB2  LEU  75           HB2      LEU  75 -10.670  -1.226  -0.774
  137    HB3  LEU  75           HB1      LEU  75  -9.773  -1.317  -2.285
  138    HG   LEU  75           HG       LEU  75  -7.680  -1.077  -0.824
  139   HD11  LEU  75          HD11      LEU  75  -7.927  -1.949   1.452
  140   HD12  LEU  75          HD12      LEU  75  -9.681  -1.935   1.259
  141   HD13  LEU  75          HD13      LEU  75  -8.779  -0.420   1.236
  142   HD21  LEU  75          HD21      LEU  75  -9.451  -3.497  -0.846
  143   HD22  LEU  75          HD22      LEU  75  -7.730  -3.521  -0.432
  144   HD23  LEU  75          HD23      LEU  75  -8.247  -3.027  -2.050
  145    H    ASN  76           HN       ASN  76  -8.749   1.097  -3.548
  146    HA   ASN  76           HA       ASN  76  -5.991   1.147  -2.875
  147    HB2  ASN  76           HB2      ASN  76  -7.415   0.975  -5.199
  148    HB3  ASN  76           HB1      ASN  76  -6.841   2.642  -5.270
  149   HD21  ASN  76          HD21      ASN  76  -5.903  -0.713  -5.040
  150   HD22  ASN  76          HD22      ASN  76  -4.282  -0.500  -5.629
  151    H    LEU  77           HN       LEU  77  -8.497   3.592  -3.348
  152    HA   LEU  77           HA       LEU  77  -6.682   5.750  -2.834
  153    HB2  LEU  77           HB2      LEU  77  -9.495   5.395  -3.601
  154    HB3  LEU  77           HB1      LEU  77  -9.164   6.817  -2.631
  155    HG   LEU  77           HG       LEU  77  -9.113   6.985  -5.218
  156   HD11  LEU  77          HD11      LEU  77  -8.478   8.738  -3.649
  157   HD12  LEU  77          HD12      LEU  77  -7.409   8.722  -5.051
  158   HD13  LEU  77          HD13      LEU  77  -6.867   8.039  -3.517
  159   HD21  LEU  77          HD21      LEU  77  -6.371   5.863  -4.668
  160   HD22  LEU  77          HD22      LEU  77  -6.905   6.580  -6.187
  161   HD23  LEU  77          HD23      LEU  77  -7.639   5.084  -5.612
  162    H    HIS  78           HN       HIS  78  -8.703   3.675  -1.045
  163    HA   HIS  78           HA       HIS  78  -8.843   5.157   1.360
  164    HB2  HIS  78           HB2      HIS  78 -10.288   3.259   1.145
  165    HB3  HIS  78           HB1      HIS  78  -8.935   2.193   0.748
  166    HD1  HIS  78           HD1      HIS  78 -10.728   3.725   3.669
  167    HD2  HIS  78           HD2      HIS  78  -7.464   1.260   2.907
  168    HE1  HIS  78           HE1      HIS  78 -10.035   2.747   5.896
  169    H    LYS  79           HN       LYS  79  -6.569   2.782   0.064
  170    HA   LYS  79           HA       LYS  79  -4.811   2.853   2.307
  171    HB2  LYS  79           HB2      LYS  79  -4.997   0.957   0.713
  172    HB3  LYS  79           HB1      LYS  79  -4.286   1.970  -0.536
  173    HG2  LYS  79           HG2      LYS  79  -2.212   2.100   0.700
  174    HG3  LYS  79           HG1      LYS  79  -2.923   1.177   2.032
  175    HD2  LYS  79           HD2      LYS  79  -2.625   0.176  -0.799
  176    HD3  LYS  79           HD1      LYS  79  -1.529  -0.213   0.530
  177    HE2  LYS  79           HE2      LYS  79  -4.407  -0.691   0.995
  178    HE3  LYS  79           HE1      LYS  79  -3.614  -1.755  -0.159
  179    HZ1  LYS  79           HZ1      LYS  79  -3.497  -2.705   2.029
  180    HZ2  LYS  79           HZ2      LYS  79  -2.812  -1.292   2.670
  181    HZ3  LYS  79           HZ3      LYS  79  -1.938  -2.235   1.563
  182    H    LYS  80           HN       LYS  80  -4.922   4.431  -0.850
  183    HA   LYS  80           HA       LYS  80  -2.569   5.925  -0.670
  184    HB2  LYS  80           HB2      LYS  80  -3.681   5.896  -2.760
  185    HB3  LYS  80           HB1      LYS  80  -5.200   6.425  -2.055
  186    HG2  LYS  80           HG2      LYS  80  -4.406   8.638  -1.792
  187    HG3  LYS  80           HG1      LYS  80  -2.749   8.168  -2.138
  188    HD2  LYS  80           HD2      LYS  80  -4.937   7.786  -4.154
  189    HD3  LYS  80           HD1      LYS  80  -4.107   9.336  -3.986
  190    HE2  LYS  80           HE2      LYS  80  -1.970   8.245  -4.360
  191    HE3  LYS  80           HE1      LYS  80  -2.780   6.688  -4.494
  192    HZ1  LYS  80           HZ1      LYS  80  -3.809   7.332  -6.501
  193    HZ2  LYS  80           HZ2      LYS  80  -2.186   7.801  -6.646
  194    HZ3  LYS  80           HZ3      LYS  80  -3.377   8.960  -6.305
  195    H    ARG  81           HN       ARG  81  -5.780   6.480   0.690
  196    HA   ARG  81           HA       ARG  81  -5.332   9.163   1.476
  197    HB2  ARG  81           HB2      ARG  81  -7.554   8.093   1.258
  198    HB3  ARG  81           HB1      ARG  81  -7.223   7.165   2.710
  199    HG2  ARG  81           HG2      ARG  81  -8.656   9.085   3.167
  200    HG3  ARG  81           HG1      ARG  81  -7.120   9.198   4.021
  201    HD2  ARG  81           HD2      ARG  81  -7.449  10.519   1.358
  202    HD3  ARG  81           HD1      ARG  81  -8.087  11.290   2.809
  203    HE   ARG  81           HE       ARG  81  -5.522  10.673   3.472
  204   HH11  ARG  81          HH11      ARG  81  -6.945  12.407   0.783
  205   HH12  ARG  81          HH12      ARG  81  -5.625  13.535   0.651
  206   HH21  ARG  81          HH21      ARG  81  -3.785  12.147   3.304
  207   HH22  ARG  81          HH22      ARG  81  -3.821  13.375   2.067
  208    H    HIS  82           HN       HIS  82  -4.486   6.127   3.017
  209    HA   HIS  82           HA       HIS  82  -4.124   7.183   5.626
  210    HB2  HIS  82           HB2      HIS  82  -3.111   4.702   4.273
  211    HB3  HIS  82           HB1      HIS  82  -2.624   5.115   5.898
  212    HD1  HIS  82           HD1      HIS  82  -4.535   5.038   7.735
  213    HD2  HIS  82           HD2      HIS  82  -5.544   3.630   3.967
  214    HE1  HIS  82           HE1      HIS  82  -6.653   3.714   8.016
  215    H    SER  83           HN       SER  83  -1.798   6.522   3.003
  216    HA   SER  83           HA       SER  83   0.279   7.877   4.536
  217    HB2  SER  83           HB2      SER  83   0.434   6.420   1.885
  218    HB3  SER  83           HB1      SER  83   1.809   7.066   2.781
  219    HG   SER  83           HG       SER  83   1.068   4.708   3.031
  220    H    GLY  84           HN       GLY  84  -2.111   9.123   2.982
  221    HA2  GLY  84           HA2      GLY  84  -2.335  11.322   2.232
  222    HA3  GLY  84           HA1      GLY  84  -0.587  11.419   2.068
  223    H    GLU  85           HN       GLU  85   0.004   9.378   0.408
  224    HA   GLU  85           HA       GLU  85  -1.780   9.317  -1.846
  225    HB2  GLU  85           HB2      GLU  85  -0.138  10.187  -3.419
  226    HB3  GLU  85           HB1      GLU  85  -0.466  11.400  -2.182
  227    HG2  GLU  85           HG2      GLU  85   1.645   9.871  -1.195
  228    HG3  GLU  85           HG1      GLU  85   2.003  10.138  -2.898
  229    H    ALA  86           HN       ALA  86  -1.278   7.603  -3.209
  230    HA   ALA  86           HA       ALA  86   0.621   5.669  -2.127
  231    HB1  ALA  86           HB1      ALA  86  -1.649   4.850  -2.450
  232    HB2  ALA  86           HB2      ALA  86  -0.530   4.030  -3.541
  233    HB3  ALA  86           HB3      ALA  86  -1.582   5.305  -4.153
  234    H    ARG  87           HN       ARG  87   2.518   6.480  -2.877
  235    HA   ARG  87           HA       ARG  87   2.840   7.096  -5.657
  236    HB2  ARG  87           HB2      ARG  87   4.836   7.010  -3.413
  237    HB3  ARG  87           HB1      ARG  87   5.146   7.634  -5.031
  238    HG2  ARG  87           HG2      ARG  87   3.132   8.668  -3.079
  239    HG3  ARG  87           HG1      ARG  87   4.711   9.365  -3.430
  240    HD2  ARG  87           HD2      ARG  87   3.946   9.471  -5.852
  241    HD3  ARG  87           HD1      ARG  87   2.329   9.120  -5.243
  242    HE   ARG  87           HE       ARG  87   3.151  11.298  -3.799
  243   HH11  ARG  87          HH11      ARG  87   2.768  10.558  -7.208
  244   HH12  ARG  87          HH12      ARG  87   2.524  12.215  -7.662
  245   HH21  ARG  87          HH21      ARG  87   2.789  13.465  -4.401
  246   HH22  ARG  87          HH22      ARG  87   2.518  13.866  -6.074
  247    H    TYR  88           HN       TYR  88   5.265   5.448  -3.900
  248    HA   TYR  88           HA       TYR  88   5.541   3.439  -5.971
  249    HB2  TYR  88           HB2      TYR  88   7.058   3.804  -3.381
  250    HB3  TYR  88           HB1      TYR  88   7.506   2.750  -4.709
  251    HD1  TYR  88           HD1      TYR  88   6.963   6.322  -3.861
  252    HD2  TYR  88           HD2      TYR  88   8.924   3.522  -6.381
  253    HE1  TYR  88           HE1      TYR  88   8.287   8.141  -4.831
  254    HE2  TYR  88           HE2      TYR  88  10.260   5.334  -7.365
  255    HH   TYR  88           HH       TYR  88  10.470   8.414  -6.002
  256    H    ARG  89           HN       ARG  89   5.244   1.200  -5.624
  257    HA   ARG  89           HA       ARG  89   4.354   0.489  -2.923
  258    HB2  ARG  89           HB2      ARG  89   2.832  -1.126  -3.724
  259    HB3  ARG  89           HB1      ARG  89   2.508   0.347  -4.625
  260    HG2  ARG  89           HG2      ARG  89   3.804  -0.590  -6.524
  261    HG3  ARG  89           HG1      ARG  89   3.970  -2.091  -5.601
  262    HD2  ARG  89           HD2      ARG  89   1.514  -2.228  -5.453
  263    HD3  ARG  89           HD1      ARG  89   1.404  -0.796  -6.475
  264    HE   ARG  89           HE       ARG  89   2.948  -2.742  -7.791
  265   HH11  ARG  89          HH11      ARG  89  -0.365  -2.089  -6.845
  266   HH12  ARG  89          HH12      ARG  89  -1.049  -3.059  -8.118
  267   HH21  ARG  89          HH21      ARG  89   2.053  -4.007  -9.461
  268   HH22  ARG  89          HH22      ARG  89   0.326  -4.146  -9.601
  269    H    CYS  90           HN       CYS  90   5.091  -1.377  -2.119
  270    HA   CYS  90           HA       CYS  90   7.582  -2.406  -2.823
  271    HB2  CYS  90           HB2      CYS  90   6.393  -2.739  -0.653
  272    HB3  CYS  90           HB1      CYS  90   5.310  -3.837  -1.454
  273    H    GLU  91           HN       GLU  91   8.153  -3.563  -4.524
  274    HA   GLU  91           HA       GLU  91   6.290  -4.411  -6.459
  275    HB2  GLU  91           HB2      GLU  91   8.294  -5.411  -7.574
  276    HB3  GLU  91           HB1      GLU  91   8.439  -3.695  -7.188
  277    HG2  GLU  91           HG2      GLU  91   9.616  -4.382  -5.122
  278    HG3  GLU  91           HG1      GLU  91   9.645  -6.022  -5.744
  279    H    ASP  92           HN       ASP  92   6.675  -5.733  -3.594
  280    HA   ASP  92           HA       ASP  92   6.386  -8.465  -4.615
  281    HB2  ASP  92           HB2      ASP  92   7.991  -9.173  -3.243
  282    HB3  ASP  92           HB1      ASP  92   8.328  -7.490  -2.850
  283    H    CYS  93           HN       CYS  93   5.217  -6.091  -2.160
  284    HA   CYS  93           HA       CYS  93   3.015  -7.958  -1.728
  285    HB2  CYS  93           HB2      CYS  93   3.199  -7.881   0.594
  286    HB3  CYS  93           HB1      CYS  93   4.855  -8.039   0.049
  287    H    GLY  94           HN       GLY  94   3.927  -4.923  -2.597
  288    HA2  GLY  94           HA2      GLY  94   2.618  -3.267  -3.408
  289    HA3  GLY  94           HA1      GLY  94   1.195  -4.148  -2.864
  290    H    LYS  95           HN       LYS  95   3.848  -3.095  -0.835
  291    HA   LYS  95           HA       LYS  95   2.194  -1.472   0.803
  292    HB2  LYS  95           HB2      LYS  95   4.972  -2.486   0.720
  293    HB3  LYS  95           HB1      LYS  95   4.685  -1.027   1.633
  294    HG2  LYS  95           HG2      LYS  95   2.952  -3.374   2.059
  295    HG3  LYS  95           HG1      LYS  95   4.567  -3.319   2.795
  296    HD2  LYS  95           HD2      LYS  95   4.084  -1.420   4.015
  297    HD3  LYS  95           HD1      LYS  95   2.772  -0.980   2.934
  298    HE2  LYS  95           HE2      LYS  95   2.764  -3.225   4.954
  299    HE3  LYS  95           HE1      LYS  95   1.916  -1.690   5.112
  300    HZ1  LYS  95           HZ1      LYS  95   0.299  -3.160   4.392
  301    HZ2  LYS  95           HZ2      LYS  95   1.330  -3.942   3.298
  302    HZ3  LYS  95           HZ3      LYS  95   0.758  -2.382   2.956
  303    H    LEU  96           HN       LEU  96   1.909   0.694   0.563
  304    HA   LEU  96           HA       LEU  96   3.263   1.940  -1.700
  305    HB2  LEU  96           HB2      LEU  96   0.852   2.717  -0.085
  306    HB3  LEU  96           HB1      LEU  96   1.584   3.807  -1.257
  307    HG   LEU  96           HG       LEU  96  -0.323   2.721  -2.256
  308   HD11  LEU  96          HD11      LEU  96   0.733   1.641  -4.184
  309   HD12  LEU  96          HD12      LEU  96   2.252   1.562  -3.288
  310   HD13  LEU  96          HD13      LEU  96   1.561   3.129  -3.720
  311   HD21  LEU  96          HD21      LEU  96  -0.463   0.753  -0.855
  312   HD22  LEU  96          HD22      LEU  96   1.036   0.134  -1.550
  313   HD23  LEU  96          HD23      LEU  96  -0.406   0.287  -2.556
  314    H    PHE  97           HN       PHE  97   4.846   3.298  -1.502
  315    HA   PHE  97           HA       PHE  97   5.170   4.763   1.043
  316    HB2  PHE  97           HB2      PHE  97   7.414   3.646  -0.669
  317    HB3  PHE  97           HB1      PHE  97   7.613   4.627   0.780
  318    HD1  PHE  97           HD2      PHE  97   6.431   1.374  -0.477
  319    HD2  PHE  97           HD1      PHE  97   7.443   3.682   2.950
  320    HE1  PHE  97           HE2      PHE  97   6.289  -0.649   0.922
  321    HE2  PHE  97           HE1      PHE  97   7.321   1.662   4.350
  322    HZ   PHE  97           HZ       PHE  97   6.746  -0.509   3.328
  323    H    THR  98           HN       THR  98   5.921   6.850   0.912
  324    HA   THR  98           HA       THR  98   5.518   8.097  -1.693
  325    HB   THR  98           HB       THR  98   5.387  10.194  -0.375
  326    HG1  THR  98           HG1      THR  98   5.155   9.606   2.045
  327   HG21  THR  98          HG21      THR  98   3.375   8.921  -0.828
  328   HG22  THR  98          HG22      THR  98   3.284   9.589   0.806
  329   HG23  THR  98          HG23      THR  98   3.690   7.883   0.567
  330    H    THR  99           HN       THR  99   7.958   6.698  -0.322
  331    HA   THR  99           HA       THR  99   9.914   8.424  -1.590
  332    HB   THR  99           HB       THR  99  10.041   7.474   1.279
  333    HG1  THR  99           HG1      THR  99   9.361   9.794   0.119
  334   HG21  THR  99          HG21      THR  99  12.148   7.092   0.013
  335   HG22  THR  99          HG22      THR  99  12.303   8.197   1.379
  336   HG23  THR  99          HG23      THR  99  12.234   8.831  -0.267
  337    H    SER 100           HN       SER 100  11.290   7.201  -2.748
  338    HA   SER 100           HA       SER 100  10.761   4.437  -3.031
  339    HB2  SER 100           HB2      SER 100  12.723   4.541  -4.639
  340    HB3  SER 100           HB1      SER 100  11.386   5.648  -4.981
  341    HG   SER 100           HG       SER 100  13.505   6.620  -5.100
  342    H    GLY 101           HN       GLY 101  13.189   6.257  -1.286
  343    HA2  GLY 101           HA2      GLY 101  14.835   3.975  -0.739
  344    HA3  GLY 101           HA1      GLY 101  14.921   5.525   0.055
  345    H    ASN 102           HN       ASN 102  12.198   5.602   0.998
  346    HA   ASN 102           HA       ASN 102  12.342   3.983   3.334
  347    HB2  ASN 102           HB2      ASN 102  10.010   5.397   2.025
  348    HB3  ASN 102           HB1      ASN 102   9.889   4.543   3.553
  349   HD21  ASN 102          HD21      ASN 102   9.384   7.323   3.084
  350   HD22  ASN 102          HD22      ASN 102  10.503   8.218   4.049
  351    H    LEU 103           HN       LEU 103  10.860   3.803   0.224
  352    HA   LEU 103           HA       LEU 103   9.323   1.525   0.606
  353    HB2  LEU 103           HB2      LEU 103   8.874   2.786  -1.287
  354    HB3  LEU 103           HB1      LEU 103  10.576   2.939  -1.703
  355    HG   LEU 103           HG       LEU 103  10.537   0.489  -2.293
  356   HD11  LEU 103          HD11      LEU 103   8.437  -0.572  -2.684
  357   HD12  LEU 103          HD12      LEU 103   7.555   0.906  -2.240
  358   HD13  LEU 103          HD13      LEU 103   8.463  -0.001  -1.011
  359   HD21  LEU 103          HD21      LEU 103   9.268   1.013  -4.430
  360   HD22  LEU 103          HD22      LEU 103  10.608   2.078  -3.995
  361   HD23  LEU 103          HD23      LEU 103   8.951   2.587  -3.694
  362    H    LYS 104           HN       LYS 104  12.512   2.041  -0.750
  363    HA   LYS 104           HA       LYS 104  13.341  -0.495  -1.312
  364    HB2  LYS 104           HB2      LYS 104  14.460   1.580  -1.943
  365    HB3  LYS 104           HB1      LYS 104  14.922   1.849  -0.271
  366    HG2  LYS 104           HG2      LYS 104  16.414   0.048  -0.278
  367    HG3  LYS 104           HG1      LYS 104  15.766  -0.584  -1.801
  368    HD2  LYS 104           HD2      LYS 104  17.884   0.521  -2.200
  369    HD3  LYS 104           HD1      LYS 104  16.570   1.426  -2.951
  370    HE2  LYS 104           HE2      LYS 104  16.576   3.000  -1.094
  371    HE3  LYS 104           HE1      LYS 104  17.867   2.089  -0.310
  372    HZ1  LYS 104           HZ1      LYS 104  18.070   3.445  -2.950
  373    HZ2  LYS 104           HZ2      LYS 104  19.311   2.589  -2.175
  374    HZ3  LYS 104           HZ3      LYS 104  18.717   4.020  -1.495
  375    H    ARG 105           HN       ARG 105  13.668   1.258   1.785
  376    HA   ARG 105           HA       ARG 105  15.042  -0.653   3.238
  377    HB2  ARG 105           HB2      ARG 105  12.777   1.147   4.139
  378    HB3  ARG 105           HB1      ARG 105  13.789   0.226   5.237
  379    HG2  ARG 105           HG2      ARG 105  14.911   2.247   3.322
  380    HG3  ARG 105           HG1      ARG 105  14.353   2.666   4.946
  381    HD2  ARG 105           HD2      ARG 105  16.398   2.140   5.660
  382    HD3  ARG 105           HD1      ARG 105  15.976   0.459   5.340
  383    HE   ARG 105           HE       ARG 105  17.022   1.928   3.074
  384   HH11  ARG 105          HH11      ARG 105  17.769  -0.135   5.812
  385   HH12  ARG 105          HH12      ARG 105  19.270  -0.701   5.133
  386   HH21  ARG 105          HH21      ARG 105  18.990   1.208   2.195
  387   HH22  ARG 105          HH22      ARG 105  19.961   0.060   3.065
  388    H    HIS 106           HN       HIS 106  11.570  -0.380   2.662
  389    HA   HIS 106           HA       HIS 106  10.857  -2.735   4.104
  390    HB2  HIS 106           HB2      HIS 106   9.252  -0.940   3.781
  391    HB3  HIS 106           HB1      HIS 106   9.363  -1.115   2.032
  392    HD1  HIS 106           HD1      HIS 106   7.889  -2.838   5.074
  393    HD2  HIS 106           HD2      HIS 106   7.873  -3.065   0.932
  394    HE1  HIS 106           HE1      HIS 106   6.090  -4.504   4.467
  395    H    GLN 107           HN       GLN 107  12.194  -2.294   0.988
  396    HA   GLN 107           HA       GLN 107  11.000  -4.644  -0.181
  397    HB2  GLN 107           HB2      GLN 107  13.288  -2.946  -1.209
  398    HB3  GLN 107           HB1      GLN 107  12.314  -4.082  -2.140
  399    HG2  GLN 107           HG2      GLN 107  10.777  -1.978  -0.857
  400    HG3  GLN 107           HG1      GLN 107  11.980  -1.400  -2.002
  401   HE21  GLN 107          HE21      GLN 107  11.843  -1.898  -4.089
  402   HE22  GLN 107          HE22      GLN 107  10.416  -2.547  -4.841
  403    H    LEU 108           HN       LEU 108  13.724  -3.527   1.503
  404    HA   LEU 108           HA       LEU 108  15.499  -5.686   0.932
  405    HB2  LEU 108           HB2      LEU 108  15.502  -3.437   2.901
  406    HB3  LEU 108           HB1      LEU 108  16.690  -4.725   2.992
  407    HG   LEU 108           HG       LEU 108  17.926  -3.881   1.328
  408   HD11  LEU 108          HD11      LEU 108  16.297  -4.509  -0.361
  409   HD12  LEU 108          HD12      LEU 108  17.050  -2.960  -0.740
  410   HD13  LEU 108          HD13      LEU 108  15.411  -3.009  -0.076
  411   HD21  LEU 108          HD21      LEU 108  17.762  -1.463   1.102
  412   HD22  LEU 108          HD22      LEU 108  17.545  -1.967   2.779
  413   HD23  LEU 108          HD23      LEU 108  16.142  -1.505   1.807
  414    H    VAL 109           HN       VAL 109  13.163  -4.896   3.399
  415    HA   VAL 109           HA       VAL 109  14.084  -6.713   5.312
  416    HB   VAL 109           HB       VAL 109  11.973  -6.467   6.389
  417   HG11  VAL 109          HG11      VAL 109  12.501  -3.920   4.902
  418   HG12  VAL 109          HG12      VAL 109  13.380  -4.453   6.339
  419   HG13  VAL 109          HG13      VAL 109  11.659  -4.076   6.442
  420   HG21  VAL 109          HG21      VAL 109  10.035  -5.449   5.237
  421   HG22  VAL 109          HG22      VAL 109  10.518  -7.008   4.563
  422   HG23  VAL 109          HG23      VAL 109  10.966  -5.514   3.736
  423    H    HIS 110           HN       HIS 110  12.342  -7.075   2.354
  424    HA   HIS 110           HA       HIS 110  11.234  -9.662   3.020
  425    HB2  HIS 110           HB2      HIS 110  11.470  -8.082   0.495
  426    HB3  HIS 110           HB1      HIS 110  10.868  -9.722   0.475
  427    HD1  HIS 110           HD1      HIS 110   8.488 -10.104   1.516
  428    HD2  HIS 110           HD2      HIS 110   9.869  -6.199   1.543
  429    HE1  HIS 110           HE1      HIS 110   6.475  -8.638   1.957
  430    H    SER 111           HN       SER 111  14.361  -8.720   2.307
  431    HA   SER 111           HA       SER 111  15.205 -11.475   2.119
  432    HB2  SER 111           HB2      SER 111  14.739 -10.828  -0.268
  433    HB3  SER 111           HB1      SER 111  15.971  -9.578  -0.116
  434    HG   SER 111           HG       SER 111  17.436 -11.037  -0.425
  435    H    GLY 112           HN       GLY 112  15.388  -9.203   3.869
  436    HA2  GLY 112           HA2      GLY 112  18.292  -8.917   4.119
  437    HA3  GLY 112           HA1      GLY 112  17.282  -7.466   4.021
  Start of MODEL    9
    1    H    LYS  58           HT1      LYS  58 -15.619  -6.566  -6.717
    2    HA   LYS  58           HA       LYS  58 -15.151  -8.676  -5.743
    3    HB2  LYS  58           HB2      LYS  58 -12.269  -7.950  -6.291
    4    HB3  LYS  58           HB1      LYS  58 -12.769  -9.270  -5.245
    5    HG2  LYS  58           HG2      LYS  58 -13.976 -10.248  -7.208
    6    HG3  LYS  58           HG1      LYS  58 -13.206  -9.015  -8.205
    7    HD2  LYS  58           HD2      LYS  58 -11.751 -11.042  -6.510
    8    HD3  LYS  58           HD1      LYS  58 -12.000 -11.163  -8.252
    9    HE2  LYS  58           HE2      LYS  58 -10.715  -9.134  -8.603
   10    HE3  LYS  58           HE1      LYS  58 -10.519  -8.934  -6.861
   11    HZ1  LYS  58           HZ1      LYS  58  -9.229 -10.941  -6.767
   12    HZ2  LYS  58           HZ2      LYS  58  -8.564  -9.923  -7.946
   13    HZ3  LYS  58           HZ3      LYS  58  -9.503 -11.258  -8.415
   14    HA   PRO  59           HA       PRO  59 -15.236  -6.098  -2.099
   15    HB2  PRO  59           HB2      PRO  59 -15.431  -8.756  -0.803
   16    HB3  PRO  59           HB1      PRO  59 -16.491  -7.349  -0.651
   17    HG2  PRO  59           HG2      PRO  59 -17.239  -9.501  -2.042
   18    HG3  PRO  59           HG1      PRO  59 -17.665  -7.864  -2.576
   19    HD2  PRO  59           HD2      PRO  59 -15.537  -9.693  -3.597
   20    HD3  PRO  59           HD1      PRO  59 -16.594  -8.585  -4.483
   21    H    TYR  60           HN       TYR  60 -13.494  -5.326  -1.366
   22    HA   TYR  60           HA       TYR  60 -11.358  -7.080  -0.344
   23    HB2  TYR  60           HB2      TYR  60 -11.160  -4.668  -2.102
   24    HB3  TYR  60           HB1      TYR  60  -9.979  -4.852  -0.824
   25    HD1  TYR  60           HD2      TYR  60 -10.692  -8.048  -1.539
   26    HD2  TYR  60           HD1      TYR  60  -8.812  -4.698  -3.336
   27    HE1  TYR  60           HE2      TYR  60  -9.415  -9.557  -2.972
   28    HE2  TYR  60           HE1      TYR  60  -7.529  -6.197  -4.799
   29    HH   TYR  60           HH       TYR  60  -6.803  -8.450  -4.963
   30    H    GLY  61           HN       GLY  61 -10.032  -5.813   1.332
   31    HA2  GLY  61           HA2      GLY  61 -11.397  -3.518   2.431
   32    HA3  GLY  61           HA1      GLY  61 -11.464  -4.954   3.444
   33    H    CYS  62           HN       CYS  62 -10.285  -2.437   4.020
   34    HA   CYS  62           HA       CYS  62  -7.492  -2.424   3.679
   35    HB2  CYS  62           HB2      CYS  62  -9.061  -0.512   4.366
   36    HB3  CYS  62           HB1      CYS  62  -8.952  -1.178   5.998
   37    H    GLU  63           HN       GLU  63  -6.173  -3.912   4.410
   38    HA   GLU  63           HA       GLU  63  -6.693  -5.821   6.389
   39    HB2  GLU  63           HB2      GLU  63  -5.045  -6.024   4.568
   40    HB3  GLU  63           HB1      GLU  63  -4.052  -4.798   5.330
   41    HG2  GLU  63           HG2      GLU  63  -3.683  -6.254   7.234
   42    HG3  GLU  63           HG1      GLU  63  -4.720  -7.482   6.505
   43    H    GLU  64           HN       GLU  64  -5.929  -2.575   6.704
   44    HA   GLU  64           HA       GLU  64  -4.479  -2.820   9.203
   45    HB2  GLU  64           HB2      GLU  64  -3.448  -1.161   8.080
   46    HB3  GLU  64           HB1      GLU  64  -4.867  -0.791   7.115
   47    HG2  GLU  64           HG2      GLU  64  -5.676   0.108   9.509
   48    HG3  GLU  64           HG1      GLU  64  -3.935   0.385   9.635
   49    H    CYS  65           HN       CYS  65  -7.569  -1.450   8.019
   50    HA   CYS  65           HA       CYS  65  -8.189  -0.748  10.797
   51    HB2  CYS  65           HB2      CYS  65  -9.454   1.176   9.885
   52    HB3  CYS  65           HB1      CYS  65  -7.746   1.247   9.469
   53    H    GLY  66           HN       GLY  66  -9.166  -2.225   7.853
   54    HA2  GLY  66           HA2      GLY  66 -10.412  -4.158   7.884
   55    HA3  GLY  66           HA1      GLY  66 -11.110  -3.670   9.420
   56    H    LYS  67           HN       LYS  67 -11.151  -1.314   6.926
   57    HA   LYS  67           HA       LYS  67 -14.029  -1.689   6.620
   58    HB2  LYS  67           HB2      LYS  67 -12.168   0.554   5.834
   59    HB3  LYS  67           HB1      LYS  67 -13.841   0.495   5.306
   60    HG2  LYS  67           HG2      LYS  67 -13.752   1.932   7.178
   61    HG3  LYS  67           HG1      LYS  67 -14.506   0.438   7.725
   62    HD2  LYS  67           HD2      LYS  67 -12.437  -0.279   8.751
   63    HD3  LYS  67           HD1      LYS  67 -11.590   1.121   8.093
   64    HE2  LYS  67           HE2      LYS  67 -12.110   1.465  10.438
   65    HE3  LYS  67           HE1      LYS  67 -13.008   2.599   9.431
   66    HZ1  LYS  67           HZ1      LYS  67 -14.942   1.091   9.617
   67    HZ2  LYS  67           HZ2      LYS  67 -14.450   1.737  11.101
   68    HZ3  LYS  67           HZ3      LYS  67 -14.063   0.134  10.713
   69    H    SER  68           HN       SER  68 -14.940  -2.540   4.818
   70    HA   SER  68           HA       SER  68 -13.120  -3.403   2.717
   71    HB2  SER  68           HB2      SER  68 -15.601  -4.396   2.034
   72    HB3  SER  68           HB1      SER  68 -14.350  -5.266   2.931
   73    HG   SER  68           HG       SER  68 -15.368  -4.827   4.819
   74    H    TYR  69           HN       TYR  69 -13.362  -2.980   0.571
   75    HA   TYR  69           HA       TYR  69 -15.269  -0.833  -0.104
   76    HB2  TYR  69           HB2      TYR  69 -12.373  -1.110  -0.836
   77    HB3  TYR  69           HB1      TYR  69 -13.474  -0.176  -1.846
   78    HD1  TYR  69           HD2      TYR  69 -12.133  -0.465   1.598
   79    HD2  TYR  69           HD1      TYR  69 -14.071   1.978  -1.273
   80    HE1  TYR  69           HE2      TYR  69 -11.865   1.468   3.080
   81    HE2  TYR  69           HE1      TYR  69 -13.810   3.931   0.189
   82    HH   TYR  69           HH       TYR  69 -11.916   3.754   3.135
   83    H    ARG  70           HN       ARG  70 -16.116  -0.783  -2.135
   84    HA   ARG  70           HA       ARG  70 -16.663  -3.312  -3.327
   85    HB2  ARG  70           HB2      ARG  70 -18.292  -1.460  -3.195
   86    HB3  ARG  70           HB1      ARG  70 -17.280  -0.495  -4.257
   87    HG2  ARG  70           HG2      ARG  70 -19.083  -1.371  -5.529
   88    HG3  ARG  70           HG1      ARG  70 -17.608  -2.202  -6.026
   89    HD2  ARG  70           HD2      ARG  70 -18.192  -4.128  -4.704
   90    HD3  ARG  70           HD1      ARG  70 -19.584  -3.288  -4.024
   91    HE   ARG  70           HE       ARG  70 -19.528  -3.641  -6.923
   92   HH11  ARG  70          HH11      ARG  70 -20.760  -4.653  -3.805
   93   HH12  ARG  70          HH12      ARG  70 -22.090  -5.549  -4.475
   94   HH21  ARG  70          HH21      ARG  70 -21.296  -4.820  -7.815
   95   HH22  ARG  70          HH22      ARG  70 -22.384  -5.654  -6.749
   96    H    LEU  71           HN       LEU  71 -14.700  -0.512  -4.221
   97    HA   LEU  71           HA       LEU  71 -13.797  -1.925  -6.623
   98    HB2  LEU  71           HB2      LEU  71 -13.910   0.953  -5.808
   99    HB3  LEU  71           HB1      LEU  71 -12.770   0.437  -7.038
  100    HG   LEU  71           HG       LEU  71 -14.485  -0.187  -8.526
  101   HD11  LEU  71          HD11      LEU  71 -16.484   0.226  -6.325
  102   HD12  LEU  71          HD12      LEU  71 -15.950  -1.330  -6.961
  103   HD13  LEU  71          HD13      LEU  71 -16.847  -0.216  -7.993
  104   HD21  LEU  71          HD21      LEU  71 -15.374   2.326  -7.139
  105   HD22  LEU  71          HD22      LEU  71 -15.785   1.852  -8.787
  106   HD23  LEU  71          HD23      LEU  71 -14.111   2.223  -8.367
  107    H    ILE  72           HN       ILE  72 -11.638  -2.177  -7.058
  108    HA   ILE  72           HA       ILE  72  -9.939  -2.527  -4.796
  109    HB   ILE  72           HB       ILE  72  -8.935  -2.410  -7.632
  110   HG12  ILE  72          HG12      ILE  72 -10.839  -3.867  -7.736
  111   HG13  ILE  72          HG11      ILE  72  -9.396  -4.874  -7.722
  112   HG21  ILE  72          HG21      ILE  72  -7.294  -2.534  -5.827
  113   HG22  ILE  72          HG22      ILE  72  -7.291  -3.993  -6.822
  114   HG23  ILE  72          HG23      ILE  72  -8.064  -4.009  -5.237
  115   HD11  ILE  72          HD11      ILE  72 -11.149  -4.303  -5.344
  116   HD12  ILE  72          HD12      ILE  72  -9.745  -5.371  -5.379
  117   HD13  ILE  72          HD13      ILE  72 -11.183  -5.771  -6.321
  118    H    SER  73           HN       SER  73 -10.128  -0.158  -7.408
  119    HA   SER  73           HA       SER  73  -7.963   1.434  -6.533
  120    HB2  SER  73           HB2      SER  73 -10.391   2.307  -8.120
  121    HB3  SER  73           HB1      SER  73  -8.833   3.133  -8.045
  122    HG   SER  73           HG       SER  73  -8.077   1.807  -9.492
  123    H    LEU  74           HN       LEU  74 -11.320   1.257  -5.634
  124    HA   LEU  74           HA       LEU  74 -11.557   3.615  -4.195
  125    HB2  LEU  74           HB2      LEU  74 -13.078   1.306  -4.740
  126    HB3  LEU  74           HB1      LEU  74 -12.987   1.427  -2.985
  127    HG   LEU  74           HG       LEU  74 -14.023   3.531  -4.872
  128   HD11  LEU  74          HD11      LEU  74 -15.552   1.645  -4.471
  129   HD12  LEU  74          HD12      LEU  74 -16.139   3.136  -3.734
  130   HD13  LEU  74          HD13      LEU  74 -15.387   1.891  -2.733
  131   HD21  LEU  74          HD21      LEU  74 -12.834   4.592  -3.169
  132   HD22  LEU  74          HD22      LEU  74 -13.431   3.468  -1.953
  133   HD23  LEU  74          HD23      LEU  74 -14.531   4.655  -2.673
  134    H    LEU  75           HN       LEU  75 -10.693   0.378  -3.147
  135    HA   LEU  75           HA       LEU  75 -10.019   1.123  -0.495
  136    HB2  LEU  75           HB2      LEU  75 -10.560  -1.125  -0.854
  137    HB3  LEU  75           HB1      LEU  75  -9.499  -1.249  -2.256
  138    HG   LEU  75           HG       LEU  75  -7.579  -0.888  -0.598
  139   HD11  LEU  75          HD11      LEU  75  -9.749  -1.719   1.313
  140   HD12  LEU  75          HD12      LEU  75  -8.959  -0.139   1.275
  141   HD13  LEU  75          HD13      LEU  75  -8.028  -1.580   1.681
  142   HD21  LEU  75          HD21      LEU  75  -7.468  -3.232  -0.191
  143   HD22  LEU  75          HD22      LEU  75  -8.215  -2.958  -1.776
  144   HD23  LEU  75          HD23      LEU  75  -9.217  -3.374  -0.381
  145    H    ASN  76           HN       ASN  76  -8.391   0.993  -3.543
  146    HA   ASN  76           HA       ASN  76  -5.717   1.115  -2.624
  147    HB2  ASN  76           HB2      ASN  76  -6.897   0.835  -5.059
  148    HB3  ASN  76           HB1      ASN  76  -6.357   2.513  -5.148
  149   HD21  ASN  76          HD21      ASN  76  -5.409  -0.805  -4.864
  150   HD22  ASN  76          HD22      ASN  76  -3.729  -0.578  -5.235
  151    H    LEU  77           HN       LEU  77  -8.147   3.513  -3.407
  152    HA   LEU  77           HA       LEU  77  -6.452   5.749  -2.914
  153    HB2  LEU  77           HB2      LEU  77  -9.264   5.226  -3.650
  154    HB3  LEU  77           HB1      LEU  77  -8.955   6.734  -2.820
  155    HG   LEU  77           HG       LEU  77  -8.958   6.699  -5.396
  156   HD11  LEU  77          HD11      LEU  77  -7.191   8.418  -5.415
  157   HD12  LEU  77          HD12      LEU  77  -6.714   7.894  -3.798
  158   HD13  LEU  77          HD13      LEU  77  -8.309   8.592  -4.060
  159   HD21  LEU  77          HD21      LEU  77  -6.192   5.622  -4.865
  160   HD22  LEU  77          HD22      LEU  77  -6.784   6.223  -6.414
  161   HD23  LEU  77          HD23      LEU  77  -7.492   4.773  -5.701
  162    H    HIS  78           HN       HIS  78  -8.460   3.679  -1.051
  163    HA   HIS  78           HA       HIS  78  -8.538   5.371   1.270
  164    HB2  HIS  78           HB2      HIS  78 -10.224   3.655   1.037
  165    HB3  HIS  78           HB1      HIS  78  -8.988   2.398   0.912
  166    HD1  HIS  78           HD1      HIS  78 -10.543   4.739   3.468
  167    HD2  HIS  78           HD2      HIS  78  -8.083   1.392   3.268
  168    HE1  HIS  78           HE1      HIS  78 -10.316   3.887   5.836
  169    H    LYS  79           HN       LYS  79  -6.454   2.854   0.010
  170    HA   LYS  79           HA       LYS  79  -4.753   2.667   2.299
  171    HB2  LYS  79           HB2      LYS  79  -5.036   0.988   0.356
  172    HB3  LYS  79           HB1      LYS  79  -3.967   2.048  -0.554
  173    HG2  LYS  79           HG2      LYS  79  -2.625   0.315   0.322
  174    HG3  LYS  79           HG1      LYS  79  -2.277   1.750   1.287
  175    HD2  LYS  79           HD2      LYS  79  -2.498  -0.136   2.763
  176    HD3  LYS  79           HD1      LYS  79  -3.888   0.926   2.993
  177    HE2  LYS  79           HE2      LYS  79  -4.773  -1.259   2.941
  178    HE3  LYS  79           HE1      LYS  79  -5.123  -0.574   1.358
  179    HZ1  LYS  79           HZ1      LYS  79  -2.805  -2.346   1.928
  180    HZ2  LYS  79           HZ2      LYS  79  -3.320  -1.803   0.406
  181    HZ3  LYS  79           HZ3      LYS  79  -4.280  -2.878   1.290
  182    H    LYS  80           HN       LYS  80  -4.790   4.465  -0.707
  183    HA   LYS  80           HA       LYS  80  -2.467   5.993  -0.384
  184    HB2  LYS  80           HB2      LYS  80  -3.552   6.031  -2.497
  185    HB3  LYS  80           HB1      LYS  80  -5.088   6.498  -1.786
  186    HG2  LYS  80           HG2      LYS  80  -4.304   8.708  -1.374
  187    HG3  LYS  80           HG1      LYS  80  -2.658   8.271  -1.800
  188    HD2  LYS  80           HD2      LYS  80  -4.924   8.027  -3.749
  189    HD3  LYS  80           HD1      LYS  80  -4.048   9.544  -3.532
  190    HE2  LYS  80           HE2      LYS  80  -1.960   8.394  -4.054
  191    HE3  LYS  80           HE1      LYS  80  -2.848   6.891  -4.277
  192    HZ1  LYS  80           HZ1      LYS  80  -3.419   9.328  -5.866
  193    HZ2  LYS  80           HZ2      LYS  80  -3.916   7.736  -6.187
  194    HZ3  LYS  80           HZ3      LYS  80  -2.281   8.168  -6.355
  195    H    ARG  81           HN       ARG  81  -5.795   6.534   0.726
  196    HA   ARG  81           HA       ARG  81  -5.480   9.124   1.707
  197    HB2  ARG  81           HB2      ARG  81  -7.655   8.017   1.398
  198    HB3  ARG  81           HB1      ARG  81  -7.311   6.972   2.771
  199    HG2  ARG  81           HG2      ARG  81  -8.795   8.789   3.398
  200    HG3  ARG  81           HG1      ARG  81  -7.251   8.914   4.242
  201    HD2  ARG  81           HD2      ARG  81  -6.507  10.584   2.607
  202    HD3  ARG  81           HD1      ARG  81  -8.068  10.473   1.795
  203    HE   ARG  81           HE       ARG  81  -8.574  11.070   4.464
  204   HH11  ARG  81          HH11      ARG  81  -6.911  12.560   1.772
  205   HH12  ARG  81          HH12      ARG  81  -7.293  14.183   2.267
  206   HH21  ARG  81          HH21      ARG  81  -9.081  13.192   5.117
  207   HH22  ARG  81          HH22      ARG  81  -8.561  14.540   4.149
  208    H    HIS  82           HN       HIS  82  -4.896   6.041   3.356
  209    HA   HIS  82           HA       HIS  82  -4.399   7.230   5.894
  210    HB2  HIS  82           HB2      HIS  82  -3.914   4.512   4.742
  211    HB3  HIS  82           HB1      HIS  82  -3.257   4.932   6.301
  212    HD1  HIS  82           HD1      HIS  82  -4.961   5.160   8.265
  213    HD2  HIS  82           HD2      HIS  82  -6.566   4.066   4.607
  214    HE1  HIS  82           HE1      HIS  82  -7.270   4.251   8.744
  215    H    SER  83           HN       SER  83  -2.420   6.551   3.110
  216    HA   SER  83           HA       SER  83   0.027   7.018   4.658
  217    HB2  SER  83           HB2      SER  83  -0.206   6.027   1.810
  218    HB3  SER  83           HB1      SER  83   1.210   5.949   2.860
  219    HG   SER  83           HG       SER  83  -1.181   4.455   2.973
  220    H    GLY  84           HN       GLY  84  -2.036   8.995   3.440
  221    HA2  GLY  84           HA2      GLY  84  -1.793  11.204   2.737
  222    HA3  GLY  84           HA1      GLY  84  -0.080  10.902   2.475
  223    H    GLU  85           HN       GLU  85   0.204   9.098   0.689
  224    HA   GLU  85           HA       GLU  85  -1.780   9.063  -1.357
  225    HB2  GLU  85           HB2      GLU  85  -0.634  10.213  -3.074
  226    HB3  GLU  85           HB1      GLU  85  -0.576  11.280  -1.686
  227    HG2  GLU  85           HG2      GLU  85   1.722  10.218  -1.241
  228    HG3  GLU  85           HG1      GLU  85   1.594   9.670  -2.904
  229    H    ALA  86           HN       ALA  86  -1.440   7.371  -2.749
  230    HA   ALA  86           HA       ALA  86   0.619   5.502  -1.946
  231    HB1  ALA  86           HB1      ALA  86  -1.644   4.649  -2.156
  232    HB2  ALA  86           HB2      ALA  86  -0.582   3.889  -3.342
  233    HB3  ALA  86           HB3      ALA  86  -1.694   5.159  -3.845
  234    H    ARG  87           HN       ARG  87   2.481   6.244  -2.787
  235    HA   ARG  87           HA       ARG  87   2.646   6.970  -5.565
  236    HB2  ARG  87           HB2      ARG  87   4.822   6.738  -3.502
  237    HB3  ARG  87           HB1      ARG  87   4.965   7.498  -5.083
  238    HG2  ARG  87           HG2      ARG  87   3.119   8.348  -2.894
  239    HG3  ARG  87           HG1      ARG  87   4.694   9.049  -3.244
  240    HD2  ARG  87           HD2      ARG  87   2.313   8.962  -5.083
  241    HD3  ARG  87           HD1      ARG  87   2.908  10.389  -4.236
  242    HE   ARG  87           HE       ARG  87   4.613   9.005  -6.203
  243   HH11  ARG  87          HH11      ARG  87   2.895  11.873  -5.126
  244   HH12  ARG  87          HH12      ARG  87   3.631  12.909  -6.316
  245   HH21  ARG  87          HH21      ARG  87   5.599  10.362  -7.746
  246   HH22  ARG  87          HH22      ARG  87   5.178  12.050  -7.809
  247    H    TYR  88           HN       TYR  88   5.003   5.120  -3.867
  248    HA   TYR  88           HA       TYR  88   5.159   3.167  -6.020
  249    HB2  TYR  88           HB2      TYR  88   6.812   3.518  -3.511
  250    HB3  TYR  88           HB1      TYR  88   7.165   2.405  -4.821
  251    HD1  TYR  88           HD1      TYR  88   6.646   6.033  -4.174
  252    HD2  TYR  88           HD2      TYR  88   8.609   3.064  -6.491
  253    HE1  TYR  88           HE1      TYR  88   7.975   7.778  -5.281
  254    HE2  TYR  88           HE2      TYR  88   9.944   4.784  -7.598
  255    HH   TYR  88           HH       TYR  88  10.069   8.020  -6.473
  256    H    ARG  89           HN       ARG  89   5.030   0.894  -5.597
  257    HA   ARG  89           HA       ARG  89   4.132   0.214  -2.887
  258    HB2  ARG  89           HB2      ARG  89   2.708  -1.504  -3.667
  259    HB3  ARG  89           HB1      ARG  89   2.302  -0.064  -4.586
  260    HG2  ARG  89           HG2      ARG  89   3.668  -0.949  -6.463
  261    HG3  ARG  89           HG1      ARG  89   3.894  -2.431  -5.522
  262    HD2  ARG  89           HD2      ARG  89   1.477  -2.732  -5.422
  263    HD3  ARG  89           HD1      ARG  89   1.261  -1.261  -6.371
  264    HE   ARG  89           HE       ARG  89   2.795  -3.487  -7.520
  265   HH11  ARG  89          HH11      ARG  89  -0.048  -1.428  -7.530
  266   HH12  ARG  89          HH12      ARG  89  -0.595  -1.982  -9.091
  267   HH21  ARG  89          HH21      ARG  89   2.056  -4.241  -9.541
  268   HH22  ARG  89          HH22      ARG  89   0.584  -3.606 -10.217
  269    H    CYS  90           HN       CYS  90   4.957  -1.598  -2.063
  270    HA   CYS  90           HA       CYS  90   7.483  -2.549  -2.850
  271    HB2  CYS  90           HB2      CYS  90   6.003  -2.766  -0.637
  272    HB3  CYS  90           HB1      CYS  90   5.586  -4.289  -1.365
  273    H    GLU  91           HN       GLU  91   7.958  -3.921  -4.530
  274    HA   GLU  91           HA       GLU  91   5.814  -4.913  -6.131
  275    HB2  GLU  91           HB2      GLU  91   7.642  -5.888  -7.534
  276    HB3  GLU  91           HB1      GLU  91   7.735  -4.143  -7.290
  277    HG2  GLU  91           HG2      GLU  91   9.350  -4.524  -5.519
  278    HG3  GLU  91           HG1      GLU  91   9.314  -6.244  -5.851
  279    H    ASP  92           HN       ASP  92   6.616  -5.983  -3.316
  280    HA   ASP  92           HA       ASP  92   6.407  -8.824  -4.050
  281    HB2  ASP  92           HB2      ASP  92   7.503  -9.286  -1.820
  282    HB3  ASP  92           HB1      ASP  92   8.539  -8.575  -3.048
  283    H    CYS  93           HN       CYS  93   5.307  -6.275  -1.809
  284    HA   CYS  93           HA       CYS  93   3.229  -8.148  -0.980
  285    HB2  CYS  93           HB2      CYS  93   3.517  -7.616   1.300
  286    HB3  CYS  93           HB1      CYS  93   5.135  -7.921   0.683
  287    H    GLY  94           HN       GLY  94   3.896  -5.385  -2.502
  288    HA2  GLY  94           HA2      GLY  94   2.632  -3.728  -3.327
  289    HA3  GLY  94           HA1      GLY  94   1.225  -4.630  -2.781
  290    H    LYS  95           HN       LYS  95   3.678  -3.404  -0.583
  291    HA   LYS  95           HA       LYS  95   1.764  -1.712   0.709
  292    HB2  LYS  95           HB2      LYS  95   4.621  -2.418   1.193
  293    HB3  LYS  95           HB1      LYS  95   3.874  -1.057   2.048
  294    HG2  LYS  95           HG2      LYS  95   2.048  -2.583   2.667
  295    HG3  LYS  95           HG1      LYS  95   2.999  -3.919   2.026
  296    HD2  LYS  95           HD2      LYS  95   4.701  -3.560   3.644
  297    HD3  LYS  95           HD1      LYS  95   3.942  -2.054   4.190
  298    HE2  LYS  95           HE2      LYS  95   2.409  -4.600   4.208
  299    HE3  LYS  95           HE1      LYS  95   3.531  -4.254   5.527
  300    HZ1  LYS  95           HZ1      LYS  95   1.400  -2.369   4.683
  301    HZ2  LYS  95           HZ2      LYS  95   2.303  -2.341   6.118
  302    HZ3  LYS  95           HZ3      LYS  95   1.146  -3.558   5.864
  303    H    LEU  96           HN       LEU  96   1.612   0.482   0.577
  304    HA   LEU  96           HA       LEU  96   2.994   1.654  -1.706
  305    HB2  LEU  96           HB2      LEU  96   0.617   2.576  -0.113
  306    HB3  LEU  96           HB1      LEU  96   1.333   3.519  -1.412
  307    HG   LEU  96           HG       LEU  96  -0.633   2.410  -2.243
  308   HD11  LEU  96          HD11      LEU  96   1.253   2.566  -3.776
  309   HD12  LEU  96          HD12      LEU  96   0.303   1.109  -4.080
  310   HD13  LEU  96          HD13      LEU  96   1.839   0.997  -3.219
  311   HD21  LEU  96          HD21      LEU  96  -0.828   0.626  -0.636
  312   HD22  LEU  96          HD22      LEU  96   0.639  -0.128  -1.263
  313   HD23  LEU  96          HD23      LEU  96  -0.809  -0.046  -2.269
  314    H    PHE  97           HN       PHE  97   4.576   3.006  -1.523
  315    HA   PHE  97           HA       PHE  97   4.898   4.507   1.000
  316    HB2  PHE  97           HB2      PHE  97   7.151   3.364  -0.674
  317    HB3  PHE  97           HB1      PHE  97   7.343   4.342   0.775
  318    HD1  PHE  97           HD2      PHE  97   6.107   1.093  -0.472
  319    HD2  PHE  97           HD1      PHE  97   7.175   3.396   2.944
  320    HE1  PHE  97           HE2      PHE  97   6.077  -0.944   0.907
  321    HE2  PHE  97           HE1      PHE  97   7.176   1.343   4.336
  322    HZ   PHE  97           HZ       PHE  97   6.358  -0.747   3.385
  323    H    THR  98           HN       THR  98   5.514   6.594   0.837
  324    HA   THR  98           HA       THR  98   4.977   7.835  -1.718
  325    HB   THR  98           HB       THR  98   5.003   9.927  -0.456
  326    HG1  THR  98           HG1      THR  98   5.660   9.992   1.661
  327   HG21  THR  98          HG21      THR  98   2.980   8.582  -0.394
  328   HG22  THR  98          HG22      THR  98   3.217   9.376   1.166
  329   HG23  THR  98          HG23      THR  98   3.613   7.664   0.973
  330    H    THR  99           HN       THR  99   7.623   6.728  -0.012
  331    HA   THR  99           HA       THR  99   9.459   8.313  -1.660
  332    HB   THR  99           HB       THR  99   9.781   7.355   1.187
  333    HG1  THR  99           HG1      THR  99  10.170   9.653   1.495
  334   HG21  THR  99          HG21      THR  99  11.789   7.015  -0.235
  335   HG22  THR  99          HG22      THR  99  12.028   8.092   1.140
  336   HG23  THR  99          HG23      THR  99  11.842   8.758  -0.486
  337    H    SER 100           HN       SER 100  10.783   7.125  -2.893
  338    HA   SER 100           HA       SER 100  10.369   4.351  -3.170
  339    HB2  SER 100           HB2      SER 100  12.285   4.566  -4.824
  340    HB3  SER 100           HB1      SER 100  10.896   5.624  -5.116
  341    HG   SER 100           HG       SER 100  13.069   6.619  -5.198
  342    H    GLY 101           HN       GLY 101  12.745   6.266  -1.474
  343    HA2  GLY 101           HA2      GLY 101  14.509   4.066  -0.959
  344    HA3  GLY 101           HA1      GLY 101  14.566   5.633  -0.187
  345    H    ASN 102           HN       ASN 102  11.927   5.677   0.917
  346    HA   ASN 102           HA       ASN 102  12.136   4.099   3.244
  347    HB2  ASN 102           HB2      ASN 102   9.696   5.289   1.913
  348    HB3  ASN 102           HB1      ASN 102   9.654   4.482   3.468
  349   HD21  ASN 102          HD21      ASN 102  12.303   5.619   4.214
  350   HD22  ASN 102          HD22      ASN 102  11.979   7.269   4.627
  351    H    LEU 103           HN       LEU 103  10.542   3.767   0.178
  352    HA   LEU 103           HA       LEU 103   9.229   1.367   0.623
  353    HB2  LEU 103           HB2      LEU 103   8.631   2.588  -1.264
  354    HB3  LEU 103           HB1      LEU 103  10.304   2.829  -1.746
  355    HG   LEU 103           HG       LEU 103  10.370   0.353  -2.274
  356   HD11  LEU 103          HD11      LEU 103   8.330  -0.811  -2.582
  357   HD12  LEU 103          HD12      LEU 103   7.373   0.646  -2.249
  358   HD13  LEU 103          HD13      LEU 103   8.290  -0.141  -0.946
  359   HD21  LEU 103          HD21      LEU 103   8.577   2.250  -3.735
  360   HD22  LEU 103          HD22      LEU 103   9.199   0.750  -4.422
  361   HD23  LEU 103          HD23      LEU 103  10.311   2.042  -3.956
  362    H    LYS 104           HN       LYS 104  12.224   1.998  -1.106
  363    HA   LYS 104           HA       LYS 104  13.352  -0.352  -1.570
  364    HB2  LYS 104           HB2      LYS 104  14.251   1.803  -2.159
  365    HB3  LYS 104           HB1      LYS 104  14.646   2.128  -0.479
  366    HG2  LYS 104           HG2      LYS 104  16.529   0.995  -0.587
  367    HG3  LYS 104           HG1      LYS 104  15.811  -0.338  -1.496
  368    HD2  LYS 104           HD2      LYS 104  16.372   2.311  -2.791
  369    HD3  LYS 104           HD1      LYS 104  17.637   1.089  -2.635
  370    HE2  LYS 104           HE2      LYS 104  16.664   0.784  -4.780
  371    HE3  LYS 104           HE1      LYS 104  16.071  -0.523  -3.761
  372    HZ1  LYS 104           HZ1      LYS 104  14.002   0.723  -3.472
  373    HZ2  LYS 104           HZ2      LYS 104  14.299   0.351  -5.090
  374    HZ3  LYS 104           HZ3      LYS 104  14.569   1.926  -4.525
  375    H    ARG 105           HN       ARG 105  13.873   1.353   1.574
  376    HA   ARG 105           HA       ARG 105  15.264  -0.634   2.868
  377    HB2  ARG 105           HB2      ARG 105  13.088   1.130   4.001
  378    HB3  ARG 105           HB1      ARG 105  14.197   0.171   4.970
  379    HG2  ARG 105           HG2      ARG 105  16.043   1.445   3.771
  380    HG3  ARG 105           HG1      ARG 105  14.770   2.564   3.280
  381    HD2  ARG 105           HD2      ARG 105  14.236   3.103   5.507
  382    HD3  ARG 105           HD1      ARG 105  15.163   1.748   6.142
  383    HE   ARG 105           HE       ARG 105  17.149   3.073   5.136
  384   HH11  ARG 105          HH11      ARG 105  14.272   4.501   6.560
  385   HH12  ARG 105          HH12      ARG 105  15.126   5.863   7.227
  386   HH21  ARG 105          HH21      ARG 105  18.276   4.845   6.052
  387   HH22  ARG 105          HH22      ARG 105  17.403   6.051   6.957
  388    H    HIS 106           HN       HIS 106  11.767  -0.268   2.665
  389    HA   HIS 106           HA       HIS 106  11.135  -2.644   4.073
  390    HB2  HIS 106           HB2      HIS 106   9.524  -0.806   3.837
  391    HB3  HIS 106           HB1      HIS 106   9.471  -1.062   2.097
  392    HD1  HIS 106           HD1      HIS 106   8.242  -2.593   5.333
  393    HD2  HIS 106           HD2      HIS 106   7.985  -3.142   1.231
  394    HE1  HIS 106           HE1      HIS 106   6.465  -4.354   4.968
  395    H    GLN 107           HN       GLN 107  12.263  -2.183   0.870
  396    HA   GLN 107           HA       GLN 107  11.044  -4.575  -0.206
  397    HB2  GLN 107           HB2      GLN 107  13.307  -3.081  -1.513
  398    HB3  GLN 107           HB1      GLN 107  12.014  -3.977  -2.285
  399    HG2  GLN 107           HG2      GLN 107  10.510  -2.113  -1.429
  400    HG3  GLN 107           HG1      GLN 107  11.989  -1.248  -1.097
  401   HE21  GLN 107          HE21      GLN 107  10.028  -2.669  -3.575
  402   HE22  GLN 107          HE22      GLN 107  10.703  -1.760  -4.903
  403    H    LEU 108           HN       LEU 108  13.874  -3.357   1.213
  404    HA   LEU 108           HA       LEU 108  15.653  -5.465   0.489
  405    HB2  LEU 108           HB2      LEU 108  15.802  -3.149   2.382
  406    HB3  LEU 108           HB1      LEU 108  17.069  -4.361   2.313
  407    HG   LEU 108           HG       LEU 108  17.984  -3.496   0.455
  408   HD11  LEU 108          HD11      LEU 108  15.240  -2.770  -0.560
  409   HD12  LEU 108          HD12      LEU 108  16.148  -4.232  -0.960
  410   HD13  LEU 108          HD13      LEU 108  16.756  -2.655  -1.467
  411   HD21  LEU 108          HD21      LEU 108  17.671  -1.088   0.224
  412   HD22  LEU 108          HD22      LEU 108  17.743  -1.559   1.924
  413   HD23  LEU 108          HD23      LEU 108  16.189  -1.182   1.178
  414    H    VAL 109           HN       VAL 109  13.489  -4.788   3.125
  415    HA   VAL 109           HA       VAL 109  14.687  -6.638   4.881
  416    HB   VAL 109           HB       VAL 109  12.705  -6.426   6.208
  417   HG11  VAL 109          HG11      VAL 109  14.137  -4.421   6.061
  418   HG12  VAL 109          HG12      VAL 109  12.448  -4.033   6.389
  419   HG13  VAL 109          HG13      VAL 109  13.099  -3.826   4.761
  420   HG21  VAL 109          HG21      VAL 109  11.064  -6.883   4.519
  421   HG22  VAL 109          HG22      VAL 109  11.438  -5.356   3.713
  422   HG23  VAL 109          HG23      VAL 109  10.669  -5.350   5.308
  423    H    HIS 110           HN       HIS 110  12.772  -6.923   2.076
  424    HA   HIS 110           HA       HIS 110  11.818  -9.599   2.699
  425    HB2  HIS 110           HB2      HIS 110  11.728  -7.872   0.251
  426    HB3  HIS 110           HB1      HIS 110  11.164  -9.522   0.228
  427    HD1  HIS 110           HD1      HIS 110   8.837  -9.963   1.328
  428    HD2  HIS 110           HD2      HIS 110  10.259  -6.086   1.634
  429    HE1  HIS 110           HE1      HIS 110   6.849  -8.517   1.934
  430    H    SER 111           HN       SER 111  14.726  -8.260   1.547
  431    HA   SER 111           HA       SER 111  15.902 -10.825   1.015
  432    HB2  SER 111           HB2      SER 111  15.556  -8.924  -1.328
  433    HB3  SER 111           HB1      SER 111  16.536 -10.390  -1.341
  434    HG   SER 111           HG       SER 111  13.992 -10.860  -0.494
  435    H    GLY 112           HN       GLY 112  16.635  -9.163   2.879
  436    HA2  GLY 112           HA2      GLY 112  18.758  -7.429   1.802
  437    HA3  GLY 112           HA1      GLY 112  17.873  -7.143   3.305
  Start of MODEL   10
    1    H    LYS  58           HT1      LYS  58 -16.915  -6.574  -5.003
    2    HA   LYS  58           HA       LYS  58 -16.580  -9.018  -3.373
    3    HB2  LYS  58           HB2      LYS  58 -14.963  -7.737  -5.511
    4    HB3  LYS  58           HB1      LYS  58 -14.092  -8.373  -4.125
    5    HG2  LYS  58           HG2      LYS  58 -16.029  -9.987  -5.761
    6    HG3  LYS  58           HG1      LYS  58 -14.287  -9.942  -6.049
    7    HD2  LYS  58           HD2      LYS  58 -13.923 -10.724  -3.733
    8    HD3  LYS  58           HD1      LYS  58 -15.669 -10.843  -3.522
    9    HE2  LYS  58           HE2      LYS  58 -15.816 -12.532  -5.217
   10    HE3  LYS  58           HE1      LYS  58 -14.114 -12.328  -5.632
   11    HZ1  LYS  58           HZ1      LYS  58 -13.496 -13.151  -3.470
   12    HZ2  LYS  58           HZ2      LYS  58 -14.518 -14.277  -4.220
   13    HZ3  LYS  58           HZ3      LYS  58 -15.120 -13.267  -2.998
   14    HA   PRO  59           HA       PRO  59 -15.511  -5.985  -0.256
   15    HB2  PRO  59           HB2      PRO  59 -14.949  -7.735   1.716
   16    HB3  PRO  59           HB1      PRO  59 -16.611  -7.376   1.227
   17    HG2  PRO  59           HG2      PRO  59 -14.883  -9.702   0.504
   18    HG3  PRO  59           HG1      PRO  59 -16.603  -9.681   0.936
   19    HD2  PRO  59           HD2      PRO  59 -15.692  -9.806  -1.639
   20    HD3  PRO  59           HD1      PRO  59 -17.242  -9.088  -1.185
   21    H    TYR  60           HN       TYR  60 -13.701  -5.023  -0.466
   22    HA   TYR  60           HA       TYR  60 -11.162  -6.526  -0.341
   23    HB2  TYR  60           HB2      TYR  60 -11.770  -3.963  -1.835
   24    HB3  TYR  60           HB1      TYR  60 -10.167  -4.678  -1.681
   25    HD1  TYR  60           HD2      TYR  60 -10.630  -7.483  -2.166
   26    HD2  TYR  60           HD1      TYR  60 -12.365  -4.095  -4.055
   27    HE1  TYR  60           HE2      TYR  60 -11.064  -8.830  -4.164
   28    HE2  TYR  60           HE1      TYR  60 -12.802  -5.435  -6.062
   29    HH   TYR  60           HH       TYR  60 -12.698  -8.770  -6.106
   30    H    GLY  61           HN       GLY  61 -10.403  -6.214   1.712
   31    HA2  GLY  61           HA2      GLY  61 -10.977  -3.591   2.884
   32    HA3  GLY  61           HA1      GLY  61 -10.955  -5.077   3.811
   33    H    CYS  62           HN       CYS  62  -9.610  -2.564   4.084
   34    HA   CYS  62           HA       CYS  62  -6.906  -2.615   3.403
   35    HB2  CYS  62           HB2      CYS  62  -8.122  -0.617   4.136
   36    HB3  CYS  62           HB1      CYS  62  -8.267  -1.295   5.755
   37    H    GLU  63           HN       GLU  63  -5.146  -3.452   4.296
   38    HA   GLU  63           HA       GLU  63  -5.357  -5.569   6.198
   39    HB2  GLU  63           HB2      GLU  63  -3.714  -5.601   4.373
   40    HB3  GLU  63           HB1      GLU  63  -2.940  -4.167   5.031
   41    HG2  GLU  63           HG2      GLU  63  -2.667  -5.658   7.161
   42    HG3  GLU  63           HG1      GLU  63  -2.877  -6.975   6.008
   43    H    GLU  64           HN       GLU  64  -4.661  -2.181   6.345
   44    HA   GLU  64           HA       GLU  64  -3.088  -2.440   8.748
   45    HB2  GLU  64           HB2      GLU  64  -1.947  -0.891   7.671
   46    HB3  GLU  64           HB1      GLU  64  -3.197  -0.747   6.461
   47    HG2  GLU  64           HG2      GLU  64  -3.691   0.631   8.993
   48    HG3  GLU  64           HG1      GLU  64  -2.380   1.267   8.001
   49    H    CYS  65           HN       CYS  65  -6.198  -1.087   7.746
   50    HA   CYS  65           HA       CYS  65  -6.670  -0.363  10.566
   51    HB2  CYS  65           HB2      CYS  65  -8.387   1.227   9.702
   52    HB3  CYS  65           HB1      CYS  65  -6.760   1.610   9.150
   53    H    GLY  66           HN       GLY  66  -7.781  -1.930   7.703
   54    HA2  GLY  66           HA2      GLY  66  -8.820  -3.992   7.727
   55    HA3  GLY  66           HA1      GLY  66  -9.333  -3.697   9.382
   56    H    LYS  67           HN       LYS  67  -9.923  -1.155   7.153
   57    HA   LYS  67           HA       LYS  67 -12.780  -1.682   7.294
   58    HB2  LYS  67           HB2      LYS  67 -11.349   0.653   6.006
   59    HB3  LYS  67           HB1      LYS  67 -13.064   0.548   6.371
   60    HG2  LYS  67           HG2      LYS  67 -10.809   0.662   8.364
   61    HG3  LYS  67           HG1      LYS  67 -11.964   1.943   7.999
   62    HD2  LYS  67           HD2      LYS  67 -12.708  -0.757   9.120
   63    HD3  LYS  67           HD1      LYS  67 -12.468   0.694  10.093
   64    HE2  LYS  67           HE2      LYS  67 -14.478   0.449   7.858
   65    HE3  LYS  67           HE1      LYS  67 -14.852   0.201   9.563
   66    HZ1  LYS  67           HZ1      LYS  67 -13.917   2.720   8.290
   67    HZ2  LYS  67           HZ2      LYS  67 -14.057   2.499   9.965
   68    HZ3  LYS  67           HZ3      LYS  67 -15.434   2.421   8.987
   69    H    SER  68           HN       SER  68 -14.005  -2.414   5.623
   70    HA   SER  68           HA       SER  68 -12.514  -3.307   3.293
   71    HB2  SER  68           HB2      SER  68 -15.293  -4.163   3.455
   72    HB3  SER  68           HB1      SER  68 -13.819  -5.122   3.283
   73    HG   SER  68           HG       SER  68 -13.530  -5.128   5.460
   74    H    TYR  69           HN       TYR  69 -12.877  -2.741   1.278
   75    HA   TYR  69           HA       TYR  69 -15.083  -0.851   0.743
   76    HB2  TYR  69           HB2      TYR  69 -12.306  -1.014  -0.416
   77    HB3  TYR  69           HB1      TYR  69 -13.603  -0.213  -1.289
   78    HD1  TYR  69           HD2      TYR  69 -11.800  -0.237   1.948
   79    HD2  TYR  69           HD1      TYR  69 -14.129   1.997  -0.812
   80    HE1  TYR  69           HE2      TYR  69 -11.389   1.796   3.262
   81    HE2  TYR  69           HE1      TYR  69 -13.729   4.034   0.479
   82    HH   TYR  69           HH       TYR  69 -11.420   4.156   3.082
   83    H    ARG  70           HN       ARG  70 -15.408  -0.879  -1.837
   84    HA   ARG  70           HA       ARG  70 -16.122  -3.656  -2.415
   85    HB2  ARG  70           HB2      ARG  70 -17.979  -2.071  -2.355
   86    HB3  ARG  70           HB1      ARG  70 -17.187  -1.074  -3.567
   87    HG2  ARG  70           HG2      ARG  70 -17.738  -2.451  -5.277
   88    HG3  ARG  70           HG1      ARG  70 -17.707  -3.904  -4.269
   89    HD2  ARG  70           HD2      ARG  70 -19.842  -1.769  -4.251
   90    HD3  ARG  70           HD1      ARG  70 -19.981  -3.366  -4.988
   91    HE   ARG  70           HE       ARG  70 -19.294  -3.703  -2.290
   92   HH11  ARG  70          HH11      ARG  70 -22.000  -2.589  -4.237
   93   HH12  ARG  70          HH12      ARG  70 -23.186  -2.997  -3.032
   94   HH21  ARG  70          HH21      ARG  70 -20.869  -4.214  -0.702
   95   HH22  ARG  70          HH22      ARG  70 -22.552  -3.906  -1.035
   96    H    LEU  71           HN       LEU  71 -14.572  -0.822  -3.833
   97    HA   LEU  71           HA       LEU  71 -13.750  -2.423  -6.134
   98    HB2  LEU  71           HB2      LEU  71 -13.907   0.513  -5.546
   99    HB3  LEU  71           HB1      LEU  71 -12.877  -0.071  -6.843
  100    HG   LEU  71           HG       LEU  71 -14.690  -0.792  -8.124
  101   HD11  LEU  71          HD11      LEU  71 -15.910  -2.004  -6.402
  102   HD12  LEU  71          HD12      LEU  71 -16.983  -0.978  -7.357
  103   HD13  LEU  71          HD13      LEU  71 -16.490  -0.474  -5.741
  104   HD21  LEU  71          HD21      LEU  71 -16.159   1.133  -8.290
  105   HD22  LEU  71          HD22      LEU  71 -14.486   1.637  -8.041
  106   HD23  LEU  71          HD23      LEU  71 -15.633   1.677  -6.700
  107    H    ILE  72           HN       ILE  72 -11.580  -2.584  -6.741
  108    HA   ILE  72           HA       ILE  72  -9.655  -2.656  -4.669
  109    HB   ILE  72           HB       ILE  72  -9.366  -2.777  -7.670
  110   HG12  ILE  72          HG12      ILE  72 -10.375  -4.689  -6.408
  111   HG13  ILE  72          HG11      ILE  72  -8.905  -5.114  -7.284
  112   HG21  ILE  72          HG21      ILE  72  -7.350  -1.737  -6.816
  113   HG22  ILE  72          HG22      ILE  72  -7.017  -3.391  -7.330
  114   HG23  ILE  72          HG23      ILE  72  -7.176  -3.015  -5.615
  115   HD11  ILE  72          HD11      ILE  72  -8.968  -6.119  -5.066
  116   HD12  ILE  72          HD12      ILE  72  -9.094  -4.517  -4.337
  117   HD13  ILE  72          HD13      ILE  72  -7.634  -4.976  -5.213
  118    H    SER  73           HN       SER  73 -10.223  -0.382  -7.335
  119    HA   SER  73           HA       SER  73  -8.171   1.414  -6.675
  120    HB2  SER  73           HB2      SER  73 -10.813   2.090  -7.983
  121    HB3  SER  73           HB1      SER  73  -9.297   2.978  -8.135
  122    HG   SER  73           HG       SER  73  -9.415   1.717  -9.931
  123    H    LEU  74           HN       LEU  74 -11.473   1.136  -5.549
  124    HA   LEU  74           HA       LEU  74 -11.737   3.405  -4.019
  125    HB2  LEU  74           HB2      LEU  74 -12.964   0.808  -4.269
  126    HB3  LEU  74           HB1      LEU  74 -12.860   1.261  -2.572
  127    HG   LEU  74           HG       LEU  74 -14.201   2.842  -4.758
  128   HD11  LEU  74          HD11      LEU  74 -15.327   1.448  -2.327
  129   HD12  LEU  74          HD12      LEU  74 -15.453   0.858  -3.985
  130   HD13  LEU  74          HD13      LEU  74 -16.237   2.370  -3.525
  131   HD21  LEU  74          HD21      LEU  74 -13.656   3.359  -1.868
  132   HD22  LEU  74          HD22      LEU  74 -14.826   4.284  -2.824
  133   HD23  LEU  74          HD23      LEU  74 -13.110   4.294  -3.257
  134    H    LEU  75           HN       LEU  75 -10.582   0.275  -3.047
  135    HA   LEU  75           HA       LEU  75  -9.821   1.074  -0.431
  136    HB2  LEU  75           HB2      LEU  75 -10.389  -1.159  -0.663
  137    HB3  LEU  75           HB1      LEU  75  -9.508  -1.326  -2.177
  138    HG   LEU  75           HG       LEU  75  -7.398  -1.041  -0.760
  139   HD11  LEU  75          HD11      LEU  75  -7.621  -1.772   1.565
  140   HD12  LEU  75          HD12      LEU  75  -9.378  -1.745   1.401
  141   HD13  LEU  75          HD13      LEU  75  -8.459  -0.244   1.275
  142   HD21  LEU  75          HD21      LEU  75  -7.441  -3.446  -0.258
  143   HD22  LEU  75          HD22      LEU  75  -8.052  -3.052  -1.872
  144   HD23  LEU  75          HD23      LEU  75  -9.184  -3.445  -0.570
  145    H    ASN  76           HN       ASN  76  -8.405   1.053  -3.525
  146    HA   ASN  76           HA       ASN  76  -5.652   1.142  -2.771
  147    HB2  ASN  76           HB2      ASN  76  -7.109   0.904  -5.142
  148    HB3  ASN  76           HB1      ASN  76  -6.270   2.449  -5.295
  149   HD21  ASN  76          HD21      ASN  76  -5.996  -0.316  -6.509
  150   HD22  ASN  76          HD22      ASN  76  -4.300  -0.677  -6.375
  151    H    LEU  77           HN       LEU  77  -8.177   3.488  -3.456
  152    HA   LEU  77           HA       LEU  77  -6.437   5.734  -3.097
  153    HB2  LEU  77           HB2      LEU  77  -9.290   5.233  -3.695
  154    HB3  LEU  77           HB1      LEU  77  -8.900   6.763  -2.946
  155    HG   LEU  77           HG       LEU  77  -9.038   6.622  -5.513
  156   HD11  LEU  77          HD11      LEU  77  -6.660   7.820  -4.123
  157   HD12  LEU  77          HD12      LEU  77  -8.259   8.544  -4.259
  158   HD13  LEU  77          HD13      LEU  77  -7.271   8.310  -5.703
  159   HD21  LEU  77          HD21      LEU  77  -7.625   4.650  -5.795
  160   HD22  LEU  77          HD22      LEU  77  -6.266   5.525  -5.087
  161   HD23  LEU  77          HD23      LEU  77  -6.947   6.053  -6.624
  162    H    HIS  78           HN       HIS  78  -8.435   3.718  -1.173
  163    HA   HIS  78           HA       HIS  78  -8.502   5.304   1.177
  164    HB2  HIS  78           HB2      HIS  78  -9.983   3.436   1.076
  165    HB3  HIS  78           HB1      HIS  78  -8.675   2.325   0.665
  166    HD1  HIS  78           HD1      HIS  78 -10.354   3.967   3.575
  167    HD2  HIS  78           HD2      HIS  78  -7.153   1.423   2.816
  168    HE1  HIS  78           HE1      HIS  78  -9.647   3.027   5.810
  169    H    LYS  79           HN       LYS  79  -6.273   2.925  -0.135
  170    HA   LYS  79           HA       LYS  79  -4.469   2.940   2.072
  171    HB2  LYS  79           HB2      LYS  79  -4.761   1.144   0.277
  172    HB3  LYS  79           HB1      LYS  79  -3.824   2.186  -0.786
  173    HG2  LYS  79           HG2      LYS  79  -1.934   2.064   0.758
  174    HG3  LYS  79           HG1      LYS  79  -2.880   1.028   1.830
  175    HD2  LYS  79           HD2      LYS  79  -2.047   0.395  -1.003
  176    HD3  LYS  79           HD1      LYS  79  -1.381  -0.314   0.467
  177    HE2  LYS  79           HE2      LYS  79  -3.553  -1.308   0.982
  178    HE3  LYS  79           HE1      LYS  79  -4.243  -0.568  -0.462
  179    HZ1  LYS  79           HZ1      LYS  79  -2.063  -2.594  -0.426
  180    HZ2  LYS  79           HZ2      LYS  79  -2.733  -1.886  -1.818
  181    HZ3  LYS  79           HZ3      LYS  79  -3.684  -2.890  -0.833
  182    H    LYS  80           HN       LYS  80  -4.656   4.597  -1.031
  183    HA   LYS  80           HA       LYS  80  -2.359   6.181  -0.801
  184    HB2  LYS  80           HB2      LYS  80  -3.381   6.135  -2.915
  185    HB3  LYS  80           HB1      LYS  80  -4.969   6.500  -2.264
  186    HG2  LYS  80           HG2      LYS  80  -4.373   8.779  -1.904
  187    HG3  LYS  80           HG1      LYS  80  -2.686   8.460  -2.266
  188    HD2  LYS  80           HD2      LYS  80  -4.836   7.947  -4.287
  189    HD3  LYS  80           HD1      LYS  80  -4.154   9.561  -4.075
  190    HE2  LYS  80           HE2      LYS  80  -1.948   8.742  -4.561
  191    HE3  LYS  80           HE1      LYS  80  -2.541   7.085  -4.613
  192    HZ1  LYS  80           HZ1      LYS  80  -3.721   7.508  -6.591
  193    HZ2  LYS  80           HZ2      LYS  80  -2.188   8.194  -6.829
  194    HZ3  LYS  80           HZ3      LYS  80  -3.519   9.188  -6.469
  195    H    ARG  81           HN       ARG  81  -5.605   6.554   0.531
  196    HA   ARG  81           HA       ARG  81  -5.331   9.258   1.288
  197    HB2  ARG  81           HB2      ARG  81  -7.479   7.985   1.095
  198    HB3  ARG  81           HB1      ARG  81  -7.084   7.197   2.618
  199    HG2  ARG  81           HG2      ARG  81  -7.197   9.246   3.804
  200    HG3  ARG  81           HG1      ARG  81  -7.287  10.177   2.308
  201    HD2  ARG  81           HD2      ARG  81  -9.432   9.000   1.812
  202    HD3  ARG  81           HD1      ARG  81  -9.360   8.310   3.434
  203    HE   ARG  81           HE       ARG  81  -9.119  10.938   3.928
  204   HH11  ARG  81          HH11      ARG  81 -11.402   9.116   1.985
  205   HH12  ARG  81          HH12      ARG  81 -12.692  10.262   2.201
  206   HH21  ARG  81          HH21      ARG  81 -10.821  12.449   4.217
  207   HH22  ARG  81          HH22      ARG  81 -12.365  12.141   3.478
  208    H    HIS  82           HN       HIS  82  -4.446   6.269   2.928
  209    HA   HIS  82           HA       HIS  82  -3.978   7.491   5.462
  210    HB2  HIS  82           HB2      HIS  82  -3.215   4.839   4.282
  211    HB3  HIS  82           HB1      HIS  82  -2.658   5.325   5.863
  212    HD1  HIS  82           HD1      HIS  82  -4.662   5.776   7.649
  213    HD2  HIS  82           HD2      HIS  82  -5.600   3.720   4.168
  214    HE1  HIS  82           HE1      HIS  82  -6.777   4.485   8.129
  215    H    SER  83           HN       SER  83  -1.860   6.479   2.787
  216    HA   SER  83           HA       SER  83   0.523   7.338   4.115
  217    HB2  SER  83           HB2      SER  83   1.596   6.915   1.902
  218    HB3  SER  83           HB1      SER  83   0.638   5.550   2.473
  219    HG   SER  83           HG       SER  83   0.414   6.799   0.178
  220    H    GLY  84           HN       GLY  84  -1.924   8.902   2.395
  221    HA2  GLY  84           HA2      GLY  84  -1.993  11.312   2.250
  222    HA3  GLY  84           HA1      GLY  84  -0.245  11.296   2.017
  223    H    GLU  85           HN       GLU  85   0.172   9.442   0.191
  224    HA   GLU  85           HA       GLU  85  -1.750   9.383  -1.906
  225    HB2  GLU  85           HB2      GLU  85  -0.540  10.515  -3.613
  226    HB3  GLU  85           HB1      GLU  85  -0.620  11.609  -2.249
  227    HG2  GLU  85           HG2      GLU  85   1.688  10.744  -1.640
  228    HG3  GLU  85           HG1      GLU  85   1.705  10.062  -3.259
  229    H    ALA  86           HN       ALA  86  -1.394   7.668  -3.224
  230    HA   ALA  86           HA       ALA  86   0.564   5.770  -2.330
  231    HB1  ALA  86           HB1      ALA  86  -0.501   4.252  -3.950
  232    HB2  ALA  86           HB2      ALA  86  -1.538   5.575  -4.473
  233    HB3  ALA  86           HB3      ALA  86  -1.653   4.962  -2.825
  234    H    ARG  87           HN       ARG  87   2.516   6.523  -2.906
  235    HA   ARG  87           HA       ARG  87   3.047   7.310  -5.600
  236    HB2  ARG  87           HB2      ARG  87   4.854   6.908  -3.230
  237    HB3  ARG  87           HB1      ARG  87   5.362   7.581  -4.776
  238    HG2  ARG  87           HG2      ARG  87   3.285   8.697  -2.951
  239    HG3  ARG  87           HG1      ARG  87   4.951   9.248  -3.097
  240    HD2  ARG  87           HD2      ARG  87   2.734   9.392  -5.112
  241    HD3  ARG  87           HD1      ARG  87   3.674  10.731  -4.434
  242    HE   ARG  87           HE       ARG  87   4.363   9.087  -6.691
  243   HH11  ARG  87          HH11      ARG  87   5.676  11.088  -4.124
  244   HH12  ARG  87          HH12      ARG  87   7.196  11.336  -4.929
  245   HH21  ARG  87          HH21      ARG  87   6.371   9.402  -7.737
  246   HH22  ARG  87          HH22      ARG  87   7.587  10.394  -6.979
  247    H    TYR  88           HN       TYR  88   5.242   5.381  -3.831
  248    HA   TYR  88           HA       TYR  88   5.602   3.537  -6.045
  249    HB2  TYR  88           HB2      TYR  88   6.961   3.664  -3.346
  250    HB3  TYR  88           HB1      TYR  88   7.469   2.696  -4.715
  251    HD1  TYR  88           HD1      TYR  88   6.878   6.222  -3.718
  252    HD2  TYR  88           HD2      TYR  88   9.092   3.528  -6.145
  253    HE1  TYR  88           HE1      TYR  88   8.319   8.069  -4.426
  254    HE2  TYR  88           HE2      TYR  88  10.548   5.374  -6.873
  255    HH   TYR  88           HH       TYR  88  10.635   7.729  -6.992
  256    H    ARG  89           HN       ARG  89   5.363   1.240  -5.815
  257    HA   ARG  89           HA       ARG  89   4.181   0.405  -3.259
  258    HB2  ARG  89           HB2      ARG  89   2.795  -1.204  -4.291
  259    HB3  ARG  89           HB1      ARG  89   2.540   0.286  -5.184
  260    HG2  ARG  89           HG2      ARG  89   4.117  -0.546  -6.910
  261    HG3  ARG  89           HG1      ARG  89   4.188  -2.074  -6.021
  262    HD2  ARG  89           HD2      ARG  89   1.786  -2.332  -6.260
  263    HD3  ARG  89           HD1      ARG  89   1.713  -0.812  -7.158
  264    HE   ARG  89           HE       ARG  89   3.430  -2.137  -8.668
  265   HH11  ARG  89          HH11      ARG  89   0.439  -3.250  -7.216
  266   HH12  ARG  89          HH12      ARG  89   0.145  -4.448  -8.432
  267   HH21  ARG  89          HH21      ARG  89   3.037  -3.717 -10.281
  268   HH22  ARG  89          HH22      ARG  89   1.604  -4.702 -10.184
  269    H    CYS  90           HN       CYS  90   4.789  -1.579  -2.541
  270    HA   CYS  90           HA       CYS  90   7.317  -2.653  -3.239
  271    HB2  CYS  90           HB2      CYS  90   6.273  -2.930  -1.043
  272    HB3  CYS  90           HB1      CYS  90   4.955  -3.812  -1.758
  273    H    GLU  91           HN       GLU  91   7.665  -3.607  -5.216
  274    HA   GLU  91           HA       GLU  91   5.595  -4.600  -6.841
  275    HB2  GLU  91           HB2      GLU  91   7.345  -5.462  -8.284
  276    HB3  GLU  91           HB1      GLU  91   7.737  -3.829  -7.741
  277    HG2  GLU  91           HG2      GLU  91   9.076  -4.927  -5.938
  278    HG3  GLU  91           HG1      GLU  91   8.886  -6.431  -6.825
  279    H    ASP  92           HN       ASP  92   6.553  -5.852  -4.034
  280    HA   ASP  92           HA       ASP  92   6.359  -8.635  -4.911
  281    HB2  ASP  92           HB2      ASP  92   8.353  -8.022  -3.549
  282    HB3  ASP  92           HB1      ASP  92   7.274  -7.582  -2.226
  283    H    CYS  93           HN       CYS  93   5.011  -6.275  -2.535
  284    HA   CYS  93           HA       CYS  93   2.801  -8.157  -2.332
  285    HB2  CYS  93           HB2      CYS  93   2.747  -8.091   0.003
  286    HB3  CYS  93           HB1      CYS  93   4.440  -8.299  -0.403
  287    H    GLY  94           HN       GLY  94   3.768  -5.075  -3.021
  288    HA2  GLY  94           HA2      GLY  94   2.564  -3.463  -4.013
  289    HA3  GLY  94           HA1      GLY  94   1.108  -4.397  -3.742
  290    H    LYS  95           HN       LYS  95   3.344  -3.186  -1.298
  291    HA   LYS  95           HA       LYS  95   1.219  -1.607  -0.116
  292    HB2  LYS  95           HB2      LYS  95   4.069  -2.009   0.775
  293    HB3  LYS  95           HB1      LYS  95   2.767  -1.282   1.721
  294    HG2  LYS  95           HG2      LYS  95   1.584  -3.526   1.295
  295    HG3  LYS  95           HG1      LYS  95   3.207  -4.114   0.937
  296    HD2  LYS  95           HD2      LYS  95   3.977  -3.698   3.056
  297    HD3  LYS  95           HD1      LYS  95   2.676  -2.565   3.432
  298    HE2  LYS  95           HE2      LYS  95   1.080  -4.486   3.291
  299    HE3  LYS  95           HE1      LYS  95   2.466  -5.561   3.134
  300    HZ1  LYS  95           HZ1      LYS  95   1.720  -5.507   5.403
  301    HZ2  LYS  95           HZ2      LYS  95   1.843  -3.822   5.461
  302    HZ3  LYS  95           HZ3      LYS  95   3.242  -4.770   5.311
  303    H    LEU  96           HN       LEU  96   1.230   0.621  -0.076
  304    HA   LEU  96           HA       LEU  96   2.925   1.783  -2.145
  305    HB2  LEU  96           HB2      LEU  96   0.311   2.629  -0.936
  306    HB3  LEU  96           HB1      LEU  96   1.237   3.688  -1.995
  307    HG   LEU  96           HG       LEU  96  -0.554   2.606  -3.229
  308   HD11  LEU  96          HD11      LEU  96   2.171   1.548  -3.920
  309   HD12  LEU  96          HD12      LEU  96   1.436   3.053  -4.483
  310   HD13  LEU  96          HD13      LEU  96   0.778   1.495  -4.999
  311   HD21  LEU  96          HD21      LEU  96   0.718   0.015  -2.392
  312   HD22  LEU  96          HD22      LEU  96  -0.578   0.179  -3.579
  313   HD23  LEU  96          HD23      LEU  96  -0.863   0.617  -1.893
  314    H    PHE  97           HN       PHE  97   4.539   3.041  -1.660
  315    HA   PHE  97           HA       PHE  97   4.519   4.428   0.949
  316    HB2  PHE  97           HB2      PHE  97   6.942   3.393  -0.550
  317    HB3  PHE  97           HB1      PHE  97   6.977   4.268   0.971
  318    HD1  PHE  97           HD2      PHE  97   6.016   1.084  -0.621
  319    HD2  PHE  97           HD1      PHE  97   6.452   3.208   3.046
  320    HE1  PHE  97           HE2      PHE  97   5.712  -1.021   0.642
  321    HE2  PHE  97           HE1      PHE  97   6.158   1.104   4.297
  322    HZ   PHE  97           HZ       PHE  97   5.797  -1.006   3.086
  323    H    THR  98           HN       THR  98   4.965   6.535   0.985
  324    HA   THR  98           HA       THR  98   4.826   7.986  -1.489
  325    HB   THR  98           HB       THR  98   4.705   9.955  -0.072
  326    HG1  THR  98           HG1      THR  98   6.322   9.313   1.475
  327   HG21  THR  98          HG21      THR  98   2.700   8.604  -0.254
  328   HG22  THR  98          HG22      THR  98   2.811   9.276   1.375
  329   HG23  THR  98          HG23      THR  98   3.238   7.585   1.080
  330    H    THR  99           HN       THR  99   7.234   6.508   0.113
  331    HA   THR  99           HA       THR  99   9.297   8.327  -0.865
  332    HB   THR  99           HB       THR  99   9.180   6.996   1.848
  333    HG1  THR  99           HG1      THR  99   9.437   9.752   1.638
  334   HG21  THR  99          HG21      THR  99  11.428   7.068   0.928
  335   HG22  THR  99          HG22      THR  99  11.264   8.148   2.310
  336   HG23  THR  99          HG23      THR  99  11.280   8.804   0.672
  337    H    SER 100           HN       SER 100  10.859   7.244  -1.961
  338    HA   SER 100           HA       SER 100  10.518   4.464  -2.464
  339    HB2  SER 100           HB2      SER 100  12.549   4.737  -3.888
  340    HB3  SER 100           HB1      SER 100  11.283   5.918  -4.245
  341    HG   SER 100           HG       SER 100  13.210   7.022  -4.118
  342    H    GLY 101           HN       GLY 101  12.452   6.363  -0.324
  343    HA2  GLY 101           HA2      GLY 101  14.275   4.281   0.397
  344    HA3  GLY 101           HA1      GLY 101  13.994   5.764   1.279
  345    H    ASN 102           HN       ASN 102  11.287   5.563   1.906
  346    HA   ASN 102           HA       ASN 102  11.183   3.734   4.052
  347    HB2  ASN 102           HB2      ASN 102   8.953   5.023   2.460
  348    HB3  ASN 102           HB1      ASN 102   8.679   4.050   3.889
  349   HD21  ASN 102          HD21      ASN 102   7.758   5.701   5.052
  350   HD22  ASN 102          HD22      ASN 102   8.647   7.073   5.627
  351    H    LEU 103           HN       LEU 103  10.231   3.668   0.722
  352    HA   LEU 103           HA       LEU 103   8.870   1.237   0.743
  353    HB2  LEU 103           HB2      LEU 103   8.547   2.659  -1.084
  354    HB3  LEU 103           HB1      LEU 103  10.277   2.882  -1.323
  355    HG   LEU 103           HG       LEU 103  10.378   0.463  -2.014
  356   HD11  LEU 103          HD11      LEU 103   7.402   0.758  -2.336
  357   HD12  LEU 103          HD12      LEU 103   8.150  -0.052  -0.949
  358   HD13  LEU 103          HD13      LEU 103   8.404  -0.692  -2.573
  359   HD21  LEU 103          HD21      LEU 103  10.515   2.237  -3.580
  360   HD22  LEU 103          HD22      LEU 103   8.774   2.478  -3.523
  361   HD23  LEU 103          HD23      LEU 103   9.436   1.006  -4.245
  362    H    LYS 104           HN       LYS 104  12.146   2.157  -0.145
  363    HA   LYS 104           HA       LYS 104  13.299  -0.218  -0.797
  364    HB2  LYS 104           HB2      LYS 104  14.325   1.966  -1.039
  365    HB3  LYS 104           HB1      LYS 104  14.451   2.122   0.705
  366    HG2  LYS 104           HG2      LYS 104  16.008   0.283   0.792
  367    HG3  LYS 104           HG1      LYS 104  15.855   0.044  -0.955
  368    HD2  LYS 104           HD2      LYS 104  16.795   2.608   0.308
  369    HD3  LYS 104           HD1      LYS 104  17.889   1.332  -0.234
  370    HE2  LYS 104           HE2      LYS 104  16.918   1.535  -2.503
  371    HE3  LYS 104           HE1      LYS 104  15.933   2.880  -1.929
  372    HZ1  LYS 104           HZ1      LYS 104  17.921   3.646  -3.065
  373    HZ2  LYS 104           HZ2      LYS 104  18.903   2.804  -1.966
  374    HZ3  LYS 104           HZ3      LYS 104  17.958   4.102  -1.433
  375    H    ARG 105           HN       ARG 105  13.173   1.233   2.461
  376    HA   ARG 105           HA       ARG 105  14.405  -0.768   3.906
  377    HB2  ARG 105           HB2      ARG 105  12.037   0.975   4.590
  378    HB3  ARG 105           HB1      ARG 105  12.809  -0.077   5.767
  379    HG2  ARG 105           HG2      ARG 105  14.305   2.031   4.241
  380    HG3  ARG 105           HG1      ARG 105  13.520   2.334   5.796
  381    HD2  ARG 105           HD2      ARG 105  15.693   0.325   5.223
  382    HD3  ARG 105           HD1      ARG 105  15.846   1.814   6.157
  383    HE   ARG 105           HE       ARG 105  14.052   0.680   7.634
  384   HH11  ARG 105          HH11      ARG 105  16.736  -0.935   6.052
  385   HH12  ARG 105          HH12      ARG 105  16.727  -2.284   7.151
  386   HH21  ARG 105          HH21      ARG 105  14.079  -1.053   9.096
  387   HH22  ARG 105          HH22      ARG 105  15.229  -2.343   8.900
  388    H    HIS 106           HN       HIS 106  11.071  -0.539   2.858
  389    HA   HIS 106           HA       HIS 106  10.261  -3.023   4.019
  390    HB2  HIS 106           HB2      HIS 106   8.666  -1.213   3.759
  391    HB3  HIS 106           HB1      HIS 106   8.922  -1.196   2.018
  392    HD1  HIS 106           HD1      HIS 106   7.250  -3.211   4.738
  393    HD2  HIS 106           HD2      HIS 106   7.590  -3.066   0.605
  394    HE1  HIS 106           HE1      HIS 106   5.480  -4.767   3.833
  395    H    GLN 107           HN       GLN 107  11.936  -2.214   1.174
  396    HA   GLN 107           HA       GLN 107  10.939  -4.464  -0.362
  397    HB2  GLN 107           HB2      GLN 107  13.311  -2.676  -0.977
  398    HB3  GLN 107           HB1      GLN 107  12.490  -3.750  -2.100
  399    HG2  GLN 107           HG2      GLN 107  10.681  -1.809  -1.003
  400    HG3  GLN 107           HG1      GLN 107  12.095  -1.043  -1.711
  401   HE21  GLN 107          HE21      GLN 107   9.271  -2.912  -2.340
  402   HE22  GLN 107          HE22      GLN 107   9.334  -2.781  -4.075
  403    H    LEU 108           HN       LEU 108  13.387  -3.451   1.756
  404    HA   LEU 108           HA       LEU 108  15.332  -5.480   1.208
  405    HB2  LEU 108           HB2      LEU 108  15.007  -3.307   3.219
  406    HB3  LEU 108           HB1      LEU 108  16.233  -4.536   3.437
  407    HG   LEU 108           HG       LEU 108  17.599  -3.667   1.848
  408   HD11  LEU 108          HD11      LEU 108  16.884  -2.550  -0.177
  409   HD12  LEU 108          HD12      LEU 108  15.210  -2.561   0.388
  410   HD13  LEU 108          HD13      LEU 108  16.024  -4.080   0.011
  411   HD21  LEU 108          HD21      LEU 108  15.814  -1.327   2.463
  412   HD22  LEU 108          HD22      LEU 108  17.470  -1.232   1.846
  413   HD23  LEU 108          HD23      LEU 108  17.163  -1.902   3.451
  414    H    VAL 109           HN       VAL 109  12.526  -5.235   3.117
  415    HA   VAL 109           HA       VAL 109  13.382  -7.287   4.916
  416    HB   VAL 109           HB       VAL 109  11.158  -7.188   5.821
  417   HG11  VAL 109          HG11      VAL 109  11.994  -4.431   4.975
  418   HG12  VAL 109          HG12      VAL 109  12.622  -5.303   6.378
  419   HG13  VAL 109          HG13      VAL 109  10.926  -4.818   6.325
  420   HG21  VAL 109          HG21      VAL 109   9.904  -7.235   3.779
  421   HG22  VAL 109          HG22      VAL 109  10.497  -5.626   3.357
  422   HG23  VAL 109          HG23      VAL 109   9.402  -5.833   4.732
  423    H    HIS 110           HN       HIS 110  12.070  -7.042   1.784
  424    HA   HIS 110           HA       HIS 110  11.169  -9.835   1.761
  425    HB2  HIS 110           HB2      HIS 110  11.090  -7.611  -0.257
  426    HB3  HIS 110           HB1      HIS 110  10.696  -9.253  -0.685
  427    HD1  HIS 110           HD1      HIS 110   8.339 -10.080  -0.046
  428    HD2  HIS 110           HD2      HIS 110   9.341  -6.338   1.402
  429    HE1  HIS 110           HE1      HIS 110   6.169  -8.975   0.639
  430    H    SER 111           HN       SER 111  14.011  -8.193   1.457
  431    HA   SER 111           HA       SER 111  15.340 -10.420   0.172
  432    HB2  SER 111           HB2      SER 111  14.582  -8.810  -1.664
  433    HB3  SER 111           HB1      SER 111  15.696  -7.636  -0.970
  434    HG   SER 111           HG       SER 111  16.224  -9.570  -2.695
  435    H    GLY 112           HN       GLY 112  15.389  -9.639   2.767
  436    HA2  GLY 112           HA2      GLY 112  18.098  -8.598   3.119
  437    HA3  GLY 112           HA1      GLY 112  16.761  -7.699   3.856
  Start of MODEL   11
    1    H    LYS  58           HT1      LYS  58 -17.769  -7.115  -5.442
    2    HA   LYS  58           HA       LYS  58 -17.120  -8.889  -4.046
    3    HB2  LYS  58           HB2      LYS  58 -14.517  -8.760  -5.575
    4    HB3  LYS  58           HB1      LYS  58 -14.708  -9.626  -4.059
    5    HG2  LYS  58           HG2      LYS  58 -16.571 -10.913  -5.216
    6    HG3  LYS  58           HG1      LYS  58 -15.949 -10.227  -6.719
    7    HD2  LYS  58           HD2      LYS  58 -14.994 -12.433  -6.324
    8    HD3  LYS  58           HD1      LYS  58 -13.743 -11.192  -6.232
    9    HE2  LYS  58           HE2      LYS  58 -13.829 -11.237  -3.814
   10    HE3  LYS  58           HE1      LYS  58 -15.158 -12.396  -3.859
   11    HZ1  LYS  58           HZ1      LYS  58 -13.681 -13.997  -4.908
   12    HZ2  LYS  58           HZ2      LYS  58 -13.050 -13.487  -3.417
   13    HZ3  LYS  58           HZ3      LYS  58 -12.401 -12.883  -4.862
   14    HA   PRO  59           HA       PRO  59 -15.772  -5.632  -1.296
   15    HB2  PRO  59           HB2      PRO  59 -15.211  -7.968   0.458
   16    HB3  PRO  59           HB1      PRO  59 -16.148  -6.506   0.796
   17    HG2  PRO  59           HG2      PRO  59 -17.363  -8.835   0.340
   18    HG3  PRO  59           HG1      PRO  59 -18.037  -7.312  -0.272
   19    HD2  PRO  59           HD2      PRO  59 -16.540  -9.438  -1.737
   20    HD3  PRO  59           HD1      PRO  59 -17.902  -8.444  -2.271
   21    H    TYR  60           HN       TYR  60 -13.940  -4.782  -1.599
   22    HA   TYR  60           HA       TYR  60 -11.477  -6.389  -1.713
   23    HB2  TYR  60           HB2      TYR  60 -12.078  -3.614  -2.772
   24    HB3  TYR  60           HB1      TYR  60 -10.505  -4.402  -2.861
   25    HD1  TYR  60           HD2      TYR  60 -11.084  -7.084  -3.686
   26    HD2  TYR  60           HD1      TYR  60 -12.931  -3.455  -4.888
   27    HE1  TYR  60           HE2      TYR  60 -11.760  -8.132  -5.794
   28    HE2  TYR  60           HE1      TYR  60 -13.607  -4.488  -7.003
   29    HH   TYR  60           HH       TYR  60 -13.392  -7.851  -7.568
   30    H    GLY  61           HN       GLY  61 -10.564  -6.429   0.289
   31    HA2  GLY  61           HA2      GLY  61 -11.035  -4.025   1.888
   32    HA3  GLY  61           HA1      GLY  61 -11.113  -5.641   2.557
   33    H    CYS  62           HN       CYS  62  -9.692  -3.365   3.340
   34    HA   CYS  62           HA       CYS  62  -6.913  -3.611   2.809
   35    HB2  CYS  62           HB2      CYS  62  -8.516  -1.721   3.924
   36    HB3  CYS  62           HB1      CYS  62  -7.845  -2.451   5.371
   37    H    GLU  63           HN       GLU  63  -6.036  -5.571   3.275
   38    HA   GLU  63           HA       GLU  63  -6.728  -7.245   5.453
   39    HB2  GLU  63           HB2      GLU  63  -5.540  -7.901   3.323
   40    HB3  GLU  63           HB1      GLU  63  -4.097  -7.136   3.960
   41    HG2  GLU  63           HG2      GLU  63  -4.034  -8.715   5.792
   42    HG3  GLU  63           HG1      GLU  63  -5.528  -9.462   5.224
   43    H    GLU  64           HN       GLU  64  -5.279  -4.329   5.405
   44    HA   GLU  64           HA       GLU  64  -3.272  -4.752   7.443
   45    HB2  GLU  64           HB2      GLU  64  -2.352  -3.210   6.128
   46    HB3  GLU  64           HB1      GLU  64  -3.878  -2.834   5.363
   47    HG2  GLU  64           HG2      GLU  64  -4.162  -1.602   7.764
   48    HG3  GLU  64           HG1      GLU  64  -2.428  -1.428   7.464
   49    H    CYS  65           HN       CYS  65  -6.451  -3.211   7.136
   50    HA   CYS  65           HA       CYS  65  -6.346  -2.599  10.000
   51    HB2  CYS  65           HB2      CYS  65  -7.702  -0.546   9.468
   52    HB3  CYS  65           HB1      CYS  65  -6.038  -0.498   8.893
   53    H    GLY  66           HN       GLY  66  -8.082  -3.804   7.297
   54    HA2  GLY  66           HA2      GLY  66  -9.572  -5.541   7.517
   55    HA3  GLY  66           HA1      GLY  66  -9.892  -5.040   9.171
   56    H    LYS  67           HN       LYS  67 -10.018  -2.700   6.608
   57    HA   LYS  67           HA       LYS  67 -12.962  -2.762   6.709
   58    HB2  LYS  67           HB2      LYS  67 -11.118  -0.477   5.981
   59    HB3  LYS  67           HB1      LYS  67 -12.875  -0.407   5.949
   60    HG2  LYS  67           HG2      LYS  67 -12.932  -0.820   8.361
   61    HG3  LYS  67           HG1      LYS  67 -11.168  -0.871   8.388
   62    HD2  LYS  67           HD2      LYS  67 -11.097   1.439   7.574
   63    HD3  LYS  67           HD1      LYS  67 -12.861   1.484   7.568
   64    HE2  LYS  67           HE2      LYS  67 -12.884   1.099   9.979
   65    HE3  LYS  67           HE1      LYS  67 -11.123   1.028   9.990
   66    HZ1  LYS  67           HZ1      LYS  67 -12.760   3.392   9.233
   67    HZ2  LYS  67           HZ2      LYS  67 -11.065   3.328   9.237
   68    HZ3  LYS  67           HZ3      LYS  67 -11.922   3.186  10.695
   69    H    SER  68           HN       SER  68 -14.069  -3.187   4.857
   70    HA   SER  68           HA       SER  68 -12.427  -3.634   2.478
   71    HB2  SER  68           HB2      SER  68 -15.164  -4.748   2.554
   72    HB3  SER  68           HB1      SER  68 -13.667  -5.458   1.941
   73    HG   SER  68           HG       SER  68 -14.741  -5.512   4.513
   74    H    TYR  69           HN       TYR  69 -12.963  -2.879   0.506
   75    HA   TYR  69           HA       TYR  69 -15.085  -0.840   0.474
   76    HB2  TYR  69           HB2      TYR  69 -12.369  -0.896  -0.787
   77    HB3  TYR  69           HB1      TYR  69 -13.645   0.074  -1.506
   78    HD1  TYR  69           HD2      TYR  69 -11.850  -0.526   1.688
   79    HD2  TYR  69           HD1      TYR  69 -14.139   2.171  -0.658
   80    HE1  TYR  69           HE2      TYR  69 -11.428   1.239   3.330
   81    HE2  TYR  69           HE1      TYR  69 -13.726   3.961   0.977
   82    HH   TYR  69           HH       TYR  69 -13.144   4.108   3.452
   83    H    ARG  70           HN       ARG  70 -15.832  -0.324  -1.791
   84    HA   ARG  70           HA       ARG  70 -16.978  -2.770  -2.815
   85    HB2  ARG  70           HB2      ARG  70 -18.310  -0.721  -2.365
   86    HB3  ARG  70           HB1      ARG  70 -17.421   0.106  -3.630
   87    HG2  ARG  70           HG2      ARG  70 -18.332  -1.447  -5.286
   88    HG3  ARG  70           HG1      ARG  70 -19.237  -2.267  -4.008
   89    HD2  ARG  70           HD2      ARG  70 -20.347  -0.101  -3.488
   90    HD3  ARG  70           HD1      ARG  70 -19.529   0.605  -4.877
   91    HE   ARG  70           HE       ARG  70 -20.780  -1.171  -6.202
   92   HH11  ARG  70          HH11      ARG  70 -21.981   0.192  -3.196
   93   HH12  ARG  70          HH12      ARG  70 -23.652   0.017  -3.635
   94   HH21  ARG  70          HH21      ARG  70 -22.990  -1.372  -6.789
   95   HH22  ARG  70          HH22      ARG  70 -24.227  -0.861  -5.677
   96    H    LEU  71           HN       LEU  71 -14.908  -0.141  -4.021
   97    HA   LEU  71           HA       LEU  71 -14.394  -1.764  -6.419
   98    HB2  LEU  71           HB2      LEU  71 -13.909   1.192  -6.030
   99    HB3  LEU  71           HB1      LEU  71 -13.651   0.285  -7.510
  100    HG   LEU  71           HG       LEU  71 -15.631   1.200  -8.047
  101   HD11  LEU  71          HD11      LEU  71 -16.663  -1.003  -6.303
  102   HD12  LEU  71          HD12      LEU  71 -16.068  -1.197  -7.955
  103   HD13  LEU  71          HD13      LEU  71 -17.519  -0.243  -7.646
  104   HD21  LEU  71          HD21      LEU  71 -17.303   2.021  -6.553
  105   HD22  LEU  71          HD22      LEU  71 -15.716   2.544  -5.987
  106   HD23  LEU  71          HD23      LEU  71 -16.540   1.202  -5.195
  107    H    ILE  72           HN       ILE  72 -12.166  -1.596  -7.294
  108    HA   ILE  72           HA       ILE  72 -10.198  -1.999  -5.268
  109    HB   ILE  72           HB       ILE  72  -9.999  -1.774  -8.272
  110   HG12  ILE  72          HG12      ILE  72 -11.024  -3.795  -7.161
  111   HG13  ILE  72          HG11      ILE  72  -9.660  -4.134  -8.220
  112   HG21  ILE  72          HG21      ILE  72  -7.661  -2.476  -8.081
  113   HG22  ILE  72          HG22      ILE  72  -7.768  -2.325  -6.327
  114   HG23  ILE  72          HG23      ILE  72  -7.933  -0.894  -7.345
  115   HD11  ILE  72          HD11      ILE  72  -9.562  -3.958  -5.214
  116   HD12  ILE  72          HD12      ILE  72  -8.202  -4.329  -6.274
  117   HD13  ILE  72          HD13      ILE  72  -9.565  -5.445  -6.167
  118    H    SER  73           HN       SER  73 -10.918   0.582  -7.588
  119    HA   SER  73           HA       SER  73  -8.833   2.310  -6.866
  120    HB2  SER  73           HB2      SER  73 -11.595   3.113  -7.811
  121    HB3  SER  73           HB1      SER  73 -10.114   4.054  -7.963
  122    HG   SER  73           HG       SER  73  -9.318   2.208  -9.251
  123    H    LEU  74           HN       LEU  74 -12.011   1.806  -5.498
  124    HA   LEU  74           HA       LEU  74 -12.143   3.870  -3.678
  125    HB2  LEU  74           HB2      LEU  74 -13.428   1.343  -4.176
  126    HB3  LEU  74           HB1      LEU  74 -13.171   1.545  -2.450
  127    HG   LEU  74           HG       LEU  74 -14.718   3.357  -4.282
  128   HD11  LEU  74          HD11      LEU  74 -15.525   1.752  -1.855
  129   HD12  LEU  74          HD12      LEU  74 -15.882   1.319  -3.530
  130   HD13  LEU  74          HD13      LEU  74 -16.580   2.782  -2.826
  131   HD21  LEU  74          HD21      LEU  74 -15.094   4.592  -2.099
  132   HD22  LEU  74          HD22      LEU  74 -13.514   4.760  -2.873
  133   HD23  LEU  74          HD23      LEU  74 -13.702   3.679  -1.494
  134    H    LEU  75           HN       LEU  75 -10.913   0.636  -3.220
  135    HA   LEU  75           HA       LEU  75  -9.974   1.102  -0.577
  136    HB2  LEU  75           HB2      LEU  75 -10.588  -1.091  -1.149
  137    HB3  LEU  75           HB1      LEU  75  -9.649  -1.049  -2.638
  138    HG   LEU  75           HG       LEU  75  -7.614  -0.839  -1.054
  139   HD11  LEU  75          HD11      LEU  75  -9.659  -2.057   0.788
  140   HD12  LEU  75          HD12      LEU  75  -8.865  -0.492   0.995
  141   HD13  LEU  75          HD13      LEU  75  -7.920  -1.980   1.077
  142   HD21  LEU  75          HD21      LEU  75  -9.212  -3.354  -1.391
  143   HD22  LEU  75          HD22      LEU  75  -7.479  -3.270  -1.004
  144   HD23  LEU  75          HD23      LEU  75  -8.078  -2.651  -2.553
  145    H    ASN  76           HN       ASN  76  -8.799   1.489  -3.755
  146    HA   ASN  76           HA       ASN  76  -6.008   1.506  -3.238
  147    HB2  ASN  76           HB2      ASN  76  -7.555   1.585  -5.490
  148    HB3  ASN  76           HB1      ASN  76  -6.997   3.258  -5.398
  149   HD21  ASN  76          HD21      ASN  76  -6.106  -0.055  -5.808
  150   HD22  ASN  76          HD22      ASN  76  -4.495   0.226  -6.381
  151    H    LEU  77           HN       LEU  77  -8.575   3.909  -3.233
  152    HA   LEU  77           HA       LEU  77  -6.792   6.070  -2.666
  153    HB2  LEU  77           HB2      LEU  77  -9.689   5.656  -3.048
  154    HB3  LEU  77           HB1      LEU  77  -9.224   7.019  -2.058
  155    HG   LEU  77           HG       LEU  77  -9.599   7.388  -4.581
  156   HD11  LEU  77          HD11      LEU  77  -7.875   9.102  -4.609
  157   HD12  LEU  77          HD12      LEU  77  -7.056   8.307  -3.265
  158   HD13  LEU  77          HD13      LEU  77  -8.650   9.017  -3.028
  159   HD21  LEU  77          HD21      LEU  77  -8.236   5.486  -5.342
  160   HD22  LEU  77          HD22      LEU  77  -6.803   6.264  -4.665
  161   HD23  LEU  77          HD23      LEU  77  -7.672   7.022  -5.998
  162    H    HIS  78           HN       HIS  78  -8.765   3.835  -0.856
  163    HA   HIS  78           HA       HIS  78  -8.466   5.058   1.693
  164    HB2  HIS  78           HB2      HIS  78 -10.130   3.351   1.450
  165    HB3  HIS  78           HB1      HIS  78  -8.948   2.194   0.831
  166    HD1  HIS  78           HD1      HIS  78 -10.085   3.804   4.065
  167    HD2  HIS  78           HD2      HIS  78  -7.594   0.751   2.724
  168    HE1  HIS  78           HE1      HIS  78  -9.405   2.491   6.111
  169    H    LYS  79           HN       LYS  79  -6.555   2.831  -0.205
  170    HA   LYS  79           HA       LYS  79  -4.578   2.375   1.810
  171    HB2  LYS  79           HB2      LYS  79  -5.052   0.807  -0.061
  172    HB3  LYS  79           HB1      LYS  79  -4.416   1.997  -1.187
  173    HG2  LYS  79           HG2      LYS  79  -2.760   0.316  -0.774
  174    HG3  LYS  79           HG1      LYS  79  -2.227   1.843  -0.072
  175    HD2  LYS  79           HD2      LYS  79  -1.752   0.018   1.446
  176    HD3  LYS  79           HD1      LYS  79  -2.987   1.069   2.140
  177    HE2  LYS  79           HE2      LYS  79  -4.718  -0.493   1.589
  178    HE3  LYS  79           HE1      LYS  79  -3.604  -1.478   0.643
  179    HZ1  LYS  79           HZ1      LYS  79  -2.452  -2.122   2.596
  180    HZ2  LYS  79           HZ2      LYS  79  -4.100  -2.345   2.906
  181    HZ3  LYS  79           HZ3      LYS  79  -3.288  -1.003   3.562
  182    H    LYS  80           HN       LYS  80  -5.040   4.591  -0.863
  183    HA   LYS  80           HA       LYS  80  -2.550   5.916  -0.678
  184    HB2  LYS  80           HB2      LYS  80  -3.901   6.162  -2.663
  185    HB3  LYS  80           HB1      LYS  80  -5.239   6.817  -1.731
  186    HG2  LYS  80           HG2      LYS  80  -4.118   8.855  -1.377
  187    HG3  LYS  80           HG1      LYS  80  -2.576   8.200  -1.897
  188    HD2  LYS  80           HD2      LYS  80  -4.961   8.437  -3.721
  189    HD3  LYS  80           HD1      LYS  80  -3.772   9.730  -3.525
  190    HE2  LYS  80           HE2      LYS  80  -1.993   8.204  -4.228
  191    HE3  LYS  80           HE1      LYS  80  -3.182   6.913  -4.414
  192    HZ1  LYS  80           HZ1      LYS  80  -4.309   8.388  -6.083
  193    HZ2  LYS  80           HZ2      LYS  80  -2.789   7.801  -6.551
  194    HZ3  LYS  80           HZ3      LYS  80  -2.948   9.399  -6.015
  195    H    ARG  81           HN       ARG  81  -5.610   6.252   1.050
  196    HA   ARG  81           HA       ARG  81  -5.112   8.663   2.376
  197    HB2  ARG  81           HB2      ARG  81  -6.628   6.199   3.218
  198    HB3  ARG  81           HB1      ARG  81  -6.601   7.668   4.163
  199    HG2  ARG  81           HG2      ARG  81  -7.673   7.345   1.385
  200    HG3  ARG  81           HG1      ARG  81  -8.606   7.594   2.862
  201    HD2  ARG  81           HD2      ARG  81  -7.444   9.778   3.141
  202    HD3  ARG  81           HD1      ARG  81  -6.704   9.531   1.558
  203    HE   ARG  81           HE       ARG  81  -9.582   9.340   1.564
  204   HH11  ARG  81          HH11      ARG  81  -6.801  11.435   1.107
  205   HH12  ARG  81          HH12      ARG  81  -7.734  12.705   0.364
  206   HH21  ARG  81          HH21      ARG  81 -10.791  10.990   0.582
  207   HH22  ARG  81          HH22      ARG  81  -9.992  12.430   0.023
  208    H    HIS  82           HN       HIS  82  -4.310   5.346   3.358
  209    HA   HIS  82           HA       HIS  82  -3.145   6.050   5.831
  210    HB2  HIS  82           HB2      HIS  82  -2.849   3.603   4.102
  211    HB3  HIS  82           HB1      HIS  82  -2.074   3.758   5.658
  212    HD1  HIS  82           HD1      HIS  82  -3.702   3.769   7.764
  213    HD2  HIS  82           HD2      HIS  82  -5.430   2.914   4.090
  214    HE1  HIS  82           HE1      HIS  82  -5.909   2.661   8.256
  215    H    SER  83           HN       SER  83  -1.830   5.882   2.585
  216    HA   SER  83           HA       SER  83   0.894   6.053   3.611
  217    HB2  SER  83           HB2      SER  83   1.446   5.829   1.127
  218    HB3  SER  83           HB1      SER  83   0.659   4.446   1.889
  219    HG   SER  83           HG       SER  83  -1.170   4.868   0.826
  220    H    GLY  84           HN       GLY  84  -1.437   8.226   3.123
  221    HA2  GLY  84           HA2      GLY  84  -1.312  10.545   2.864
  222    HA3  GLY  84           HA1      GLY  84   0.384  10.377   2.419
  223    H    GLU  85           HN       GLU  85   0.551   8.904   0.332
  224    HA   GLU  85           HA       GLU  85  -1.668   9.004  -1.440
  225    HB2  GLU  85           HB2      GLU  85  -0.841  10.369  -3.140
  226    HB3  GLU  85           HB1      GLU  85  -0.465  11.278  -1.690
  227    HG2  GLU  85           HG2      GLU  85   1.828  10.359  -1.788
  228    HG3  GLU  85           HG1      GLU  85   1.392   9.613  -3.319
  229    H    ALA  86           HN       ALA  86  -1.426   7.534  -3.097
  230    HA   ALA  86           HA       ALA  86   0.474   5.467  -2.513
  231    HB1  ALA  86           HB1      ALA  86  -1.729   5.549  -4.562
  232    HB2  ALA  86           HB2      ALA  86  -1.855   4.880  -2.935
  233    HB3  ALA  86           HB3      ALA  86  -0.783   4.130  -4.116
  234    H    ARG  87           HN       ARG  87   2.429   6.203  -3.140
  235    HA   ARG  87           HA       ARG  87   2.788   6.935  -5.905
  236    HB2  ARG  87           HB2      ARG  87   4.867   6.731  -3.741
  237    HB3  ARG  87           HB1      ARG  87   5.033   7.539  -5.293
  238    HG2  ARG  87           HG2      ARG  87   3.023   8.295  -3.213
  239    HG3  ARG  87           HG1      ARG  87   4.639   8.989  -3.340
  240    HD2  ARG  87           HD2      ARG  87   2.541   8.997  -5.496
  241    HD3  ARG  87           HD1      ARG  87   2.915  10.368  -4.446
  242    HE   ARG  87           HE       ARG  87   4.731   9.250  -6.487
  243   HH11  ARG  87          HH11      ARG  87   3.728  11.888  -4.387
  244   HH12  ARG  87          HH12      ARG  87   4.875  13.010  -5.063
  245   HH21  ARG  87          HH21      ARG  87   6.200  10.742  -7.384
  246   HH22  ARG  87          HH22      ARG  87   6.244  12.377  -6.785
  247    H    TYR  88           HN       TYR  88   5.075   5.107  -4.040
  248    HA   TYR  88           HA       TYR  88   5.253   3.067  -6.124
  249    HB2  TYR  88           HB2      TYR  88   6.905   3.484  -3.627
  250    HB3  TYR  88           HB1      TYR  88   7.241   2.335  -4.908
  251    HD1  TYR  88           HD1      TYR  88   6.668   5.989  -4.481
  252    HD2  TYR  88           HD2      TYR  88   8.828   2.909  -6.449
  253    HE1  TYR  88           HE1      TYR  88   8.008   7.687  -5.647
  254    HE2  TYR  88           HE2      TYR  88  10.178   4.576  -7.618
  255    HH   TYR  88           HH       TYR  88  10.121   7.927  -6.773
  256    H    ARG  89           HN       ARG  89   4.872   0.872  -5.715
  257    HA   ARG  89           HA       ARG  89   3.778   0.245  -3.064
  258    HB2  ARG  89           HB2      ARG  89   3.118  -0.764  -5.746
  259    HB3  ARG  89           HB1      ARG  89   3.337  -2.007  -4.537
  260    HG2  ARG  89           HG2      ARG  89   1.633  -1.116  -3.189
  261    HG3  ARG  89           HG1      ARG  89   1.518   0.331  -4.188
  262    HD2  ARG  89           HD2      ARG  89   0.936  -1.183  -6.095
  263    HD3  ARG  89           HD1      ARG  89   0.770  -2.462  -4.893
  264    HE   ARG  89           HE       ARG  89  -0.770  -0.050  -4.426
  265   HH11  ARG  89          HH11      ARG  89  -0.721  -3.313  -5.642
  266   HH12  ARG  89          HH12      ARG  89  -2.442  -3.533  -5.537
  267   HH21  ARG  89          HH21      ARG  89  -3.045  -0.296  -4.297
  268   HH22  ARG  89          HH22      ARG  89  -3.777  -1.801  -4.765
  269    H    CYS  90           HN       CYS  90   4.493  -1.552  -2.071
  270    HA   CYS  90           HA       CYS  90   7.127  -2.537  -2.619
  271    HB2  CYS  90           HB2      CYS  90   5.715  -2.379  -0.390
  272    HB3  CYS  90           HB1      CYS  90   5.133  -3.932  -0.890
  273    H    GLU  91           HN       GLU  91   7.452  -3.942  -4.274
  274    HA   GLU  91           HA       GLU  91   5.426  -5.125  -5.762
  275    HB2  GLU  91           HB2      GLU  91   7.198  -6.391  -6.870
  276    HB3  GLU  91           HB1      GLU  91   7.635  -4.697  -6.663
  277    HG2  GLU  91           HG2      GLU  91   9.025  -5.222  -4.802
  278    HG3  GLU  91           HG1      GLU  91   8.485  -6.893  -4.853
  279    H    ASP  92           HN       ASP  92   6.153  -5.954  -2.699
  280    HA   ASP  92           HA       ASP  92   5.605  -8.801  -3.171
  281    HB2  ASP  92           HB2      ASP  92   6.551  -9.095  -0.816
  282    HB3  ASP  92           HB1      ASP  92   7.695  -8.712  -2.097
  283    H    CYS  93           HN       CYS  93   4.714  -5.960  -1.204
  284    HA   CYS  93           HA       CYS  93   2.471  -7.557  -0.250
  285    HB2  CYS  93           HB2      CYS  93   2.847  -6.923   1.986
  286    HB3  CYS  93           HB1      CYS  93   4.434  -7.364   1.372
  287    H    GLY  94           HN       GLY  94   3.371  -4.979  -1.967
  288    HA2  GLY  94           HA2      GLY  94   2.307  -3.247  -2.872
  289    HA3  GLY  94           HA1      GLY  94   0.810  -4.010  -2.374
  290    H    LYS  95           HN       LYS  95   3.342  -2.766  -0.246
  291    HA   LYS  95           HA       LYS  95   1.550  -0.870   0.956
  292    HB2  LYS  95           HB2      LYS  95   4.487  -1.445   1.244
  293    HB3  LYS  95           HB1      LYS  95   3.719  -0.079   2.047
  294    HG2  LYS  95           HG2      LYS  95   2.139  -1.804   3.036
  295    HG3  LYS  95           HG1      LYS  95   3.337  -3.000   2.513
  296    HD2  LYS  95           HD2      LYS  95   3.960  -2.446   4.710
  297    HD3  LYS  95           HD1      LYS  95   5.049  -1.543   3.673
  298    HE2  LYS  95           HE2      LYS  95   3.784   0.470   3.980
  299    HE3  LYS  95           HE1      LYS  95   2.530  -0.397   4.863
  300    HZ1  LYS  95           HZ1      LYS  95   4.067   0.859   6.304
  301    HZ2  LYS  95           HZ2      LYS  95   5.342  -0.129   5.788
  302    HZ3  LYS  95           HZ3      LYS  95   4.043  -0.801   6.649
  303    H    LEU  96           HN       LEU  96   1.698   1.381   0.742
  304    HA   LEU  96           HA       LEU  96   3.012   2.175  -1.751
  305    HB2  LEU  96           HB2      LEU  96   0.625   3.221  -0.299
  306    HB3  LEU  96           HB1      LEU  96   1.446   4.212  -1.496
  307    HG   LEU  96           HG       LEU  96  -0.432   3.162  -2.545
  308   HD11  LEU  96          HD11      LEU  96   2.093   1.708  -3.305
  309   HD12  LEU  96          HD12      LEU  96   1.590   3.301  -3.889
  310   HD13  LEU  96          HD13      LEU  96   0.646   1.867  -4.310
  311   HD21  LEU  96          HD21      LEU  96   0.678   0.554  -1.534
  312   HD22  LEU  96          HD22      LEU  96  -0.690   0.726  -2.637
  313   HD23  LEU  96          HD23      LEU  96  -0.801   1.347  -0.989
  314    H    PHE  97           HN       PHE  97   4.793   3.227  -1.607
  315    HA   PHE  97           HA       PHE  97   5.217   4.981   0.727
  316    HB2  PHE  97           HB2      PHE  97   7.313   3.515  -0.899
  317    HB3  PHE  97           HB1      PHE  97   7.643   4.636   0.418
  318    HD1  PHE  97           HD2      PHE  97   6.234   1.358  -0.433
  319    HD2  PHE  97           HD1      PHE  97   7.396   3.979   2.716
  320    HE1  PHE  97           HE2      PHE  97   6.102  -0.508   1.163
  321    HE2  PHE  97           HE1      PHE  97   7.288   2.084   4.330
  322    HZ   PHE  97           HZ       PHE  97   6.454  -0.025   3.641
  323    H    THR  98           HN       THR  98   5.929   7.010   0.394
  324    HA   THR  98           HA       THR  98   5.424   8.048  -2.265
  325    HB   THR  98           HB       THR  98   5.398  10.229  -1.138
  326    HG1  THR  98           HG1      THR  98   5.860  10.367   1.062
  327   HG21  THR  98          HG21      THR  98   3.500   9.762   0.376
  328   HG22  THR  98          HG22      THR  98   3.919   8.044   0.336
  329   HG23  THR  98          HG23      THR  98   3.376   8.856  -1.134
  330    H    THR  99           HN       THR  99   7.944   6.661  -1.085
  331    HA   THR  99           HA       THR  99   9.835   8.186  -2.628
  332    HB   THR  99           HB       THR  99  10.009   7.876   0.367
  333    HG1  THR  99           HG1      THR  99   9.298   9.854  -1.087
  334   HG21  THR  99          HG21      THR  99  12.327   8.383   0.329
  335   HG22  THR  99          HG22      THR  99  12.306   8.619  -1.421
  336   HG23  THR  99          HG23      THR  99  12.060   7.009  -0.744
  337    H    SER 100           HN       SER 100  11.207   6.786  -3.584
  338    HA   SER 100           HA       SER 100  10.705   4.021  -3.426
  339    HB2  SER 100           HB2      SER 100  12.589   3.821  -5.035
  340    HB3  SER 100           HB1      SER 100  11.411   5.054  -5.512
  341    HG   SER 100           HG       SER 100  14.022   5.380  -4.470
  342    H    GLY 101           HN       GLY 101  13.035   6.116  -1.912
  343    HA2  GLY 101           HA2      GLY 101  14.743   4.064  -0.925
  344    HA3  GLY 101           HA1      GLY 101  14.616   5.694  -0.300
  345    H    ASN 102           HN       ASN 102  12.062   5.879   0.604
  346    HA   ASN 102           HA       ASN 102  11.929   4.497   3.015
  347    HB2  ASN 102           HB2      ASN 102   9.670   5.573   1.306
  348    HB3  ASN 102           HB1      ASN 102   9.469   4.984   2.947
  349   HD21  ASN 102          HD21      ASN 102  12.046   6.132   3.810
  350   HD22  ASN 102          HD22      ASN 102  11.771   7.835   3.952
  351    H    LEU 103           HN       LEU 103  10.700   3.840  -0.162
  352    HA   LEU 103           HA       LEU 103   9.196   1.572   0.474
  353    HB2  LEU 103           HB2      LEU 103   8.765   2.660  -1.559
  354    HB3  LEU 103           HB1      LEU 103  10.468   2.680  -2.003
  355    HG   LEU 103           HG       LEU 103  10.340   0.187  -2.261
  356   HD11  LEU 103          HD11      LEU 103   8.347  -0.953  -2.191
  357   HD12  LEU 103          HD12      LEU 103   7.374   0.522  -2.404
  358   HD13  LEU 103          HD13      LEU 103   8.159   0.177  -0.843
  359   HD21  LEU 103          HD21      LEU 103   8.628   2.018  -3.883
  360   HD22  LEU 103          HD22      LEU 103   9.079   0.389  -4.398
  361   HD23  LEU 103          HD23      LEU 103  10.323   1.622  -4.146
  362    H    LYS 104           HN       LYS 104  12.403   2.037  -0.876
  363    HA   LYS 104           HA       LYS 104  13.277  -0.533  -1.183
  364    HB2  LYS 104           HB2      LYS 104  14.382   1.497  -1.992
  365    HB3  LYS 104           HB1      LYS 104  14.837   1.901  -0.348
  366    HG2  LYS 104           HG2      LYS 104  16.204  -0.093  -0.216
  367    HG3  LYS 104           HG1      LYS 104  15.742  -0.529  -1.868
  368    HD2  LYS 104           HD2      LYS 104  17.113   2.044  -1.114
  369    HD3  LYS 104           HD1      LYS 104  17.970   0.601  -1.668
  370    HE2  LYS 104           HE2      LYS 104  16.624   0.684  -3.758
  371    HE3  LYS 104           HE1      LYS 104  15.917   2.198  -3.194
  372    HZ1  LYS 104           HZ1      LYS 104  18.770   1.680  -3.826
  373    HZ2  LYS 104           HZ2      LYS 104  18.212   3.101  -3.094
  374    HZ3  LYS 104           HZ3      LYS 104  17.706   2.705  -4.663
  375    H    ARG 105           HN       ARG 105  13.643   1.531   1.713
  376    HA   ARG 105           HA       ARG 105  15.059  -0.301   3.265
  377    HB2  ARG 105           HB2      ARG 105  12.946   1.603   4.286
  378    HB3  ARG 105           HB1      ARG 105  14.292   0.933   5.201
  379    HG2  ARG 105           HG2      ARG 105  15.814   2.102   3.586
  380    HG3  ARG 105           HG1      ARG 105  14.385   2.932   2.966
  381    HD2  ARG 105           HD2      ARG 105  15.403   3.009   5.802
  382    HD3  ARG 105           HD1      ARG 105  15.538   4.299   4.610
  383    HE   ARG 105           HE       ARG 105  12.829   3.458   5.142
  384   HH11  ARG 105          HH11      ARG 105  15.438   5.594   6.066
  385   HH12  ARG 105          HH12      ARG 105  14.397   6.738   6.861
  386   HH21  ARG 105          HH21      ARG 105  11.445   4.949   6.179
  387   HH22  ARG 105          HH22      ARG 105  12.121   6.355   6.949
  388    H    HIS 106           HN       HIS 106  11.626   0.065   2.705
  389    HA   HIS 106           HA       HIS 106  10.884  -2.066   4.477
  390    HB2  HIS 106           HB2      HIS 106   9.300  -0.258   3.994
  391    HB3  HIS 106           HB1      HIS 106   9.301  -0.703   2.290
  392    HD1  HIS 106           HD1      HIS 106   8.141  -2.045   5.652
  393    HD2  HIS 106           HD2      HIS 106   7.724  -2.731   1.583
  394    HE1  HIS 106           HE1      HIS 106   6.301  -3.769   5.412
  395    H    GLN 107           HN       GLN 107  12.076  -1.945   1.275
  396    HA   GLN 107           HA       GLN 107  10.862  -4.426   0.433
  397    HB2  GLN 107           HB2      GLN 107  13.208  -2.968  -0.823
  398    HB3  GLN 107           HB1      GLN 107  12.216  -4.203  -1.579
  399    HG2  GLN 107           HG2      GLN 107  10.650  -1.932  -0.749
  400    HG3  GLN 107           HG1      GLN 107  11.985  -1.476  -1.800
  401   HE21  GLN 107          HE21      GLN 107   8.976  -3.110  -1.601
  402   HE22  GLN 107          HE22      GLN 107   8.838  -3.478  -3.288
  403    H    LEU 108           HN       LEU 108  13.559  -3.134   1.998
  404    HA   LEU 108           HA       LEU 108  15.373  -5.341   1.698
  405    HB2  LEU 108           HB2      LEU 108  15.366  -2.731   3.121
  406    HB3  LEU 108           HB1      LEU 108  16.586  -3.929   3.492
  407    HG   LEU 108           HG       LEU 108  17.763  -3.529   1.605
  408   HD11  LEU 108          HD11      LEU 108  16.823  -2.991  -0.569
  409   HD12  LEU 108          HD12      LEU 108  15.220  -2.837   0.152
  410   HD13  LEU 108          HD13      LEU 108  16.027  -4.403   0.125
  411   HD21  LEU 108          HD21      LEU 108  17.639  -1.192   0.920
  412   HD22  LEU 108          HD22      LEU 108  17.512  -1.362   2.671
  413   HD23  LEU 108          HD23      LEU 108  16.064  -1.048   1.707
  414    H    VAL 109           HN       VAL 109  12.826  -4.589   3.784
  415    HA   VAL 109           HA       VAL 109  13.905  -6.220   5.878
  416    HB   VAL 109           HB       VAL 109  11.825  -5.853   7.019
  417   HG11  VAL 109          HG11      VAL 109  13.357  -3.947   6.954
  418   HG12  VAL 109          HG12      VAL 109  11.673  -3.425   7.025
  419   HG13  VAL 109          HG13      VAL 109  12.549  -3.374   5.492
  420   HG21  VAL 109          HG21      VAL 109  10.836  -4.790   4.402
  421   HG22  VAL 109          HG22      VAL 109   9.931  -4.743   5.924
  422   HG23  VAL 109          HG23      VAL 109  10.331  -6.292   5.175
  423    H    HIS 110           HN       HIS 110  12.086  -6.521   2.985
  424    HA   HIS 110           HA       HIS 110  11.144  -9.202   3.599
  425    HB2  HIS 110           HB2      HIS 110  11.143  -7.534   1.095
  426    HB3  HIS 110           HB1      HIS 110  10.547  -9.172   1.135
  427    HD1  HIS 110           HD1      HIS 110   8.178  -9.515   2.114
  428    HD2  HIS 110           HD2      HIS 110   9.666  -5.662   2.369
  429    HE1  HIS 110           HE1      HIS 110   6.196  -8.018   2.610
  430    H    SER 111           HN       SER 111  13.987  -7.745   2.571
  431    HA   SER 111           HA       SER 111  15.251 -10.278   2.036
  432    HB2  SER 111           HB2      SER 111  16.239  -9.290  -0.152
  433    HB3  SER 111           HB1      SER 111  14.601  -9.936  -0.198
  434    HG   SER 111           HG       SER 111  14.176  -7.511   0.427
  435    H    GLY 112           HN       GLY 112  15.797  -9.024   4.177
  436    HA2  GLY 112           HA2      GLY 112  18.390  -7.734   3.749
  437    HA3  GLY 112           HA1      GLY 112  17.148  -6.828   4.618
  Start of MODEL   12
    1    H    LYS  58           HT1      LYS  58 -17.757  -8.009  -4.351
    2    HA   LYS  58           HA       LYS  58 -17.827  -9.432  -1.762
    3    HB2  LYS  58           HB2      LYS  58 -15.776  -9.471  -3.988
    4    HB3  LYS  58           HB1      LYS  58 -15.518 -10.146  -2.384
    5    HG2  LYS  58           HG2      LYS  58 -17.464 -11.653  -2.784
    6    HG3  LYS  58           HG1      LYS  58 -17.518 -11.050  -4.440
    7    HD2  LYS  58           HD2      LYS  58 -16.304 -13.152  -4.343
    8    HD3  LYS  58           HD1      LYS  58 -15.216 -11.837  -4.787
    9    HE2  LYS  58           HE2      LYS  58 -14.410 -11.716  -2.489
   10    HE3  LYS  58           HE1      LYS  58 -15.525 -12.996  -2.021
   11    HZ1  LYS  58           HZ1      LYS  58 -14.355 -14.543  -3.388
   12    HZ2  LYS  58           HZ2      LYS  58 -13.221 -13.759  -2.398
   13    HZ3  LYS  58           HZ3      LYS  58 -13.364 -13.324  -4.030
   14    HA   PRO  59           HA       PRO  59 -16.427  -5.428  -0.465
   15    HB2  PRO  59           HB2      PRO  59 -16.018  -6.073   2.137
   16    HB3  PRO  59           HB1      PRO  59 -17.627  -5.796   1.453
   17    HG2  PRO  59           HG2      PRO  59 -16.212  -8.374   1.990
   18    HG3  PRO  59           HG1      PRO  59 -17.908  -7.944   2.284
   19    HD2  PRO  59           HD2      PRO  59 -17.119  -9.385   0.136
   20    HD3  PRO  59           HD1      PRO  59 -18.499  -8.280   0.088
   21    H    TYR  60           HN       TYR  60 -14.552  -4.754  -0.959
   22    HA   TYR  60           HA       TYR  60 -12.138  -6.294  -0.375
   23    HB2  TYR  60           HB2      TYR  60 -12.529  -3.742  -1.962
   24    HB3  TYR  60           HB1      TYR  60 -10.987  -4.573  -1.750
   25    HD1  TYR  60           HD2      TYR  60 -11.598  -7.344  -2.181
   26    HD2  TYR  60           HD1      TYR  60 -13.130  -3.912  -4.168
   27    HE1  TYR  60           HE2      TYR  60 -12.012  -8.692  -4.184
   28    HE2  TYR  60           HE1      TYR  60 -13.543  -5.253  -6.175
   29    HH   TYR  60           HH       TYR  60 -12.581  -7.397  -7.189
   30    H    GLY  61           HN       GLY  61 -11.626  -6.005   1.747
   31    HA2  GLY  61           HA2      GLY  61 -11.916  -3.270   2.770
   32    HA3  GLY  61           HA1      GLY  61 -12.327  -4.690   3.711
   33    H    CYS  62           HN       CYS  62 -10.534  -2.404   4.007
   34    HA   CYS  62           HA       CYS  62  -7.847  -3.283   4.145
   35    HB2  CYS  62           HB2      CYS  62  -8.964  -0.889   4.300
   36    HB3  CYS  62           HB1      CYS  62  -8.999  -1.247   6.017
   37    H    GLU  63           HN       GLU  63  -7.495  -5.165   5.318
   38    HA   GLU  63           HA       GLU  63  -8.825  -5.771   7.763
   39    HB2  GLU  63           HB2      GLU  63  -6.282  -6.862   6.556
   40    HB3  GLU  63           HB1      GLU  63  -7.059  -7.520   7.988
   41    HG2  GLU  63           HG2      GLU  63  -9.079  -7.972   6.648
   42    HG3  GLU  63           HG1      GLU  63  -8.231  -7.383   5.220
   43    H    GLU  64           HN       GLU  64  -6.733  -3.422   7.114
   44    HA   GLU  64           HA       GLU  64  -5.092  -3.456   9.461
   45    HB2  GLU  64           HB2      GLU  64  -3.975  -2.358   7.797
   46    HB3  GLU  64           HB1      GLU  64  -5.453  -1.767   7.050
   47    HG2  GLU  64           HG2      GLU  64  -5.618  -0.222   9.078
   48    HG3  GLU  64           HG1      GLU  64  -3.919  -0.625   9.349
   49    H    CYS  65           HN       CYS  65  -7.994  -1.698   8.320
   50    HA   CYS  65           HA       CYS  65  -8.192  -0.520  11.003
   51    HB2  CYS  65           HB2      CYS  65  -9.248   1.468   9.694
   52    HB3  CYS  65           HB1      CYS  65  -7.493   1.298   9.718
   53    H    GLY  66           HN       GLY  66  -9.672  -2.136   8.394
   54    HA2  GLY  66           HA2      GLY  66 -11.381  -3.632   8.757
   55    HA3  GLY  66           HA1      GLY  66 -11.872  -2.705  10.167
   56    H    LYS  67           HN       LYS  67 -11.329  -1.174   7.083
   57    HA   LYS  67           HA       LYS  67 -14.238  -0.801   6.814
   58    HB2  LYS  67           HB2      LYS  67 -13.112   1.306   7.104
   59    HB3  LYS  67           HB1      LYS  67 -11.942   0.913   5.856
   60    HG2  LYS  67           HG2      LYS  67 -13.460   2.468   4.921
   61    HG3  LYS  67           HG1      LYS  67 -13.839   0.894   4.218
   62    HD2  LYS  67           HD2      LYS  67 -15.902   1.953   4.768
   63    HD3  LYS  67           HD1      LYS  67 -15.642   0.666   5.946
   64    HE2  LYS  67           HE2      LYS  67 -14.862   2.277   7.580
   65    HE3  LYS  67           HE1      LYS  67 -15.000   3.579   6.398
   66    HZ1  LYS  67           HZ1      LYS  67 -17.239   1.955   7.484
   67    HZ2  LYS  67           HZ2      LYS  67 -17.393   3.158   6.299
   68    HZ3  LYS  67           HZ3      LYS  67 -16.896   3.572   7.869
   69    H    SER  68           HN       SER  68 -15.225  -1.621   5.083
   70    HA   SER  68           HA       SER  68 -13.523  -2.829   3.019
   71    HB2  SER  68           HB2      SER  68 -16.290  -3.652   2.866
   72    HB3  SER  68           HB1      SER  68 -14.832  -4.632   3.052
   73    HG   SER  68           HG       SER  68 -16.051  -4.941   4.881
   74    H    TYR  69           HN       TYR  69 -13.752  -2.378   0.911
   75    HA   TYR  69           HA       TYR  69 -15.694  -0.262   0.250
   76    HB2  TYR  69           HB2      TYR  69 -12.879  -0.727  -0.693
   77    HB3  TYR  69           HB1      TYR  69 -14.002   0.268  -1.613
   78    HD1  TYR  69           HD2      TYR  69 -12.249  -0.073   1.609
   79    HD2  TYR  69           HD1      TYR  69 -14.509   2.472  -0.925
   80    HE1  TYR  69           HE2      TYR  69 -11.677   1.837   3.028
   81    HE2  TYR  69           HE1      TYR  69 -13.935   4.402   0.480
   82    HH   TYR  69           HH       TYR  69 -13.238   4.829   2.843
   83    H    ARG  70           HN       ARG  70 -16.497  -0.213  -1.898
   84    HA   ARG  70           HA       ARG  70 -17.347  -2.767  -2.841
   85    HB2  ARG  70           HB2      ARG  70 -18.764  -0.740  -2.915
   86    HB3  ARG  70           HB1      ARG  70 -17.651  -0.018  -4.073
   87    HG2  ARG  70           HG2      ARG  70 -19.460  -0.823  -5.328
   88    HG3  ARG  70           HG1      ARG  70 -18.146  -1.970  -5.584
   89    HD2  ARG  70           HD2      ARG  70 -20.175  -3.201  -5.242
   90    HD3  ARG  70           HD1      ARG  70 -19.147  -3.417  -3.825
   91    HE   ARG  70           HE       ARG  70 -20.582  -1.954  -2.601
   92   HH11  ARG  70          HH11      ARG  70 -21.765  -2.876  -5.773
   93   HH12  ARG  70          HH12      ARG  70 -23.403  -2.380  -5.444
   94   HH21  ARG  70          HH21      ARG  70 -22.761  -1.327  -2.168
   95   HH22  ARG  70          HH22      ARG  70 -23.957  -1.507  -3.417
   96    H    LEU  71           HN       LEU  71 -15.076  -0.313  -3.962
   97    HA   LEU  71           HA       LEU  71 -14.382  -1.995  -6.255
   98    HB2  LEU  71           HB2      LEU  71 -14.274   0.948  -5.735
   99    HB3  LEU  71           HB1      LEU  71 -13.211   0.237  -6.938
  100    HG   LEU  71           HG       LEU  71 -15.079  -0.498  -8.244
  101   HD11  LEU  71          HD11      LEU  71 -17.379  -0.031  -7.626
  102   HD12  LEU  71          HD12      LEU  71 -16.829   0.602  -6.073
  103   HD13  LEU  71          HD13      LEU  71 -16.594  -1.103  -6.465
  104   HD21  LEU  71          HD21      LEU  71 -15.520   2.325  -7.320
  105   HD22  LEU  71          HD22      LEU  71 -16.074   1.630  -8.844
  106   HD23  LEU  71          HD23      LEU  71 -14.346   1.816  -8.537
  107    H    ILE  72           HN       ILE  72 -12.251  -2.306  -6.818
  108    HA   ILE  72           HA       ILE  72 -10.320  -2.500  -4.748
  109    HB   ILE  72           HB       ILE  72 -10.038  -2.609  -7.752
  110   HG12  ILE  72          HG12      ILE  72 -11.217  -4.459  -6.543
  111   HG13  ILE  72          HG11      ILE  72  -9.778  -4.982  -7.414
  112   HG21  ILE  72          HG21      ILE  72  -7.950  -1.758  -6.772
  113   HG22  ILE  72          HG22      ILE  72  -7.756  -3.375  -7.447
  114   HG23  ILE  72          HG23      ILE  72  -7.898  -3.158  -5.703
  115   HD11  ILE  72          HD11      ILE  72  -9.933  -4.425  -4.457
  116   HD12  ILE  72          HD12      ILE  72  -8.519  -5.010  -5.336
  117   HD13  ILE  72          HD13      ILE  72  -9.959  -6.022  -5.208
  118    H    SER  73           HN       SER  73 -10.869  -0.151  -7.343
  119    HA   SER  73           HA       SER  73  -8.662   1.504  -6.716
  120    HB2  SER  73           HB2      SER  73 -11.259   2.373  -8.002
  121    HB3  SER  73           HB1      SER  73  -9.679   3.136  -8.171
  122    HG   SER  73           HG       SER  73 -10.505   0.597  -9.142
  123    H    LEU  74           HN       LEU  74 -11.938   1.343  -5.542
  124    HA   LEU  74           HA       LEU  74 -12.065   3.656  -4.030
  125    HB2  LEU  74           HB2      LEU  74 -13.481   1.165  -4.303
  126    HB3  LEU  74           HB1      LEU  74 -13.348   1.597  -2.604
  127    HG   LEU  74           HG       LEU  74 -14.567   3.270  -4.787
  128   HD11  LEU  74          HD11      LEU  74 -15.969   1.421  -3.960
  129   HD12  LEU  74          HD12      LEU  74 -16.605   3.002  -3.499
  130   HD13  LEU  74          HD13      LEU  74 -15.748   2.014  -2.312
  131   HD21  LEU  74          HD21      LEU  74 -13.384   4.706  -3.370
  132   HD22  LEU  74          HD22      LEU  74 -13.858   3.798  -1.939
  133   HD23  LEU  74          HD23      LEU  74 -15.061   4.761  -2.810
  134    H    LEU  75           HN       LEU  75 -11.127   0.437  -3.084
  135    HA   LEU  75           HA       LEU  75 -10.335   1.159  -0.460
  136    HB2  LEU  75           HB2      LEU  75 -11.016  -1.038  -0.709
  137    HB3  LEU  75           HB1      LEU  75 -10.147  -1.238  -2.225
  138    HG   LEU  75           HG       LEU  75  -8.021  -1.101  -0.802
  139   HD11  LEU  75          HD11      LEU  75 -10.034  -1.739   1.349
  140   HD12  LEU  75          HD12      LEU  75  -9.047  -0.278   1.244
  141   HD13  LEU  75          HD13      LEU  75  -8.279  -1.844   1.505
  142   HD21  LEU  75          HD21      LEU  75  -9.959  -3.386  -0.655
  143   HD22  LEU  75          HD22      LEU  75  -8.222  -3.503  -0.330
  144   HD23  LEU  75          HD23      LEU  75  -8.794  -3.045  -1.942
  145    H    ASN  76           HN       ASN  76  -8.902   1.072  -3.553
  146    HA   ASN  76           HA       ASN  76  -6.156   1.082  -2.847
  147    HB2  ASN  76           HB2      ASN  76  -7.627   1.020  -5.185
  148    HB3  ASN  76           HB1      ASN  76  -6.865   2.614  -5.238
  149   HD21  ASN  76          HD21      ASN  76  -6.404  -0.798  -5.288
  150   HD22  ASN  76          HD22      ASN  76  -4.730  -0.794  -5.751
  151    H    LEU  77           HN       LEU  77  -8.580   3.577  -3.426
  152    HA   LEU  77           HA       LEU  77  -6.769   5.722  -2.926
  153    HB2  LEU  77           HB2      LEU  77  -9.628   5.375  -3.591
  154    HB3  LEU  77           HB1      LEU  77  -9.196   6.849  -2.753
  155    HG   LEU  77           HG       LEU  77  -9.296   6.942  -5.287
  156   HD11  LEU  77          HD11      LEU  77  -7.339   8.406  -5.394
  157   HD12  LEU  77          HD12      LEU  77  -6.763   7.723  -3.874
  158   HD13  LEU  77          HD13      LEU  77  -8.262   8.646  -3.909
  159   HD21  LEU  77          HD21      LEU  77  -6.688   5.458  -5.016
  160   HD22  LEU  77          HD22      LEU  77  -7.308   6.198  -6.491
  161   HD23  LEU  77          HD23      LEU  77  -8.160   4.837  -5.762
  162    H    HIS  78           HN       HIS  78  -8.813   3.696  -1.061
  163    HA   HIS  78           HA       HIS  78  -8.812   5.223   1.337
  164    HB2  HIS  78           HB2      HIS  78 -10.335   3.381   1.194
  165    HB3  HIS  78           HB1      HIS  78  -9.036   2.256   0.786
  166    HD1  HIS  78           HD1      HIS  78 -10.560   4.067   3.717
  167    HD2  HIS  78           HD2      HIS  78  -7.665   1.191   2.922
  168    HE1  HIS  78           HE1      HIS  78  -9.893   3.096   5.951
  169    H    LYS  79           HN       LYS  79  -6.706   2.786  -0.049
  170    HA   LYS  79           HA       LYS  79  -4.871   2.656   2.125
  171    HB2  LYS  79           HB2      LYS  79  -5.256   0.920   0.304
  172    HB3  LYS  79           HB1      LYS  79  -4.359   1.974  -0.780
  173    HG2  LYS  79           HG2      LYS  79  -2.415   1.800   0.763
  174    HG3  LYS  79           HG1      LYS  79  -3.326   0.607   1.692
  175    HD2  LYS  79           HD2      LYS  79  -2.454   0.392  -1.187
  176    HD3  LYS  79           HD1      LYS  79  -1.850  -0.547   0.179
  177    HE2  LYS  79           HE2      LYS  79  -4.106  -1.509   0.467
  178    HE3  LYS  79           HE1      LYS  79  -4.646  -0.619  -0.955
  179    HZ1  LYS  79           HZ1      LYS  79  -2.494  -2.668  -0.926
  180    HZ2  LYS  79           HZ2      LYS  79  -3.050  -1.838  -2.298
  181    HZ3  LYS  79           HZ3      LYS  79  -4.077  -2.917  -1.482
  182    H    LYS  80           HN       LYS  80  -5.015   4.377  -0.937
  183    HA   LYS  80           HA       LYS  80  -2.586   5.779  -0.712
  184    HB2  LYS  80           HB2      LYS  80  -3.632   5.670  -2.841
  185    HB3  LYS  80           HB1      LYS  80  -5.146   6.305  -2.217
  186    HG2  LYS  80           HG2      LYS  80  -4.268   8.480  -2.060
  187    HG3  LYS  80           HG1      LYS  80  -2.617   7.926  -2.273
  188    HD2  LYS  80           HD2      LYS  80  -4.767   7.664  -4.368
  189    HD3  LYS  80           HD1      LYS  80  -3.651   9.029  -4.277
  190    HE2  LYS  80           HE2      LYS  80  -1.763   7.531  -4.525
  191    HE3  LYS  80           HE1      LYS  80  -2.846   6.143  -4.545
  192    HZ1  LYS  80           HZ1      LYS  80  -2.116   6.820  -6.783
  193    HZ2  LYS  80           HZ2      LYS  80  -2.858   8.328  -6.566
  194    HZ3  LYS  80           HZ3      LYS  80  -3.797   6.916  -6.606
  195    H    ARG  81           HN       ARG  81  -5.812   6.398   0.559
  196    HA   ARG  81           HA       ARG  81  -5.442   9.092   1.276
  197    HB2  ARG  81           HB2      ARG  81  -7.627   7.860   1.222
  198    HB3  ARG  81           HB1      ARG  81  -7.161   7.074   2.724
  199    HG2  ARG  81           HG2      ARG  81  -8.631   8.913   3.202
  200    HG3  ARG  81           HG1      ARG  81  -7.014   9.288   3.802
  201    HD2  ARG  81           HD2      ARG  81  -7.977  11.227   2.701
  202    HD3  ARG  81           HD1      ARG  81  -6.593  10.628   1.789
  203    HE   ARG  81           HE       ARG  81  -9.010   9.498   0.820
  204   HH11  ARG  81          HH11      ARG  81  -7.120  12.457   0.765
  205   HH12  ARG  81          HH12      ARG  81  -7.799  13.002  -0.745
  206   HH21  ARG  81          HH21      ARG  81  -9.876  10.196  -1.146
  207   HH22  ARG  81          HH22      ARG  81  -9.350  11.695  -1.850
  208    H    HIS  82           HN       HIS  82  -4.626   6.107   2.954
  209    HA   HIS  82           HA       HIS  82  -4.212   7.175   5.513
  210    HB2  HIS  82           HB2      HIS  82  -3.281   4.699   4.126
  211    HB3  HIS  82           HB1      HIS  82  -2.646   5.092   5.705
  212    HD1  HIS  82           HD1      HIS  82  -4.522   5.244   7.658
  213    HD2  HIS  82           HD2      HIS  82  -5.631   3.465   4.074
  214    HE1  HIS  82           HE1      HIS  82  -6.592   3.886   8.142
  215    H    SER  83           HN       SER  83  -1.998   6.831   2.779
  216    HA   SER  83           HA       SER  83   0.095   8.145   4.363
  217    HB2  SER  83           HB2      SER  83   1.502   7.390   2.292
  218    HB3  SER  83           HB1      SER  83   1.017   6.192   3.494
  219    HG   SER  83           HG       SER  83  -0.057   6.662   0.917
  220    H    GLY  84           HN       GLY  84  -2.302   9.328   2.883
  221    HA2  GLY  84           HA2      GLY  84  -2.613  11.444   1.959
  222    HA3  GLY  84           HA1      GLY  84  -0.873  11.581   1.749
  223    H    GLU  85           HN       GLU  85  -0.083   9.725   0.188
  224    HA   GLU  85           HA       GLU  85  -1.966   9.292  -1.988
  225    HB2  GLU  85           HB2      GLU  85  -0.151   9.784  -3.622
  226    HB3  GLU  85           HB1      GLU  85  -0.674  11.200  -2.722
  227    HG2  GLU  85           HG2      GLU  85   1.582   9.700  -1.580
  228    HG3  GLU  85           HG1      GLU  85   1.885  10.536  -3.101
  229    H    ALA  86           HN       ALA  86  -0.317   7.913  -3.645
  230    HA   ALA  86           HA       ALA  86   1.064   5.892  -2.082
  231    HB1  ALA  86           HB1      ALA  86  -0.168   4.032  -3.080
  232    HB2  ALA  86           HB2      ALA  86  -1.234   5.173  -3.900
  233    HB3  ALA  86           HB3      ALA  86  -1.241   5.070  -2.141
  234    H    ARG  87           HN       ARG  87   2.971   6.110  -3.016
  235    HA   ARG  87           HA       ARG  87   3.062   6.788  -5.834
  236    HB2  ARG  87           HB2      ARG  87   5.363   6.726  -3.890
  237    HB3  ARG  87           HB1      ARG  87   5.307   7.525  -5.452
  238    HG2  ARG  87           HG2      ARG  87   3.457   8.254  -3.228
  239    HG3  ARG  87           HG1      ARG  87   5.086   8.916  -3.362
  240    HD2  ARG  87           HD2      ARG  87   4.504   9.666  -5.670
  241    HD3  ARG  87           HD1      ARG  87   2.853   9.126  -5.368
  242    HE   ARG  87           HE       ARG  87   2.612  10.856  -3.771
  243   HH11  ARG  87          HH11      ARG  87   5.654  11.016  -5.515
  244   HH12  ARG  87          HH12      ARG  87   5.919  12.685  -5.109
  245   HH21  ARG  87          HH21      ARG  87   2.990  13.027  -3.223
  246   HH22  ARG  87          HH22      ARG  87   4.432  13.822  -3.807
  247    H    TYR  88           HN       TYR  88   5.423   5.051  -3.986
  248    HA   TYR  88           HA       TYR  88   5.781   3.130  -6.131
  249    HB2  TYR  88           HB2      TYR  88   7.212   3.440  -3.482
  250    HB3  TYR  88           HB1      TYR  88   7.695   2.384  -4.795
  251    HD1  TYR  88           HD1      TYR  88   7.108   5.957  -4.005
  252    HD2  TYR  88           HD2      TYR  88   9.238   3.140  -6.361
  253    HE1  TYR  88           HE1      TYR  88   8.477   7.769  -4.909
  254    HE2  TYR  88           HE2      TYR  88  10.621   4.946  -7.287
  255    HH   TYR  88           HH       TYR  88  10.844   7.969  -5.965
  256    H    ARG  89           HN       ARG  89   5.637   0.860  -5.764
  257    HA   ARG  89           HA       ARG  89   4.572   0.116  -3.140
  258    HB2  ARG  89           HB2      ARG  89   3.225  -1.604  -4.010
  259    HB3  ARG  89           HB1      ARG  89   2.866  -0.202  -4.998
  260    HG2  ARG  89           HG2      ARG  89   4.445  -1.108  -6.709
  261    HG3  ARG  89           HG1      ARG  89   4.562  -2.568  -5.715
  262    HD2  ARG  89           HD2      ARG  89   2.106  -2.803  -5.857
  263    HD3  ARG  89           HD1      ARG  89   2.077  -1.429  -6.967
  264    HE   ARG  89           HE       ARG  89   3.799  -3.065  -8.195
  265   HH11  ARG  89          HH11      ARG  89   0.607  -3.603  -6.846
  266   HH12  ARG  89          HH12      ARG  89   0.264  -4.958  -7.876
  267   HH21  ARG  89          HH21      ARG  89   3.337  -4.832  -9.574
  268   HH22  ARG  89          HH22      ARG  89   1.806  -5.654  -9.427
  269    H    CYS  90           HN       CYS  90   5.354  -1.763  -2.341
  270    HA   CYS  90           HA       CYS  90   7.915  -2.694  -3.150
  271    HB2  CYS  90           HB2      CYS  90   6.332  -2.883  -0.939
  272    HB3  CYS  90           HB1      CYS  90   6.120  -4.460  -1.623
  273    H    GLU  91           HN       GLU  91   8.153  -3.838  -5.088
  274    HA   GLU  91           HA       GLU  91   5.929  -4.915  -6.445
  275    HB2  GLU  91           HB2      GLU  91   7.600  -5.878  -8.005
  276    HB3  GLU  91           HB1      GLU  91   7.788  -4.148  -7.719
  277    HG2  GLU  91           HG2      GLU  91   9.539  -4.628  -6.133
  278    HG3  GLU  91           HG1      GLU  91   9.376  -6.348  -6.449
  279    H    ASP  92           HN       ASP  92   6.966  -6.053  -3.720
  280    HA   ASP  92           HA       ASP  92   6.789  -8.884  -4.503
  281    HB2  ASP  92           HB2      ASP  92   8.026  -9.259  -2.282
  282    HB3  ASP  92           HB1      ASP  92   8.956  -8.603  -3.626
  283    H    CYS  93           HN       CYS  93   5.726  -6.392  -2.200
  284    HA   CYS  93           HA       CYS  93   3.714  -8.306  -1.288
  285    HB2  CYS  93           HB2      CYS  93   4.043  -7.700   0.968
  286    HB3  CYS  93           HB1      CYS  93   5.659  -7.955   0.319
  287    H    GLY  94           HN       GLY  94   4.295  -5.525  -2.846
  288    HA2  GLY  94           HA2      GLY  94   3.039  -3.854  -3.639
  289    HA3  GLY  94           HA1      GLY  94   1.635  -4.810  -3.199
  290    H    LYS  95           HN       LYS  95   3.968  -3.579  -0.883
  291    HA   LYS  95           HA       LYS  95   2.006  -1.912   0.373
  292    HB2  LYS  95           HB2      LYS  95   4.876  -2.581   0.872
  293    HB3  LYS  95           HB1      LYS  95   4.103  -1.246   1.730
  294    HG2  LYS  95           HG2      LYS  95   2.319  -2.858   2.364
  295    HG3  LYS  95           HG1      LYS  95   3.355  -4.147   1.755
  296    HD2  LYS  95           HD2      LYS  95   4.934  -3.812   3.397
  297    HD3  LYS  95           HD1      LYS  95   4.395  -2.165   3.731
  298    HE2  LYS  95           HE2      LYS  95   3.690  -3.538   5.557
  299    HE3  LYS  95           HE1      LYS  95   2.273  -3.096   4.607
  300    HZ1  LYS  95           HZ1      LYS  95   3.691  -5.703   4.418
  301    HZ2  LYS  95           HZ2      LYS  95   2.274  -5.272   3.594
  302    HZ3  LYS  95           HZ3      LYS  95   2.262  -5.432   5.284
  303    H    LEU  96           HN       LEU  96   1.766   0.233   0.113
  304    HA   LEU  96           HA       LEU  96   3.307   1.457  -2.035
  305    HB2  LEU  96           HB2      LEU  96   0.777   2.312  -0.652
  306    HB3  LEU  96           HB1      LEU  96   1.605   3.311  -1.841
  307    HG   LEU  96           HG       LEU  96  -0.260   2.196  -2.888
  308   HD11  LEU  96          HD11      LEU  96   0.887   0.981  -4.671
  309   HD12  LEU  96          HD12      LEU  96   2.341   0.904  -3.671
  310   HD13  LEU  96          HD13      LEU  96   1.736   2.465  -4.239
  311   HD21  LEU  96          HD21      LEU  96   0.988  -0.355  -1.901
  312   HD22  LEU  96          HD22      LEU  96  -0.367  -0.261  -3.032
  313   HD23  LEU  96          HD23      LEU  96  -0.550   0.336  -1.380
  314    H    PHE  97           HN       PHE  97   4.881   2.769  -1.670
  315    HA   PHE  97           HA       PHE  97   4.899   4.260   0.873
  316    HB2  PHE  97           HB2      PHE  97   7.334   3.281  -0.633
  317    HB3  PHE  97           HB1      PHE  97   7.336   4.227   0.849
  318    HD1  PHE  97           HD2      PHE  97   6.345   0.936  -0.554
  319    HD2  PHE  97           HD1      PHE  97   7.147   3.217   2.954
  320    HE1  PHE  97           HE2      PHE  97   6.196  -1.125   0.814
  321    HE2  PHE  97           HE1      PHE  97   7.029   1.166   4.314
  322    HZ   PHE  97           HZ       PHE  97   6.555  -0.996   3.240
  323    H    THR  98           HN       THR  98   5.240   6.369   0.787
  324    HA   THR  98           HA       THR  98   5.104   7.618  -1.819
  325    HB   THR  98           HB       THR  98   4.673   9.670  -0.515
  326    HG1  THR  98           HG1      THR  98   4.554   9.477   1.773
  327   HG21  THR  98          HG21      THR  98   3.153   7.193   0.291
  328   HG22  THR  98          HG22      THR  98   2.832   8.221  -1.111
  329   HG23  THR  98          HG23      THR  98   2.561   8.844   0.521
  330    H    THR  99           HN       THR  99   7.440   6.614   0.252
  331    HA   THR  99           HA       THR  99   9.411   8.407  -0.967
  332    HB   THR  99           HB       THR  99   9.383   7.234   1.822
  333    HG1  THR  99           HG1      THR  99   9.106   9.844   0.748
  334   HG21  THR  99          HG21      THR  99  11.604   7.149   0.702
  335   HG22  THR  99          HG22      THR  99  11.555   8.137   2.163
  336   HG23  THR  99          HG23      THR  99  11.547   8.905   0.575
  337    H    SER 100           HN       SER 100  10.930   7.318  -2.105
  338    HA   SER 100           HA       SER 100  10.629   4.533  -2.500
  339    HB2  SER 100           HB2      SER 100  12.577   4.808  -4.045
  340    HB3  SER 100           HB1      SER 100  11.238   5.913  -4.379
  341    HG   SER 100           HG       SER 100  12.606   7.471  -4.123
  342    H    GLY 101           HN       GLY 101  12.718   6.533  -0.552
  343    HA2  GLY 101           HA2      GLY 101  14.582   4.453   0.063
  344    HA3  GLY 101           HA1      GLY 101  14.380   5.947   0.950
  345    H    ASN 102           HN       ASN 102  11.632   5.660   1.695
  346    HA   ASN 102           HA       ASN 102  11.713   3.898   3.894
  347    HB2  ASN 102           HB2      ASN 102   9.356   4.992   2.351
  348    HB3  ASN 102           HB1      ASN 102   9.195   4.043   3.818
  349   HD21  ASN 102          HD21      ASN 102  11.522   5.237   5.112
  350   HD22  ASN 102          HD22      ASN 102  11.051   6.849   5.552
  351    H    LEU 103           HN       LEU 103  10.562   3.693   0.624
  352    HA   LEU 103           HA       LEU 103   9.422   1.155   0.756
  353    HB2  LEU 103           HB2      LEU 103   8.883   2.516  -1.070
  354    HB3  LEU 103           HB1      LEU 103  10.577   2.861  -1.412
  355    HG   LEU 103           HG       LEU 103  10.799   0.411  -2.029
  356   HD11  LEU 103          HD11      LEU 103   8.859  -0.831  -2.518
  357   HD12  LEU 103          HD12      LEU 103   7.809   0.581  -2.284
  358   HD13  LEU 103          HD13      LEU 103   8.619  -0.172  -0.893
  359   HD21  LEU 103          HD21      LEU 103   9.011   2.231  -3.588
  360   HD22  LEU 103          HD22      LEU 103   9.883   0.841  -4.246
  361   HD23  LEU 103          HD23      LEU 103  10.771   2.234  -3.607
  362    H    LYS 104           HN       LYS 104  12.509   2.261  -0.484
  363    HA   LYS 104           HA       LYS 104  13.802  -0.013  -1.141
  364    HB2  LYS 104           HB2      LYS 104  14.764   2.041  -1.664
  365    HB3  LYS 104           HB1      LYS 104  14.682   2.613  -0.008
  366    HG2  LYS 104           HG2      LYS 104  16.524   1.303   0.634
  367    HG3  LYS 104           HG1      LYS 104  16.488   0.389  -0.886
  368    HD2  LYS 104           HD2      LYS 104  17.019   3.349  -0.665
  369    HD3  LYS 104           HD1      LYS 104  18.281   2.120  -0.794
  370    HE2  LYS 104           HE2      LYS 104  17.479   1.462  -2.967
  371    HE3  LYS 104           HE1      LYS 104  16.083   2.527  -2.820
  372    HZ1  LYS 104           HZ1      LYS 104  18.904   3.454  -2.867
  373    HZ2  LYS 104           HZ2      LYS 104  17.516   4.428  -2.896
  374    HZ3  LYS 104           HZ3      LYS 104  17.883   3.433  -4.219
  375    H    ARG 105           HN       ARG 105  13.920   1.485   2.132
  376    HA   ARG 105           HA       ARG 105  15.490  -0.519   3.303
  377    HB2  ARG 105           HB2      ARG 105  13.294   1.142   4.551
  378    HB3  ARG 105           HB1      ARG 105  14.428   0.153   5.458
  379    HG2  ARG 105           HG2      ARG 105  16.267   1.506   4.427
  380    HG3  ARG 105           HG1      ARG 105  15.017   2.591   3.811
  381    HD2  ARG 105           HD2      ARG 105  14.238   3.002   6.080
  382    HD3  ARG 105           HD1      ARG 105  15.445   1.882   6.710
  383    HE   ARG 105           HE       ARG 105  16.128   4.410   5.337
  384   HH11  ARG 105          HH11      ARG 105  16.726   1.972   7.796
  385   HH12  ARG 105          HH12      ARG 105  18.004   2.875   8.562
  386   HH21  ARG 105          HH21      ARG 105  17.818   5.587   6.331
  387   HH22  ARG 105          HH22      ARG 105  18.613   4.947   7.742
  388    H    HIS 106           HN       HIS 106  12.060  -0.302   2.754
  389    HA   HIS 106           HA       HIS 106  11.397  -2.742   4.086
  390    HB2  HIS 106           HB2      HIS 106   9.783  -0.892   3.855
  391    HB3  HIS 106           HB1      HIS 106   9.808  -1.087   2.108
  392    HD1  HIS 106           HD1      HIS 106   8.410  -2.660   5.226
  393    HD2  HIS 106           HD2      HIS 106   8.471  -3.216   1.120
  394    HE1  HIS 106           HE1      HIS 106   6.665  -4.422   4.728
  395    H    GLN 107           HN       GLN 107  12.737  -2.029   1.037
  396    HA   GLN 107           HA       GLN 107  11.695  -4.388  -0.292
  397    HB2  GLN 107           HB2      GLN 107  13.910  -2.514  -1.187
  398    HB3  GLN 107           HB1      GLN 107  13.070  -3.689  -2.188
  399    HG2  GLN 107           HG2      GLN 107  11.244  -1.802  -1.018
  400    HG3  GLN 107           HG1      GLN 107  12.534  -0.998  -1.904
  401   HE21  GLN 107          HE21      GLN 107   9.786  -3.073  -2.139
  402   HE22  GLN 107          HE22      GLN 107   9.694  -3.089  -3.876
  403    H    LEU 108           HN       LEU 108  14.286  -3.208   1.540
  404    HA   LEU 108           HA       LEU 108  16.249  -5.197   0.871
  405    HB2  LEU 108           HB2      LEU 108  16.051  -2.929   2.786
  406    HB3  LEU 108           HB1      LEU 108  17.340  -4.104   2.935
  407    HG   LEU 108           HG       LEU 108  18.507  -3.269   1.188
  408   HD11  LEU 108          HD11      LEU 108  17.527  -2.322  -0.836
  409   HD12  LEU 108          HD12      LEU 108  15.916  -2.490  -0.134
  410   HD13  LEU 108          HD13      LEU 108  16.883  -3.923  -0.486
  411   HD21  LEU 108          HD21      LEU 108  18.244  -0.849   0.994
  412   HD22  LEU 108          HD22      LEU 108  18.116  -1.388   2.670
  413   HD23  LEU 108          HD23      LEU 108  16.659  -0.966   1.763
  414    H    VAL 109           HN       VAL 109  13.644  -4.985   3.029
  415    HA   VAL 109           HA       VAL 109  14.758  -6.906   4.824
  416    HB   VAL 109           HB       VAL 109  12.601  -6.916   5.889
  417   HG11  VAL 109          HG11      VAL 109  12.290  -4.560   6.367
  418   HG12  VAL 109          HG12      VAL 109  13.198  -4.142   4.912
  419   HG13  VAL 109          HG13      VAL 109  14.010  -4.945   6.260
  420   HG21  VAL 109          HG21      VAL 109  11.214  -7.087   3.933
  421   HG22  VAL 109          HG22      VAL 109  11.662  -5.448   3.457
  422   HG23  VAL 109          HG23      VAL 109  10.691  -5.713   4.911
  423    H    HIS 110           HN       HIS 110  13.111  -6.840   1.812
  424    HA   HIS 110           HA       HIS 110  12.310  -9.639   1.941
  425    HB2  HIS 110           HB2      HIS 110  12.240  -7.565  -0.236
  426    HB3  HIS 110           HB1      HIS 110  11.766  -9.223  -0.507
  427    HD1  HIS 110           HD1      HIS 110   9.374  -9.859   0.241
  428    HD2  HIS 110           HD2      HIS 110  10.656  -6.107   1.420
  429    HE1  HIS 110           HE1      HIS 110   7.318  -8.617   1.037
  430    H    SER 111           HN       SER 111  15.122  -7.940   1.344
  431    HA   SER 111           HA       SER 111  16.505 -10.304   0.450
  432    HB2  SER 111           HB2      SER 111  15.647  -9.253  -1.671
  433    HB3  SER 111           HB1      SER 111  16.602  -7.820  -1.291
  434    HG   SER 111           HG       SER 111  18.477  -9.128  -1.378
  435    H    GLY 112           HN       GLY 112  16.791  -9.251   2.800
  436    HA2  GLY 112           HA2      GLY 112  19.398  -7.924   2.733
  437    HA3  GLY 112           HA1      GLY 112  18.076  -7.149   3.614
  Start of MODEL   13
    1    H    LYS  58           HT1      LYS  58 -21.237  -4.245  -5.585
    2    HA   LYS  58           HA       LYS  58 -20.177  -5.942  -4.210
    3    HB2  LYS  58           HB2      LYS  58 -18.298  -4.348  -5.970
    4    HB3  LYS  58           HB1      LYS  58 -18.042  -6.009  -5.458
    5    HG2  LYS  58           HG2      LYS  58 -20.139  -6.636  -6.632
    6    HG3  LYS  58           HG1      LYS  58 -20.232  -4.983  -7.245
    7    HD2  LYS  58           HD2      LYS  58 -18.058  -5.270  -8.333
    8    HD3  LYS  58           HD1      LYS  58 -17.964  -6.920  -7.714
    9    HE2  LYS  58           HE2      LYS  58 -20.041  -7.448  -8.953
   10    HE3  LYS  58           HE1      LYS  58 -20.001  -5.827  -9.645
   11    HZ1  LYS  58           HZ1      LYS  58 -19.038  -7.401 -11.169
   12    HZ2  LYS  58           HZ2      LYS  58 -17.939  -7.938  -9.995
   13    HZ3  LYS  58           HZ3      LYS  58 -17.822  -6.364 -10.604
   14    HA   PRO  59           HA       PRO  59 -17.900  -4.199  -0.797
   15    HB2  PRO  59           HB2      PRO  59 -17.499  -6.469   0.565
   16    HB3  PRO  59           HB1      PRO  59 -19.099  -5.719   0.465
   17    HG2  PRO  59           HG2      PRO  59 -17.992  -8.028  -1.075
   18    HG3  PRO  59           HG1      PRO  59 -19.599  -7.834  -0.353
   19    HD2  PRO  59           HD2      PRO  59 -19.051  -7.413  -3.007
   20    HD3  PRO  59           HD1      PRO  59 -20.374  -6.632  -2.132
   21    H    TYR  60           HN       TYR  60 -15.967  -3.548  -1.255
   22    HA   TYR  60           HA       TYR  60 -13.799  -5.541  -1.410
   23    HB2  TYR  60           HB2      TYR  60 -13.823  -2.764  -2.620
   24    HB3  TYR  60           HB1      TYR  60 -12.453  -3.872  -2.632
   25    HD1  TYR  60           HD2      TYR  60 -13.160  -6.292  -3.603
   26    HD2  TYR  60           HD1      TYR  60 -14.966  -2.580  -4.590
   27    HE1  TYR  60           HE2      TYR  60 -13.963  -7.251  -5.703
   28    HE2  TYR  60           HE1      TYR  60 -15.783  -3.532  -6.693
   29    HH   TYR  60           HH       TYR  60 -15.107  -5.387  -8.245
   30    H    GLY  61           HN       GLY  61 -13.383  -5.568   0.780
   31    HA2  GLY  61           HA2      GLY  61 -13.238  -2.951   2.086
   32    HA3  GLY  61           HA1      GLY  61 -13.734  -4.432   2.879
   33    H    CYS  62           HN       CYS  62 -11.727  -2.448   3.457
   34    HA   CYS  62           HA       CYS  62  -9.119  -3.512   3.163
   35    HB2  CYS  62           HB2      CYS  62 -10.226  -1.171   4.078
   36    HB3  CYS  62           HB1      CYS  62  -9.679  -1.916   5.566
   37    H    GLU  63           HN       GLU  63  -8.540  -5.443   4.030
   38    HA   GLU  63           HA       GLU  63 -10.022  -6.624   6.168
   39    HB2  GLU  63           HB2      GLU  63  -7.445  -7.434   4.827
   40    HB3  GLU  63           HB1      GLU  63  -8.300  -8.415   6.009
   41    HG2  GLU  63           HG2      GLU  63 -10.184  -8.641   4.564
   42    HG3  GLU  63           HG1      GLU  63  -9.526  -7.452   3.441
   43    H    GLU  64           HN       GLU  64  -7.797  -4.239   6.273
   44    HA   GLU  64           HA       GLU  64  -6.489  -5.115   8.721
   45    HB2  GLU  64           HB2      GLU  64  -5.467  -2.734   8.451
   46    HB3  GLU  64           HB1      GLU  64  -4.919  -4.050   7.433
   47    HG2  GLU  64           HG2      GLU  64  -5.854  -3.180   5.565
   48    HG3  GLU  64           HG1      GLU  64  -7.165  -2.398   6.457
   49    H    CYS  65           HN       CYS  65  -8.861  -2.712   7.646
   50    HA   CYS  65           HA       CYS  65  -9.101  -1.808  10.432
   51    HB2  CYS  65           HB2      CYS  65  -9.755   0.433   9.362
   52    HB3  CYS  65           HB1      CYS  65  -8.043  -0.001   9.340
   53    H    GLY  66           HN       GLY  66 -10.440  -3.366   7.944
   54    HA2  GLY  66           HA2      GLY  66 -12.450  -4.317   7.678
   55    HA3  GLY  66           HA1      GLY  66 -12.870  -3.702   9.271
   56    H    LYS  67           HN       LYS  67 -11.979  -1.782   6.473
   57    HA   LYS  67           HA       LYS  67 -14.697  -0.655   6.454
   58    HB2  LYS  67           HB2      LYS  67 -12.087   0.606   5.576
   59    HB3  LYS  67           HB1      LYS  67 -13.669   1.363   5.452
   60    HG2  LYS  67           HG2      LYS  67 -12.409   0.491   8.039
   61    HG3  LYS  67           HG1      LYS  67 -12.339   2.132   7.393
   62    HD2  LYS  67           HD2      LYS  67 -14.708   2.371   7.557
   63    HD3  LYS  67           HD1      LYS  67 -14.913   0.660   7.931
   64    HE2  LYS  67           HE2      LYS  67 -13.355   2.556   9.673
   65    HE3  LYS  67           HE1      LYS  67 -15.075   2.237   9.891
   66    HZ1  LYS  67           HZ1      LYS  67 -12.983   0.125   9.933
   67    HZ2  LYS  67           HZ2      LYS  67 -14.622  -0.047  10.330
   68    HZ3  LYS  67           HZ3      LYS  67 -13.605   0.878  11.318
   69    H    SER  68           HN       SER  68 -15.847  -1.544   4.851
   70    HA   SER  68           HA       SER  68 -14.485  -2.512   2.472
   71    HB2  SER  68           HB2      SER  68 -17.450  -2.614   2.681
   72    HB3  SER  68           HB1      SER  68 -16.315  -3.820   2.070
   73    HG   SER  68           HG       SER  68 -16.161  -4.673   3.985
   74    H    TYR  69           HN       TYR  69 -14.774  -1.771   0.440
   75    HA   TYR  69           HA       TYR  69 -16.331   0.720   0.155
   76    HB2  TYR  69           HB2      TYR  69 -13.622   0.012  -0.915
   77    HB3  TYR  69           HB1      TYR  69 -14.623   1.171  -1.764
   78    HD1  TYR  69           HD2      TYR  69 -13.093   0.434   1.527
   79    HD2  TYR  69           HD1      TYR  69 -14.721   3.390  -1.046
   80    HE1  TYR  69           HE2      TYR  69 -12.346   2.177   3.070
   81    HE2  TYR  69           HE1      TYR  69 -13.975   5.154   0.481
   82    HH   TYR  69           HH       TYR  69 -13.440   5.373   2.912
   83    H    ARG  70           HN       ARG  70 -16.913   1.179  -2.158
   84    HA   ARG  70           HA       ARG  70 -18.414  -1.096  -3.083
   85    HB2  ARG  70           HB2      ARG  70 -18.269   1.708  -4.210
   86    HB3  ARG  70           HB1      ARG  70 -19.467   0.488  -4.620
   87    HG2  ARG  70           HG2      ARG  70 -19.093   1.654  -1.871
   88    HG3  ARG  70           HG1      ARG  70 -20.282   2.214  -3.048
   89    HD2  ARG  70           HD2      ARG  70 -20.132  -0.610  -2.005
   90    HD3  ARG  70           HD1      ARG  70 -21.178   0.638  -1.330
   91    HE   ARG  70           HE       ARG  70 -21.571   0.362  -4.137
   92   HH11  ARG  70          HH11      ARG  70 -22.360  -1.082  -1.041
   93   HH12  ARG  70          HH12      ARG  70 -23.826  -1.815  -1.611
   94   HH21  ARG  70          HH21      ARG  70 -23.493  -0.606  -4.897
   95   HH22  ARG  70          HH22      ARG  70 -24.483  -1.527  -3.804
   96    H    LEU  71           HN       LEU  71 -15.784   0.939  -4.353
   97    HA   LEU  71           HA       LEU  71 -15.520  -0.960  -6.580
   98    HB2  LEU  71           HB2      LEU  71 -14.431   1.851  -6.402
   99    HB3  LEU  71           HB1      LEU  71 -14.314   0.782  -7.785
  100    HG   LEU  71           HG       LEU  71 -16.028   2.028  -8.519
  101   HD11  LEU  71          HD11      LEU  71 -17.638   0.359  -6.625
  102   HD12  LEU  71          HD12      LEU  71 -16.999  -0.212  -8.173
  103   HD13  LEU  71          HD13      LEU  71 -18.196   1.088  -8.133
  104   HD21  LEU  71          HD21      LEU  71 -15.878   3.588  -6.622
  105   HD22  LEU  71          HD22      LEU  71 -16.983   2.548  -5.727
  106   HD23  LEU  71          HD23      LEU  71 -17.530   3.351  -7.195
  107    H    ILE  72           HN       ILE  72 -13.295  -1.431  -7.276
  108    HA   ILE  72           HA       ILE  72 -11.559  -1.988  -5.101
  109    HB   ILE  72           HB       ILE  72 -11.243  -2.190  -8.085
  110   HG12  ILE  72          HG12      ILE  72 -12.523  -3.883  -6.715
  111   HG13  ILE  72          HG11      ILE  72 -11.211  -4.549  -7.679
  112   HG21  ILE  72          HG21      ILE  72  -9.073  -1.466  -7.213
  113   HG22  ILE  72          HG22      ILE  72  -9.025  -3.130  -7.798
  114   HG23  ILE  72          HG23      ILE  72  -9.097  -2.805  -6.066
  115   HD11  ILE  72          HD11      ILE  72 -11.270  -5.542  -5.470
  116   HD12  ILE  72          HD12      ILE  72 -11.125  -3.946  -4.732
  117   HD13  ILE  72          HD13      ILE  72  -9.794  -4.601  -5.686
  118    H    SER  73           HN       SER  73 -11.595   0.451  -7.678
  119    HA   SER  73           HA       SER  73  -9.224   1.766  -6.963
  120    HB2  SER  73           HB2      SER  73 -11.683   3.086  -8.121
  121    HB3  SER  73           HB1      SER  73 -10.003   3.591  -8.313
  122    HG   SER  73           HG       SER  73 -11.331   2.089  -9.939
  123    H    LEU  74           HN       LEU  74 -12.511   2.114  -5.801
  124    HA   LEU  74           HA       LEU  74 -12.281   4.289  -4.126
  125    HB2  LEU  74           HB2      LEU  74 -14.040   2.049  -4.531
  126    HB3  LEU  74           HB1      LEU  74 -13.830   2.341  -2.808
  127    HG   LEU  74           HG       LEU  74 -14.879   4.262  -4.867
  128   HD11  LEU  74          HD11      LEU  74 -16.079   3.071  -2.365
  129   HD12  LEU  74          HD12      LEU  74 -16.477   2.603  -4.021
  130   HD13  LEU  74          HD13      LEU  74 -16.865   4.226  -3.442
  131   HD21  LEU  74          HD21      LEU  74 -13.940   4.636  -2.056
  132   HD22  LEU  74          HD22      LEU  74 -15.072   5.755  -2.827
  133   HD23  LEU  74          HD23      LEU  74 -13.456   5.518  -3.503
  134    H    LEU  75           HN       LEU  75 -11.823   0.923  -3.355
  135    HA   LEU  75           HA       LEU  75 -10.969   1.363  -0.698
  136    HB2  LEU  75           HB2      LEU  75 -11.927  -0.703  -1.125
  137    HB3  LEU  75           HB1      LEU  75 -11.026  -0.919  -2.622
  138    HG   LEU  75           HG       LEU  75  -8.959  -1.108  -1.115
  139   HD11  LEU  75          HD11      LEU  75 -11.094  -1.704   0.922
  140   HD12  LEU  75          HD12      LEU  75 -10.057  -0.275   0.923
  141   HD13  LEU  75          HD13      LEU  75  -9.350  -1.879   1.134
  142   HD21  LEU  75          HD21      LEU  75 -11.155  -3.138  -1.267
  143   HD22  LEU  75          HD22      LEU  75  -9.500  -3.509  -0.752
  144   HD23  LEU  75          HD23      LEU  75  -9.806  -2.902  -2.387
  145    H    ASN  76           HN       ASN  76  -9.492   1.274  -3.780
  146    HA   ASN  76           HA       ASN  76  -6.808   0.812  -2.947
  147    HB2  ASN  76           HB2      ASN  76  -8.058   0.862  -5.365
  148    HB3  ASN  76           HB1      ASN  76  -7.234   2.424  -5.385
  149   HD21  ASN  76          HD21      ASN  76  -6.886  -1.005  -5.267
  150   HD22  ASN  76          HD22      ASN  76  -5.188  -1.059  -5.630
  151    H    LEU  77           HN       LEU  77  -8.845   3.600  -3.466
  152    HA   LEU  77           HA       LEU  77  -6.749   5.472  -2.937
  153    HB2  LEU  77           HB2      LEU  77  -9.635   5.530  -3.601
  154    HB3  LEU  77           HB1      LEU  77  -8.969   6.931  -2.796
  155    HG   LEU  77           HG       LEU  77  -9.074   6.928  -5.362
  156   HD11  LEU  77          HD11      LEU  77  -6.538   7.521  -3.876
  157   HD12  LEU  77          HD12      LEU  77  -7.926   8.587  -4.058
  158   HD13  LEU  77          HD13      LEU  77  -6.951   8.163  -5.466
  159   HD21  LEU  77          HD21      LEU  77  -7.154   5.943  -6.494
  160   HD22  LEU  77          HD22      LEU  77  -8.108   4.687  -5.703
  161   HD23  LEU  77          HD23      LEU  77  -6.599   5.239  -4.975
  162    H    HIS  78           HN       HIS  78  -9.087   3.700  -1.162
  163    HA   HIS  78           HA       HIS  78  -8.873   5.131   1.293
  164    HB2  HIS  78           HB2      HIS  78 -10.679   3.579   1.091
  165    HB3  HIS  78           HB1      HIS  78  -9.589   2.266   0.636
  166    HD1  HIS  78           HD1      HIS  78 -10.754   4.214   3.651
  167    HD2  HIS  78           HD2      HIS  78  -8.456   0.878   2.723
  168    HE1  HIS  78           HE1      HIS  78 -10.265   3.062   5.843
  169    H    LYS  79           HN       LYS  79  -7.124   2.459  -0.177
  170    HA   LYS  79           HA       LYS  79  -5.389   1.993   2.038
  171    HB2  LYS  79           HB2      LYS  79  -5.978   0.363   0.178
  172    HB3  LYS  79           HB1      LYS  79  -4.889   1.278  -0.856
  173    HG2  LYS  79           HG2      LYS  79  -3.025   0.757   0.622
  174    HG3  LYS  79           HG1      LYS  79  -4.112  -0.131   1.690
  175    HD2  LYS  79           HD2      LYS  79  -3.428  -0.801  -1.170
  176    HD3  LYS  79           HD1      LYS  79  -2.930  -1.688   0.271
  177    HE2  LYS  79           HE2      LYS  79  -5.285  -2.203   0.749
  178    HE3  LYS  79           HE1      LYS  79  -5.761  -1.340  -0.712
  179    HZ1  LYS  79           HZ1      LYS  79  -5.676  -3.698  -1.128
  180    HZ2  LYS  79           HZ2      LYS  79  -4.072  -3.777  -0.584
  181    HZ3  LYS  79           HZ3      LYS  79  -4.440  -2.926  -2.004
  182    H    LYS  80           HN       LYS  80  -5.270   3.879  -0.905
  183    HA   LYS  80           HA       LYS  80  -2.688   4.958  -0.576
  184    HB2  LYS  80           HB2      LYS  80  -3.668   5.214  -2.704
  185    HB3  LYS  80           HB1      LYS  80  -5.167   5.838  -2.036
  186    HG2  LYS  80           HG2      LYS  80  -4.179   7.943  -1.575
  187    HG3  LYS  80           HG1      LYS  80  -2.562   7.342  -1.907
  188    HD2  LYS  80           HD2      LYS  80  -4.735   7.369  -3.987
  189    HD3  LYS  80           HD1      LYS  80  -3.680   8.757  -3.709
  190    HE2  LYS  80           HE2      LYS  80  -1.733   7.383  -4.146
  191    HE3  LYS  80           HE1      LYS  80  -2.761   5.973  -4.377
  192    HZ1  LYS  80           HZ1      LYS  80  -3.676   6.909  -6.339
  193    HZ2  LYS  80           HZ2      LYS  80  -1.993   7.090  -6.466
  194    HZ3  LYS  80           HZ3      LYS  80  -2.957   8.420  -6.047
  195    H    ARG  81           HN       ARG  81  -5.864   5.866   0.651
  196    HA   ARG  81           HA       ARG  81  -5.240   8.405   1.639
  197    HB2  ARG  81           HB2      ARG  81  -7.531   7.428   1.403
  198    HB3  ARG  81           HB1      ARG  81  -7.215   6.458   2.834
  199    HG2  ARG  81           HG2      ARG  81  -8.525   8.418   3.385
  200    HG3  ARG  81           HG1      ARG  81  -6.937   8.497   4.155
  201    HD2  ARG  81           HD2      ARG  81  -6.152  10.010   2.433
  202    HD3  ARG  81           HD1      ARG  81  -7.686   9.869   1.575
  203    HE   ARG  81           HE       ARG  81  -8.320  10.767   4.100
  204   HH11  ARG  81          HH11      ARG  81  -6.300  11.890   1.461
  205   HH12  ARG  81          HH12      ARG  81  -6.575  13.576   1.810
  206   HH21  ARG  81          HH21      ARG  81  -8.682  12.955   4.555
  207   HH22  ARG  81          HH22      ARG  81  -7.944  14.180   3.564
  208    H    HIS  82           HN       HIS  82  -4.932   5.223   3.166
  209    HA   HIS  82           HA       HIS  82  -4.331   6.039   5.760
  210    HB2  HIS  82           HB2      HIS  82  -3.657   3.600   4.171
  211    HB3  HIS  82           HB1      HIS  82  -2.937   3.822   5.747
  212    HD1  HIS  82           HD1      HIS  82  -4.586   3.745   7.798
  213    HD2  HIS  82           HD2      HIS  82  -6.241   2.867   4.101
  214    HE1  HIS  82           HE1      HIS  82  -6.770   2.585   8.256
  215    H    SER  83           HN       SER  83  -2.212   5.642   2.973
  216    HA   SER  83           HA       SER  83   0.105   6.413   4.572
  217    HB2  SER  83           HB2      SER  83   0.085   5.650   1.652
  218    HB3  SER  83           HB1      SER  83   1.434   5.572   2.790
  219    HG   SER  83           HG       SER  83  -0.607   3.780   2.338
  220    H    GLY  84           HN       GLY  84  -2.239   8.108   3.357
  221    HA2  GLY  84           HA2      GLY  84  -2.374  10.329   2.673
  222    HA3  GLY  84           HA1      GLY  84  -0.620  10.364   2.523
  223    H    GLU  85           HN       GLU  85   0.145   8.725   0.760
  224    HA   GLU  85           HA       GLU  85  -1.724   8.492  -1.445
  225    HB2  GLU  85           HB2      GLU  85   0.061   9.171  -3.032
  226    HB3  GLU  85           HB1      GLU  85  -0.469  10.484  -1.993
  227    HG2  GLU  85           HG2      GLU  85   1.883   8.859  -1.199
  228    HG3  GLU  85           HG1      GLU  85   2.055  10.087  -2.448
  229    H    ALA  86           HN       ALA  86  -0.942   6.903  -2.991
  230    HA   ALA  86           HA       ALA  86   0.811   4.909  -1.737
  231    HB1  ALA  86           HB1      ALA  86  -1.528   4.161  -1.922
  232    HB2  ALA  86           HB2      ALA  86  -0.422   3.175  -2.880
  233    HB3  ALA  86           HB3      ALA  86  -1.437   4.380  -3.671
  234    H    ARG  87           HN       ARG  87   2.683   5.518  -2.621
  235    HA   ARG  87           HA       ARG  87   2.858   6.144  -5.433
  236    HB2  ARG  87           HB2      ARG  87   4.980   6.127  -3.301
  237    HB3  ARG  87           HB1      ARG  87   5.120   6.840  -4.909
  238    HG2  ARG  87           HG2      ARG  87   3.177   7.639  -2.785
  239    HG3  ARG  87           HG1      ARG  87   4.711   8.432  -3.124
  240    HD2  ARG  87           HD2      ARG  87   2.378   8.163  -5.010
  241    HD3  ARG  87           HD1      ARG  87   2.854   9.635  -4.165
  242    HE   ARG  87           HE       ARG  87   5.089   9.042  -5.527
  243   HH11  ARG  87          HH11      ARG  87   1.728   9.206  -6.503
  244   HH12  ARG  87          HH12      ARG  87   2.094   9.690  -8.131
  245   HH21  ARG  87          HH21      ARG  87   5.570   9.696  -7.674
  246   HH22  ARG  87          HH22      ARG  87   4.265   9.979  -8.793
  247    H    TYR  88           HN       TYR  88   5.438   4.594  -3.797
  248    HA   TYR  88           HA       TYR  88   5.576   2.530  -5.823
  249    HB2  TYR  88           HB2      TYR  88   7.333   3.147  -3.441
  250    HB3  TYR  88           HB1      TYR  88   7.668   1.913  -4.644
  251    HD1  TYR  88           HD1      TYR  88   6.987   5.562  -4.384
  252    HD2  TYR  88           HD2      TYR  88   9.006   2.440  -6.431
  253    HE1  TYR  88           HE1      TYR  88   8.163   7.228  -5.753
  254    HE2  TYR  88           HE2      TYR  88  10.190   4.078  -7.799
  255    HH   TYR  88           HH       TYR  88  10.273   7.392  -7.057
  256    H    ARG  89           HN       ARG  89   5.691   0.281  -5.277
  257    HA   ARG  89           HA       ARG  89   4.916  -0.322  -2.517
  258    HB2  ARG  89           HB2      ARG  89   3.648  -2.213  -3.146
  259    HB3  ARG  89           HB1      ARG  89   3.089  -0.913  -4.184
  260    HG2  ARG  89           HG2      ARG  89   4.590  -1.803  -5.970
  261    HG3  ARG  89           HG1      ARG  89   4.911  -3.181  -4.909
  262    HD2  ARG  89           HD2      ARG  89   2.481  -3.620  -4.828
  263    HD3  ARG  89           HD1      ARG  89   2.247  -2.321  -6.000
  264    HE   ARG  89           HE       ARG  89   3.534  -4.914  -6.506
  265   HH11  ARG  89          HH11      ARG  89   2.271  -1.872  -7.673
  266   HH12  ARG  89          HH12      ARG  89   2.301  -2.342  -9.345
  267   HH21  ARG  89          HH21      ARG  89   3.551  -5.561  -8.713
  268   HH22  ARG  89          HH22      ARG  89   2.996  -4.451  -9.928
  269    H    CYS  90           HN       CYS  90   5.911  -2.073  -1.652
  270    HA   CYS  90           HA       CYS  90   8.508  -2.755  -2.527
  271    HB2  CYS  90           HB2      CYS  90   7.126  -3.026  -0.232
  272    HB3  CYS  90           HB1      CYS  90   6.952  -4.644  -0.865
  273    H    GLU  91           HN       GLU  91   8.896  -3.954  -4.340
  274    HA   GLU  91           HA       GLU  91   6.854  -5.402  -5.642
  275    HB2  GLU  91           HB2      GLU  91   8.728  -6.199  -7.123
  276    HB3  GLU  91           HB1      GLU  91   8.520  -4.453  -7.014
  277    HG2  GLU  91           HG2      GLU  91  10.294  -4.393  -5.360
  278    HG3  GLU  91           HG1      GLU  91  10.544  -6.119  -5.564
  279    H    ASP  92           HN       ASP  92   8.005  -6.220  -2.865
  280    HA   ASP  92           HA       ASP  92   8.096  -9.086  -3.486
  281    HB2  ASP  92           HB2      ASP  92   9.355  -9.299  -1.288
  282    HB3  ASP  92           HB1      ASP  92  10.232  -8.572  -2.629
  283    H    CYS  93           HN       CYS  93   6.815  -6.590  -1.293
  284    HA   CYS  93           HA       CYS  93   5.026  -8.639  -0.247
  285    HB2  CYS  93           HB2      CYS  93   5.409  -8.003   1.976
  286    HB3  CYS  93           HB1      CYS  93   7.006  -8.115   1.254
  287    H    GLY  94           HN       GLY  94   5.229  -5.933  -1.947
  288    HA2  GLY  94           HA2      GLY  94   3.736  -4.462  -2.734
  289    HA3  GLY  94           HA1      GLY  94   2.483  -5.509  -2.086
  290    H    LYS  95           HN       LYS  95   4.881  -3.859  -0.130
  291    HA   LYS  95           HA       LYS  95   2.832  -2.340   1.210
  292    HB2  LYS  95           HB2      LYS  95   5.786  -2.688   1.595
  293    HB3  LYS  95           HB1      LYS  95   4.873  -1.474   2.491
  294    HG2  LYS  95           HG2      LYS  95   3.337  -3.298   3.172
  295    HG3  LYS  95           HG1      LYS  95   4.497  -4.446   2.507
  296    HD2  LYS  95           HD2      LYS  95   6.116  -3.864   4.086
  297    HD3  LYS  95           HD1      LYS  95   5.269  -2.381   4.542
  298    HE2  LYS  95           HE2      LYS  95   4.856  -3.916   6.293
  299    HE3  LYS  95           HE1      LYS  95   3.380  -3.840   5.329
  300    HZ1  LYS  95           HZ1      LYS  95   4.101  -5.899   4.206
  301    HZ2  LYS  95           HZ2      LYS  95   3.861  -6.108   5.867
  302    HZ3  LYS  95           HZ3      LYS  95   5.436  -5.988   5.253
  303    H    LEU  96           HN       LEU  96   2.360  -0.253   0.850
  304    HA   LEU  96           HA       LEU  96   3.634   0.997  -1.444
  305    HB2  LEU  96           HB2      LEU  96   1.189   1.715   0.158
  306    HB3  LEU  96           HB1      LEU  96   1.828   2.751  -1.112
  307    HG   LEU  96           HG       LEU  96  -0.003   1.508  -2.017
  308   HD11  LEU  96          HD11      LEU  96   1.911   1.788  -3.498
  309   HD12  LEU  96          HD12      LEU  96   1.052   0.281  -3.830
  310   HD13  LEU  96          HD13      LEU  96   2.574   0.253  -2.932
  311   HD21  LEU  96          HD21      LEU  96  -0.056  -0.941  -2.044
  312   HD22  LEU  96          HD22      LEU  96  -0.094  -0.296  -0.400
  313   HD23  LEU  96          HD23      LEU  96   1.405  -0.968  -1.048
  314    H    PHE  97           HN       PHE  97   5.206   2.351  -1.271
  315    HA   PHE  97           HA       PHE  97   5.374   4.019   1.157
  316    HB2  PHE  97           HB2      PHE  97   7.700   3.062  -0.519
  317    HB3  PHE  97           HB1      PHE  97   7.809   4.121   0.882
  318    HD1  PHE  97           HD2      PHE  97   6.908   0.692  -0.190
  319    HD2  PHE  97           HD1      PHE  97   7.780   3.274   3.085
  320    HE1  PHE  97           HE2      PHE  97   6.944  -1.254   1.339
  321    HE2  PHE  97           HE1      PHE  97   7.836   1.337   4.602
  322    HZ   PHE  97           HZ       PHE  97   7.418  -0.924   3.723
  323    H    THR  98           HN       THR  98   5.360   6.078   0.924
  324    HA   THR  98           HA       THR  98   4.702   7.222  -1.594
  325    HB   THR  98           HB       THR  98   4.435   9.271  -0.339
  326    HG1  THR  98           HG1      THR  98   5.081   8.839   2.098
  327   HG21  THR  98          HG21      THR  98   2.942   8.447   1.440
  328   HG22  THR  98          HG22      THR  98   3.674   6.844   1.284
  329   HG23  THR  98          HG23      THR  98   2.751   7.526  -0.057
  330    H    THR  99           HN       THR  99   7.592   6.516  -0.082
  331    HA   THR  99           HA       THR  99   9.058   8.324  -1.854
  332    HB   THR  99           HB       THR  99   9.496   7.784   1.077
  333    HG1  THR  99           HG1      THR  99   8.261   9.677   0.082
  334   HG21  THR  99          HG21      THR  99  11.571   7.466  -0.366
  335   HG22  THR  99          HG22      THR  99  11.679   8.583   0.995
  336   HG23  THR  99          HG23      THR  99  11.493   9.207  -0.644
  337    H    SER 100           HN       SER 100  10.564   7.268  -3.026
  338    HA   SER 100           HA       SER 100  10.600   4.449  -3.013
  339    HB2  SER 100           HB2      SER 100  12.395   4.756  -4.767
  340    HB3  SER 100           HB1      SER 100  10.851   5.548  -5.105
  341    HG   SER 100           HG       SER 100  12.473   7.008  -5.519
  342    H    GLY 101           HN       GLY 101  12.704   6.911  -1.676
  343    HA2  GLY 101           HA2      GLY 101  14.863   5.189  -1.030
  344    HA3  GLY 101           HA1      GLY 101  14.523   6.741  -0.294
  345    H    ASN 102           HN       ASN 102  12.008   6.234   0.829
  346    HA   ASN 102           HA       ASN 102  12.569   4.784   3.182
  347    HB2  ASN 102           HB2      ASN 102   9.924   5.519   1.915
  348    HB3  ASN 102           HB1      ASN 102  10.077   4.786   3.503
  349   HD21  ASN 102          HD21      ASN 102   8.903   7.340   2.870
  350   HD22  ASN 102          HD22      ASN 102   9.828   8.544   3.702
  351    H    LEU 103           HN       LEU 103  11.030   4.067   0.156
  352    HA   LEU 103           HA       LEU 103  10.063   1.530   0.774
  353    HB2  LEU 103           HB2      LEU 103   9.236   2.534  -1.160
  354    HB3  LEU 103           HB1      LEU 103  10.843   2.970  -1.727
  355    HG   LEU 103           HG       LEU 103  11.239   0.480  -2.048
  356   HD11  LEU 103          HD11      LEU 103   8.237   0.359  -2.048
  357   HD12  LEU 103          HD12      LEU 103   9.215  -0.115  -0.642
  358   HD13  LEU 103          HD13      LEU 103   9.404  -0.976  -2.174
  359   HD21  LEU 103          HD21      LEU 103  10.885   2.077  -3.823
  360   HD22  LEU 103          HD22      LEU 103   9.142   1.911  -3.624
  361   HD23  LEU 103          HD23      LEU 103  10.098   0.536  -4.191
  362    H    LYS 104           HN       LYS 104  12.965   2.622  -0.873
  363    HA   LYS 104           HA       LYS 104  14.326   0.322  -1.361
  364    HB2  LYS 104           HB2      LYS 104  15.102   3.115  -0.720
  365    HB3  LYS 104           HB1      LYS 104  16.375   1.902  -0.784
  366    HG2  LYS 104           HG2      LYS 104  15.729   1.339  -3.071
  367    HG3  LYS 104           HG1      LYS 104  14.432   2.543  -2.994
  368    HD2  LYS 104           HD2      LYS 104  16.097   4.305  -2.657
  369    HD3  LYS 104           HD1      LYS 104  17.389   3.106  -2.741
  370    HE2  LYS 104           HE2      LYS 104  15.430   3.754  -4.940
  371    HE3  LYS 104           HE1      LYS 104  17.105   4.299  -4.863
  372    HZ1  LYS 104           HZ1      LYS 104  16.931   2.402  -6.295
  373    HZ2  LYS 104           HZ2      LYS 104  16.174   1.483  -5.088
  374    HZ3  LYS 104           HZ3      LYS 104  17.795   1.956  -4.905
  375    H    ARG 105           HN       ARG 105  14.519   2.221   1.662
  376    HA   ARG 105           HA       ARG 105  16.295   0.561   3.010
  377    HB2  ARG 105           HB2      ARG 105  13.947   2.073   4.176
  378    HB3  ARG 105           HB1      ARG 105  15.326   1.470   5.082
  379    HG2  ARG 105           HG2      ARG 105  15.404   3.575   2.929
  380    HG3  ARG 105           HG1      ARG 105  15.524   3.849   4.669
  381    HD2  ARG 105           HD2      ARG 105  17.470   2.349   2.924
  382    HD3  ARG 105           HD1      ARG 105  17.730   3.908   3.704
  383    HE   ARG 105           HE       ARG 105  17.115   2.029   5.686
  384   HH11  ARG 105          HH11      ARG 105  19.676   2.794   3.420
  385   HH12  ARG 105          HH12      ARG 105  20.916   2.023   4.369
  386   HH21  ARG 105          HH21      ARG 105  18.728   1.005   6.923
  387   HH22  ARG 105          HH22      ARG 105  20.381   1.025   6.380
  388    H    HIS 106           HN       HIS 106  12.792   0.371   2.727
  389    HA   HIS 106           HA       HIS 106  12.533  -1.992   4.309
  390    HB2  HIS 106           HB2      HIS 106  10.669  -0.411   4.058
  391    HB3  HIS 106           HB1      HIS 106  10.612  -0.734   2.330
  392    HD1  HIS 106           HD1      HIS 106   9.696  -2.269   5.650
  393    HD2  HIS 106           HD2      HIS 106   9.421  -3.046   1.586
  394    HE1  HIS 106           HE1      HIS 106   8.152  -4.258   5.418
  395    H    GLN 107           HN       GLN 107  13.581  -1.467   1.113
  396    HA   GLN 107           HA       GLN 107  12.655  -4.004   0.072
  397    HB2  GLN 107           HB2      GLN 107  14.645  -2.053  -1.131
  398    HB3  GLN 107           HB1      GLN 107  13.893  -3.410  -1.957
  399    HG2  GLN 107           HG2      GLN 107  11.969  -1.542  -0.875
  400    HG3  GLN 107           HG1      GLN 107  13.093  -0.800  -2.013
  401   HE21  GLN 107          HE21      GLN 107  10.516  -3.058  -1.618
  402   HE22  GLN 107          HE22      GLN 107  10.292  -3.396  -3.308
  403    H    LEU 108           HN       LEU 108  15.314  -2.468   1.535
  404    HA   LEU 108           HA       LEU 108  17.331  -4.371   0.843
  405    HB2  LEU 108           HB2      LEU 108  17.184  -2.006   2.661
  406    HB3  LEU 108           HB1      LEU 108  18.576  -3.069   2.679
  407    HG   LEU 108           HG       LEU 108  19.444  -2.201   0.790
  408   HD11  LEU 108          HD11      LEU 108  16.664  -1.717  -0.264
  409   HD12  LEU 108          HD12      LEU 108  17.674  -3.120  -0.617
  410   HD13  LEU 108          HD13      LEU 108  18.176  -1.518  -1.163
  411   HD21  LEU 108          HD21      LEU 108  17.440  -0.055   1.455
  412   HD22  LEU 108          HD22      LEU 108  18.919   0.163   0.512
  413   HD23  LEU 108          HD23      LEU 108  19.014  -0.280   2.218
  414    H    VAL 109           HN       VAL 109  15.041  -3.971   3.393
  415    HA   VAL 109           HA       VAL 109  16.408  -5.661   5.192
  416    HB   VAL 109           HB       VAL 109  14.370  -5.707   6.454
  417   HG11  VAL 109          HG11      VAL 109  13.851  -3.358   6.677
  418   HG12  VAL 109          HG12      VAL 109  14.523  -3.042   5.076
  419   HG13  VAL 109          HG13      VAL 109  15.583  -3.555   6.392
  420   HG21  VAL 109          HG21      VAL 109  13.081  -4.741   3.928
  421   HG22  VAL 109          HG22      VAL 109  12.266  -4.810   5.495
  422   HG23  VAL 109          HG23      VAL 109  12.827  -6.297   4.724
  423    H    HIS 110           HN       HIS 110  14.532  -6.119   2.363
  424    HA   HIS 110           HA       HIS 110  13.924  -8.903   2.944
  425    HB2  HIS 110           HB2      HIS 110  13.571  -7.155   0.533
  426    HB3  HIS 110           HB1      HIS 110  13.235  -8.866   0.480
  427    HD1  HIS 110           HD1      HIS 110  11.013  -9.646   1.556
  428    HD2  HIS 110           HD2      HIS 110  11.893  -5.629   2.020
  429    HE1  HIS 110           HE1      HIS 110   8.864  -8.521   2.282
  430    H    SER 111           HN       SER 111  16.607  -7.191   1.794
  431    HA   SER 111           HA       SER 111  17.951  -9.638   0.972
  432    HB2  SER 111           HB2      SER 111  17.710  -7.285  -0.926
  433    HB3  SER 111           HB1      SER 111  18.654  -8.746  -1.205
  434    HG   SER 111           HG       SER 111  16.216  -8.380  -1.937
  435    H    GLY 112           HN       GLY 112  18.324  -8.069   3.185
  436    HA2  GLY 112           HA2      GLY 112  20.859  -6.672   2.636
  437    HA3  GLY 112           HA1      GLY 112  19.584  -5.918   3.606
  Start of MODEL   14
    1    H    LYS  58           HT1      LYS  58 -16.117 -10.525  -5.946
    2    HA   LYS  58           HA       LYS  58 -16.139 -10.018  -3.587
    3    HB2  LYS  58           HB2      LYS  58 -14.355 -11.439  -4.506
    4    HB3  LYS  58           HB1      LYS  58 -13.387 -10.014  -4.856
    5    HG2  LYS  58           HG2      LYS  58 -13.401  -9.519  -2.397
    6    HG3  LYS  58           HG1      LYS  58 -14.157 -11.094  -2.159
    7    HD2  LYS  58           HD2      LYS  58 -11.504 -10.658  -3.520
    8    HD3  LYS  58           HD1      LYS  58 -11.704 -11.113  -1.827
    9    HE2  LYS  58           HE2      LYS  58 -12.869 -13.154  -2.530
   10    HE3  LYS  58           HE1      LYS  58 -12.626 -12.700  -4.218
   11    HZ1  LYS  58           HZ1      LYS  58 -10.246 -12.803  -3.875
   12    HZ2  LYS  58           HZ2      LYS  58 -10.964 -14.287  -3.463
   13    HZ3  LYS  58           HZ3      LYS  58 -10.471 -13.215  -2.243
   14    HA   PRO  59           HA       PRO  59 -15.269  -5.768  -2.471
   15    HB2  PRO  59           HB2      PRO  59 -15.187  -6.088   0.208
   16    HB3  PRO  59           HB1      PRO  59 -16.709  -6.083  -0.692
   17    HG2  PRO  59           HG2      PRO  59 -15.107  -8.401   0.301
   18    HG3  PRO  59           HG1      PRO  59 -16.861  -8.145   0.368
   19    HD2  PRO  59           HD2      PRO  59 -15.684  -9.691  -1.509
   20    HD3  PRO  59           HD1      PRO  59 -17.155  -8.764  -1.824
   21    H    TYR  60           HN       TYR  60 -13.644  -4.649  -1.398
   22    HA   TYR  60           HA       TYR  60 -11.094  -6.103  -1.205
   23    HB2  TYR  60           HB2      TYR  60 -11.609  -3.500  -2.661
   24    HB3  TYR  60           HB1      TYR  60 -10.002  -4.145  -2.324
   25    HD1  TYR  60           HD2      TYR  60  -9.704  -6.671  -3.096
   26    HD2  TYR  60           HD1      TYR  60 -12.486  -3.913  -4.740
   27    HE1  TYR  60           HE2      TYR  60  -9.776  -7.988  -5.158
   28    HE2  TYR  60           HE1      TYR  60 -12.570  -5.222  -6.809
   29    HH   TYR  60           HH       TYR  60 -11.067  -8.362  -7.067
   30    H    GLY  61           HN       GLY  61 -10.821  -5.996   0.939
   31    HA2  GLY  61           HA2      GLY  61 -11.545  -3.470   2.227
   32    HA3  GLY  61           HA1      GLY  61 -11.576  -5.038   3.005
   33    H    CYS  62           HN       CYS  62 -10.330  -2.484   3.605
   34    HA   CYS  62           HA       CYS  62  -7.507  -2.756   3.479
   35    HB2  CYS  62           HB2      CYS  62  -9.057  -0.676   3.967
   36    HB3  CYS  62           HB1      CYS  62  -8.923  -1.222   5.633
   37    H    GLU  63           HN       GLU  63  -6.785  -4.694   4.330
   38    HA   GLU  63           HA       GLU  63  -7.762  -5.840   6.746
   39    HB2  GLU  63           HB2      GLU  63  -5.200  -6.286   5.211
   40    HB3  GLU  63           HB1      GLU  63  -5.727  -7.271   6.565
   41    HG2  GLU  63           HG2      GLU  63  -7.690  -7.970   5.337
   42    HG3  GLU  63           HG1      GLU  63  -7.257  -6.908   3.999
   43    H    GLU  64           HN       GLU  64  -6.253  -3.098   6.321
   44    HA   GLU  64           HA       GLU  64  -4.351  -3.152   8.493
   45    HB2  GLU  64           HB2      GLU  64  -3.453  -1.811   6.919
   46    HB3  GLU  64           HB1      GLU  64  -5.007  -1.455   6.189
   47    HG2  GLU  64           HG2      GLU  64  -5.288   0.009   8.363
   48    HG3  GLU  64           HG1      GLU  64  -3.520  -0.015   8.305
   49    H    CYS  65           HN       CYS  65  -7.516  -1.680   7.729
   50    HA   CYS  65           HA       CYS  65  -7.662  -0.780  10.525
   51    HB2  CYS  65           HB2      CYS  65  -9.105   1.092   9.616
   52    HB3  CYS  65           HB1      CYS  65  -7.394   1.189   9.209
   53    H    GLY  66           HN       GLY  66  -9.079  -2.402   7.887
   54    HA2  GLY  66           HA2      GLY  66 -10.563  -4.133   8.152
   55    HA3  GLY  66           HA1      GLY  66 -11.095  -3.423   9.669
   56    H    LYS  67           HN       LYS  67 -10.871  -1.489   6.784
   57    HA   LYS  67           HA       LYS  67 -13.811  -1.517   6.548
   58    HB2  LYS  67           HB2      LYS  67 -12.011   0.644   6.721
   59    HB3  LYS  67           HB1      LYS  67 -12.541   0.593   5.045
   60    HG2  LYS  67           HG2      LYS  67 -14.054   2.021   6.090
   61    HG3  LYS  67           HG1      LYS  67 -14.914   0.483   5.978
   62    HD2  LYS  67           HD2      LYS  67 -15.252   1.441   8.170
   63    HD3  LYS  67           HD1      LYS  67 -14.259  -0.013   8.307
   64    HE2  LYS  67           HE2      LYS  67 -12.245   1.366   8.421
   65    HE3  LYS  67           HE1      LYS  67 -13.225   2.823   8.261
   66    HZ1  LYS  67           HZ1      LYS  67 -13.389   0.882  10.508
   67    HZ2  LYS  67           HZ2      LYS  67 -14.281   2.318  10.361
   68    HZ3  LYS  67           HZ3      LYS  67 -12.598   2.384  10.558
   69    H    SER  68           HN       SER  68 -14.635  -2.464   4.741
   70    HA   SER  68           HA       SER  68 -12.716  -3.100   2.612
   71    HB2  SER  68           HB2      SER  68 -15.457  -4.270   2.596
   72    HB3  SER  68           HB1      SER  68 -13.927  -4.966   2.067
   73    HG   SER  68           HG       SER  68 -14.599  -4.499   4.796
   74    H    TYR  69           HN       TYR  69 -13.109  -2.651   0.483
   75    HA   TYR  69           HA       TYR  69 -15.273  -0.700   0.031
   76    HB2  TYR  69           HB2      TYR  69 -12.425  -0.694  -0.876
   77    HB3  TYR  69           HB1      TYR  69 -13.643   0.120  -1.847
   78    HD1  TYR  69           HD2      TYR  69 -12.251  -0.082   1.585
   79    HD2  TYR  69           HD1      TYR  69 -14.335   2.257  -1.272
   80    HE1  TYR  69           HE2      TYR  69 -12.112   1.849   3.081
   81    HE2  TYR  69           HE1      TYR  69 -14.197   4.213   0.204
   82    HH   TYR  69           HH       TYR  69 -13.950   4.627   2.684
   83    H    ARG  70           HN       ARG  70 -16.036  -0.504  -2.164
   84    HA   ARG  70           HA       ARG  70 -16.837  -3.058  -3.137
   85    HB2  ARG  70           HB2      ARG  70 -18.246  -0.966  -3.103
   86    HB3  ARG  70           HB1      ARG  70 -17.264  -0.355  -4.423
   87    HG2  ARG  70           HG2      ARG  70 -19.128  -1.200  -5.497
   88    HG3  ARG  70           HG1      ARG  70 -17.961  -2.514  -5.648
   89    HD2  ARG  70           HD2      ARG  70 -20.085  -2.337  -3.515
   90    HD3  ARG  70           HD1      ARG  70 -20.242  -3.263  -5.005
   91    HE   ARG  70           HE       ARG  70 -18.050  -4.362  -4.052
   92   HH11  ARG  70          HH11      ARG  70 -20.961  -3.442  -2.316
   93   HH12  ARG  70          HH12      ARG  70 -20.789  -4.704  -1.127
   94   HH21  ARG  70          HH21      ARG  70 -17.829  -5.989  -2.474
   95   HH22  ARG  70          HH22      ARG  70 -18.988  -6.111  -1.180
   96    H    LEU  71           HN       LEU  71 -14.564  -0.586  -4.221
   97    HA   LEU  71           HA       LEU  71 -13.881  -2.315  -6.507
   98    HB2  LEU  71           HB2      LEU  71 -13.455   0.662  -6.479
   99    HB3  LEU  71           HB1      LEU  71 -13.422  -0.434  -7.854
  100    HG   LEU  71           HG       LEU  71 -15.862   0.347  -6.290
  101   HD11  LEU  71          HD11      LEU  71 -15.037   2.195  -7.605
  102   HD12  LEU  71          HD12      LEU  71 -16.505   1.547  -8.339
  103   HD13  LEU  71          HD13      LEU  71 -14.930   1.163  -9.031
  104   HD21  LEU  71          HD21      LEU  71 -16.065  -1.892  -7.162
  105   HD22  LEU  71          HD22      LEU  71 -15.587  -1.334  -8.765
  106   HD23  LEU  71          HD23      LEU  71 -17.108  -0.788  -8.057
  107    H    ILE  72           HN       ILE  72 -11.681  -1.943  -7.329
  108    HA   ILE  72           HA       ILE  72  -9.731  -2.104  -5.256
  109    HB   ILE  72           HB       ILE  72  -9.534  -1.970  -8.256
  110   HG12  ILE  72          HG12      ILE  72 -10.223  -4.060  -7.042
  111   HG13  ILE  72          HG11      ILE  72  -8.787  -4.243  -8.048
  112   HG21  ILE  72          HG21      ILE  72  -7.120  -2.281  -8.079
  113   HG22  ILE  72          HG22      ILE  72  -7.219  -2.077  -6.331
  114   HG23  ILE  72          HG23      ILE  72  -7.617  -0.731  -7.399
  115   HD11  ILE  72          HD11      ILE  72  -8.578  -5.361  -5.875
  116   HD12  ILE  72          HD12      ILE  72  -8.781  -3.803  -5.071
  117   HD13  ILE  72          HD13      ILE  72  -7.373  -4.090  -6.094
  118    H    SER  73           HN       SER  73 -10.334   0.328  -7.792
  119    HA   SER  73           HA       SER  73  -8.449   2.187  -6.905
  120    HB2  SER  73           HB2      SER  73 -11.059   2.866  -8.271
  121    HB3  SER  73           HB1      SER  73  -9.533   3.747  -8.367
  122    HG   SER  73           HG       SER  73 -10.290   2.046 -10.087
  123    H    LEU  74           HN       LEU  74 -11.705   1.550  -5.890
  124    HA   LEU  74           HA       LEU  74 -12.197   3.741  -4.282
  125    HB2  LEU  74           HB2      LEU  74 -13.221   1.068  -4.698
  126    HB3  LEU  74           HB1      LEU  74 -13.290   1.514  -2.994
  127    HG   LEU  74           HG       LEU  74 -14.517   3.035  -5.286
  128   HD11  LEU  74          HD11      LEU  74 -16.629   2.466  -4.169
  129   HD12  LEU  74          HD12      LEU  74 -15.741   1.490  -2.998
  130   HD13  LEU  74          HD13      LEU  74 -15.762   1.023  -4.702
  131   HD21  LEU  74          HD21      LEU  74 -13.734   4.607  -3.786
  132   HD22  LEU  74          HD22      LEU  74 -14.091   3.595  -2.393
  133   HD23  LEU  74          HD23      LEU  74 -15.413   4.364  -3.289
  134    H    LEU  75           HN       LEU  75 -10.844   0.635  -3.381
  135    HA   LEU  75           HA       LEU  75 -10.295   1.431  -0.710
  136    HB2  LEU  75           HB2      LEU  75 -10.651  -0.854  -1.030
  137    HB3  LEU  75           HB1      LEU  75  -9.608  -0.909  -2.449
  138    HG   LEU  75           HG       LEU  75  -7.719  -0.336  -0.765
  139   HD11  LEU  75          HD11      LEU  75  -9.186   0.125   1.132
  140   HD12  LEU  75          HD12      LEU  75  -8.082  -1.210   1.466
  141   HD13  LEU  75          HD13      LEU  75  -9.772  -1.539   1.081
  142   HD21  LEU  75          HD21      LEU  75  -9.081  -3.004  -0.916
  143   HD22  LEU  75          HD22      LEU  75  -7.401  -2.731  -0.401
  144   HD23  LEU  75          HD23      LEU  75  -7.901  -2.341  -2.057
  145    H    ASN  76           HN       ASN  76  -8.749   1.571  -3.748
  146    HA   ASN  76           HA       ASN  76  -6.062   1.844  -2.885
  147    HB2  ASN  76           HB2      ASN  76  -7.282   1.602  -5.317
  148    HB3  ASN  76           HB1      ASN  76  -6.840   3.312  -5.323
  149   HD21  ASN  76          HD21      ASN  76  -5.693   0.045  -5.193
  150   HD22  ASN  76          HD22      ASN  76  -4.033   0.384  -5.559
  151    H    LEU  77           HN       LEU  77  -8.715   4.063  -3.494
  152    HA   LEU  77           HA       LEU  77  -7.150   6.374  -2.885
  153    HB2  LEU  77           HB2      LEU  77  -9.927   5.759  -3.689
  154    HB3  LEU  77           HB1      LEU  77  -9.675   7.248  -2.811
  155    HG   LEU  77           HG       LEU  77  -9.658   7.397  -5.335
  156   HD11  LEU  77          HD11      LEU  77  -7.267   8.338  -3.781
  157   HD12  LEU  77          HD12      LEU  77  -8.825   9.149  -3.904
  158   HD13  LEU  77          HD13      LEU  77  -7.798   8.995  -5.330
  159   HD21  LEU  77          HD21      LEU  77  -8.349   5.416  -5.833
  160   HD22  LEU  77          HD22      LEU  77  -6.967   6.095  -4.972
  161   HD23  LEU  77          HD23      LEU  77  -7.546   6.860  -6.451
  162    H    HIS  78           HN       HIS  78  -9.030   4.086  -1.168
  163    HA   HIS  78           HA       HIS  78  -9.257   5.572   1.261
  164    HB2  HIS  78           HB2      HIS  78 -10.692   3.672   1.004
  165    HB3  HIS  78           HB1      HIS  78  -9.327   2.609   0.644
  166    HD1  HIS  78           HD1      HIS  78 -11.201   4.153   3.500
  167    HD2  HIS  78           HD2      HIS  78  -7.910   1.691   2.857
  168    HE1  HIS  78           HE1      HIS  78 -10.572   3.197   5.756
  169    H    LYS  79           HN       LYS  79  -6.919   3.341  -0.117
  170    HA   LYS  79           HA       LYS  79  -5.179   3.279   2.144
  171    HB2  LYS  79           HB2      LYS  79  -5.250   1.535   0.365
  172    HB3  LYS  79           HB1      LYS  79  -4.586   2.700  -0.771
  173    HG2  LYS  79           HG2      LYS  79  -2.833   1.256  -0.032
  174    HG3  LYS  79           HG1      LYS  79  -2.565   2.861   0.648
  175    HD2  LYS  79           HD2      LYS  79  -2.152   1.098   2.297
  176    HD3  LYS  79           HD1      LYS  79  -3.492   2.140   2.776
  177    HE2  LYS  79           HE2      LYS  79  -5.097   0.486   2.074
  178    HE3  LYS  79           HE1      LYS  79  -3.821  -0.532   1.407
  179    HZ1  LYS  79           HZ1      LYS  79  -2.976  -0.948   3.579
  180    HZ2  LYS  79           HZ2      LYS  79  -4.646  -1.227   3.631
  181    HZ3  LYS  79           HZ3      LYS  79  -4.002   0.203   4.284
  182    H    LYS  80           HN       LYS  80  -5.336   5.057  -0.865
  183    HA   LYS  80           HA       LYS  80  -3.106   6.729  -0.490
  184    HB2  LYS  80           HB2      LYS  80  -4.126   6.429  -2.663
  185    HB3  LYS  80           HB1      LYS  80  -5.655   7.069  -2.082
  186    HG2  LYS  80           HG2      LYS  80  -4.832   9.255  -2.018
  187    HG3  LYS  80           HG1      LYS  80  -3.159   8.726  -2.116
  188    HD2  LYS  80           HD2      LYS  80  -5.149   8.243  -4.315
  189    HD3  LYS  80           HD1      LYS  80  -4.172   9.712  -4.226
  190    HE2  LYS  80           HE2      LYS  80  -2.166   8.209  -4.085
  191    HE3  LYS  80           HE1      LYS  80  -3.239   6.876  -4.494
  192    HZ1  LYS  80           HZ1      LYS  80  -2.083   7.781  -6.442
  193    HZ2  LYS  80           HZ2      LYS  80  -2.812   9.289  -6.171
  194    HZ3  LYS  80           HZ3      LYS  80  -3.768   7.944  -6.575
  195    H    ARG  81           HN       ARG  81  -6.280   6.727   0.879
  196    HA   ARG  81           HA       ARG  81  -6.338   9.478   1.669
  197    HB2  ARG  81           HB2      ARG  81  -8.341   8.027   1.372
  198    HB3  ARG  81           HB1      ARG  81  -7.874   7.158   2.823
  199    HG2  ARG  81           HG2      ARG  81  -8.171   9.134   4.160
  200    HG3  ARG  81           HG1      ARG  81  -8.510  10.095   2.714
  201    HD2  ARG  81           HD2      ARG  81 -10.422   8.595   2.248
  202    HD3  ARG  81           HD1      ARG  81 -10.135   7.803   3.794
  203    HE   ARG  81           HE       ARG  81 -10.653  10.695   3.730
  204   HH11  ARG  81          HH11      ARG  81 -11.622   7.472   4.673
  205   HH12  ARG  81          HH12      ARG  81 -12.972   8.003   5.619
  206   HH21  ARG  81          HH21      ARG  81 -12.430  11.415   4.978
  207   HH22  ARG  81          HH22      ARG  81 -13.427  10.253   5.808
  208    H    HIS  82           HN       HIS  82  -4.922   6.611   2.978
  209    HA   HIS  82           HA       HIS  82  -4.815   7.583   5.691
  210    HB2  HIS  82           HB2      HIS  82  -3.826   5.109   4.324
  211    HB3  HIS  82           HB1      HIS  82  -3.276   5.507   5.933
  212    HD1  HIS  82           HD1      HIS  82  -5.089   5.426   7.835
  213    HD2  HIS  82           HD2      HIS  82  -6.292   4.073   4.105
  214    HE1  HIS  82           HE1      HIS  82  -7.206   4.116   8.206
  215    H    SER  83           HN       SER  83  -2.404   6.987   3.130
  216    HA   SER  83           HA       SER  83  -0.392   8.234   4.870
  217    HB2  SER  83           HB2      SER  83   0.019   5.900   4.076
  218    HB3  SER  83           HB1      SER  83   0.064   6.512   2.423
  219    HG   SER  83           HG       SER  83   1.796   7.937   3.224
  220    H    GLY  84           HN       GLY  84  -2.287   9.790   3.306
  221    HA2  GLY  84           HA2      GLY  84  -2.100  11.832   2.204
  222    HA3  GLY  84           HA1      GLY  84  -0.390  11.506   1.948
  223    H    GLU  85           HN       GLU  85  -0.201   9.332   0.549
  224    HA   GLU  85           HA       GLU  85  -2.268   8.857  -1.321
  225    HB2  GLU  85           HB2      GLU  85  -1.397   9.681  -3.306
  226    HB3  GLU  85           HB1      GLU  85  -1.110  10.991  -2.187
  227    HG2  GLU  85           HG2      GLU  85   1.206  10.354  -1.990
  228    HG3  GLU  85           HG1      GLU  85   0.907   8.959  -3.023
  229    H    ALA  86           HN       ALA  86  -1.949   6.968  -2.432
  230    HA   ALA  86           HA       ALA  86   0.202   5.309  -1.416
  231    HB1  ALA  86           HB1      ALA  86  -1.053   3.457  -2.478
  232    HB2  ALA  86           HB2      ALA  86  -2.220   4.632  -3.096
  233    HB3  ALA  86           HB3      ALA  86  -2.043   4.391  -1.357
  234    H    ARG  87           HN       ARG  87   2.001   5.756  -2.419
  235    HA   ARG  87           HA       ARG  87   2.153   6.171  -5.244
  236    HB2  ARG  87           HB2      ARG  87   4.126   6.277  -3.003
  237    HB3  ARG  87           HB1      ARG  87   4.554   6.577  -4.695
  238    HG2  ARG  87           HG2      ARG  87   3.142   8.360  -4.819
  239    HG3  ARG  87           HG1      ARG  87   2.323   7.954  -3.327
  240    HD2  ARG  87           HD2      ARG  87   4.223   8.477  -2.062
  241    HD3  ARG  87           HD1      ARG  87   5.200   8.765  -3.508
  242    HE   ARG  87           HE       ARG  87   2.963  10.457  -3.575
  243   HH11  ARG  87          HH11      ARG  87   5.961  10.105  -1.803
  244   HH12  ARG  87          HH12      ARG  87   6.024  11.779  -1.338
  245   HH21  ARG  87          HH21      ARG  87   3.038  12.622  -3.010
  246   HH22  ARG  87          HH22      ARG  87   4.365  13.231  -2.054
  247    H    TYR  88           HN       TYR  88   4.691   4.724  -3.633
  248    HA   TYR  88           HA       TYR  88   4.906   2.570  -5.547
  249    HB2  TYR  88           HB2      TYR  88   6.594   3.132  -3.109
  250    HB3  TYR  88           HB1      TYR  88   7.013   2.111  -4.471
  251    HD1  TYR  88           HD1      TYR  88   6.490   5.605  -3.404
  252    HD2  TYR  88           HD2      TYR  88   8.009   3.024  -6.415
  253    HE1  TYR  88           HE1      TYR  88   7.578   7.521  -4.490
  254    HE2  TYR  88           HE2      TYR  88   9.103   4.924  -7.513
  255    HH   TYR  88           HH       TYR  88   8.813   7.405  -7.632
  256    H    ARG  89           HN       ARG  89   4.805   0.343  -5.016
  257    HA   ARG  89           HA       ARG  89   4.234  -0.195  -2.184
  258    HB2  ARG  89           HB2      ARG  89   2.888  -2.059  -2.717
  259    HB3  ARG  89           HB1      ARG  89   2.311  -0.736  -3.711
  260    HG2  ARG  89           HG2      ARG  89   3.517  -1.658  -5.630
  261    HG3  ARG  89           HG1      ARG  89   4.068  -2.998  -4.614
  262    HD2  ARG  89           HD2      ARG  89   1.688  -3.518  -4.133
  263    HD3  ARG  89           HD1      ARG  89   1.236  -2.287  -5.311
  264    HE   ARG  89           HE       ARG  89   2.950  -4.035  -6.621
  265   HH11  ARG  89          HH11      ARG  89  -0.157  -4.211  -5.008
  266   HH12  ARG  89          HH12      ARG  89  -0.770  -5.467  -6.045
  267   HH21  ARG  89          HH21      ARG  89   2.161  -5.690  -7.977
  268   HH22  ARG  89          HH22      ARG  89   0.569  -6.349  -7.706
  269    H    CYS  90           HN       CYS  90   5.208  -1.966  -1.311
  270    HA   CYS  90           HA       CYS  90   7.736  -2.791  -2.182
  271    HB2  CYS  90           HB2      CYS  90   6.821  -3.096   0.115
  272    HB3  CYS  90           HB1      CYS  90   5.735  -4.308  -0.503
  273    H    GLU  91           HN       GLU  91   8.188  -3.957  -3.962
  274    HA   GLU  91           HA       GLU  91   6.053  -5.194  -5.407
  275    HB2  GLU  91           HB2      GLU  91   7.854  -5.791  -7.044
  276    HB3  GLU  91           HB1      GLU  91   7.656  -4.066  -6.734
  277    HG2  GLU  91           HG2      GLU  91   9.506  -4.277  -5.098
  278    HG3  GLU  91           HG1      GLU  91   9.774  -5.906  -5.699
  279    H    ASP  92           HN       ASP  92   7.220  -6.190  -2.744
  280    HA   ASP  92           HA       ASP  92   7.314  -8.989  -3.618
  281    HB2  ASP  92           HB2      ASP  92   9.417  -7.933  -2.491
  282    HB3  ASP  92           HB1      ASP  92   8.501  -8.152  -1.001
  283    H    CYS  93           HN       CYS  93   6.034  -6.700  -1.131
  284    HA   CYS  93           HA       CYS  93   4.161  -8.862  -0.505
  285    HB2  CYS  93           HB2      CYS  93   4.212  -8.395   1.805
  286    HB3  CYS  93           HB1      CYS  93   5.882  -8.547   1.288
  287    H    GLY  94           HN       GLY  94   4.637  -5.539  -1.206
  288    HA2  GLY  94           HA2      GLY  94   3.060  -4.349  -2.404
  289    HA3  GLY  94           HA1      GLY  94   1.787  -5.367  -1.745
  290    H    LYS  95           HN       LYS  95   4.201  -3.708   0.202
  291    HA   LYS  95           HA       LYS  95   2.146  -2.174   1.535
  292    HB2  LYS  95           HB2      LYS  95   5.129  -2.218   1.935
  293    HB3  LYS  95           HB1      LYS  95   3.957  -1.432   2.992
  294    HG2  LYS  95           HG2      LYS  95   2.915  -3.737   3.200
  295    HG3  LYS  95           HG1      LYS  95   4.421  -4.342   2.515
  296    HD2  LYS  95           HD2      LYS  95   5.683  -3.631   4.302
  297    HD3  LYS  95           HD1      LYS  95   4.477  -2.450   4.824
  298    HE2  LYS  95           HE2      LYS  95   2.997  -4.255   5.514
  299    HE3  LYS  95           HE1      LYS  95   4.176  -5.447   4.971
  300    HZ1  LYS  95           HZ1      LYS  95   5.675  -4.814   6.665
  301    HZ2  LYS  95           HZ2      LYS  95   4.163  -4.951   7.424
  302    HZ3  LYS  95           HZ3      LYS  95   4.790  -3.419   7.049
  303    H    LEU  96           HN       LEU  96   1.802   0.004   1.256
  304    HA   LEU  96           HA       LEU  96   3.082   1.186  -1.072
  305    HB2  LEU  96           HB2      LEU  96   0.753   2.098   0.606
  306    HB3  LEU  96           HB1      LEU  96   1.391   3.018  -0.752
  307    HG   LEU  96           HG       LEU  96  -0.573   1.849  -1.474
  308   HD11  LEU  96          HD11      LEU  96   1.181   1.965  -3.118
  309   HD12  LEU  96          HD12      LEU  96   0.345   0.416  -3.262
  310   HD13  LEU  96          HD13      LEU  96   1.922   0.497  -2.474
  311   HD21  LEU  96          HD21      LEU  96  -0.730  -0.601  -1.390
  312   HD22  LEU  96          HD22      LEU  96  -0.672   0.126   0.217
  313   HD23  LEU  96          HD23      LEU  96   0.769  -0.642  -0.457
  314    H    PHE  97           HN       PHE  97   4.705   2.482  -0.954
  315    HA   PHE  97           HA       PHE  97   5.056   4.084   1.501
  316    HB2  PHE  97           HB2      PHE  97   7.275   3.133  -0.339
  317    HB3  PHE  97           HB1      PHE  97   7.460   4.134   1.086
  318    HD1  PHE  97           HD2      PHE  97   6.661   0.751  -0.095
  319    HD2  PHE  97           HD1      PHE  97   7.376   3.233   3.290
  320    HE1  PHE  97           HE2      PHE  97   6.840  -1.246   1.337
  321    HE2  PHE  97           HE1      PHE  97   7.562   1.236   4.720
  322    HZ   PHE  97           HZ       PHE  97   7.297  -1.007   3.732
  323    H    THR  98           HN       THR  98   5.524   6.186   1.312
  324    HA   THR  98           HA       THR  98   4.870   7.402  -1.231
  325    HB   THR  98           HB       THR  98   4.841   9.500   0.126
  326    HG1  THR  98           HG1      THR  98   5.905   9.375   1.978
  327   HG21  THR  98          HG21      THR  98   2.802   8.254  -0.177
  328   HG22  THR  98          HG22      THR  98   2.872   8.779   1.511
  329   HG23  THR  98          HG23      THR  98   3.276   7.109   1.082
  330    H    THR  99           HN       THR  99   7.579   6.476   0.515
  331    HA   THR  99           HA       THR  99   9.287   8.159  -1.180
  332    HB   THR  99           HB       THR  99   9.791   7.044   1.587
  333    HG1  THR  99           HG1      THR  99   8.586   9.092   1.305
  334   HG21  THR  99          HG21      THR  99  11.708   8.637  -0.094
  335   HG22  THR  99          HG22      THR  99  11.740   6.882   0.041
  336   HG23  THR  99          HG23      THR  99  12.007   7.876   1.471
  337    H    SER 100           HN       SER 100  10.513   7.042  -2.586
  338    HA   SER 100           HA       SER 100  10.178   4.226  -2.797
  339    HB2  SER 100           HB2      SER 100  11.816   4.478  -4.724
  340    HB3  SER 100           HB1      SER 100  10.333   5.433  -4.843
  341    HG   SER 100           HG       SER 100  12.223   6.639  -5.364
  342    H    GLY 101           HN       GLY 101  12.583   6.315  -1.401
  343    HA2  GLY 101           HA2      GLY 101  14.580   4.305  -1.100
  344    HA3  GLY 101           HA1      GLY 101  14.483   5.810  -0.201
  345    H    ASN 102           HN       ASN 102  11.988   5.471   1.102
  346    HA   ASN 102           HA       ASN 102  12.619   3.669   3.192
  347    HB2  ASN 102           HB2      ASN 102  10.061   5.018   2.369
  348    HB3  ASN 102           HB1      ASN 102  10.075   3.811   3.643
  349   HD21  ASN 102          HD21      ASN 102  10.892   7.050   2.800
  350   HD22  ASN 102          HD22      ASN 102  11.411   7.556   4.372
  351    H    LEU 103           HN       LEU 103  10.869   3.496   0.208
  352    HA   LEU 103           HA       LEU 103   9.610   1.047   0.655
  353    HB2  LEU 103           HB2      LEU 103   8.741   2.350  -1.051
  354    HB3  LEU 103           HB1      LEU 103  10.334   2.722  -1.702
  355    HG   LEU 103           HG       LEU 103  10.463   0.271  -2.354
  356   HD11  LEU 103          HD11      LEU 103   8.417  -0.927  -2.563
  357   HD12  LEU 103          HD12      LEU 103   7.487   0.470  -1.977
  358   HD13  LEU 103          HD13      LEU 103   8.584  -0.398  -0.886
  359   HD21  LEU 103          HD21      LEU 103   8.998   0.738  -4.349
  360   HD22  LEU 103          HD22      LEU 103  10.245   1.935  -3.988
  361   HD23  LEU 103          HD23      LEU 103   8.571   2.249  -3.543
  362    H    LYS 104           HN       LYS 104  12.489   2.011  -1.084
  363    HA   LYS 104           HA       LYS 104  13.285  -0.454  -2.058
  364    HB2  LYS 104           HB2      LYS 104  15.086   0.700  -2.889
  365    HB3  LYS 104           HB1      LYS 104  13.983   2.021  -2.534
  366    HG2  LYS 104           HG2      LYS 104  15.123   2.336  -0.386
  367    HG3  LYS 104           HG1      LYS 104  16.311   1.125  -0.876
  368    HD2  LYS 104           HD2      LYS 104  16.931   2.498  -2.802
  369    HD3  LYS 104           HD1      LYS 104  15.710   3.690  -2.354
  370    HE2  LYS 104           HE2      LYS 104  16.902   3.963  -0.174
  371    HE3  LYS 104           HE1      LYS 104  18.186   2.939  -0.812
  372    HZ1  LYS 104           HZ1      LYS 104  18.764   5.233  -1.116
  373    HZ2  LYS 104           HZ2      LYS 104  17.296   5.556  -1.898
  374    HZ3  LYS 104           HZ3      LYS 104  18.445   4.558  -2.642
  375    H    ARG 105           HN       ARG 105  14.240   1.158   0.978
  376    HA   ARG 105           HA       ARG 105  16.036  -0.847   1.807
  377    HB2  ARG 105           HB2      ARG 105  14.289   0.897   3.558
  378    HB3  ARG 105           HB1      ARG 105  15.788   0.102   4.028
  379    HG2  ARG 105           HG2      ARG 105  16.961   1.457   2.316
  380    HG3  ARG 105           HG1      ARG 105  15.458   2.335   2.044
  381    HD2  ARG 105           HD2      ARG 105  16.885   2.145   4.692
  382    HD3  ARG 105           HD1      ARG 105  17.007   3.504   3.577
  383    HE   ARG 105           HE       ARG 105  14.557   3.780   3.918
  384   HH11  ARG 105          HH11      ARG 105  16.554   2.228   6.342
  385   HH12  ARG 105          HH12      ARG 105  15.457   2.572   7.651
  386   HH21  ARG 105          HH21      ARG 105  13.114   4.244   5.646
  387   HH22  ARG 105          HH22      ARG 105  13.492   3.684   7.248
  388    H    HIS 106           HN       HIS 106  12.601  -0.463   2.052
  389    HA   HIS 106           HA       HIS 106  12.105  -2.763   3.673
  390    HB2  HIS 106           HB2      HIS 106  10.520  -0.907   3.586
  391    HB3  HIS 106           HB1      HIS 106  10.276  -1.169   1.863
  392    HD1  HIS 106           HD1      HIS 106   9.314  -2.531   5.218
  393    HD2  HIS 106           HD2      HIS 106   8.675  -3.270   1.193
  394    HE1  HIS 106           HE1      HIS 106   7.412  -4.191   5.102
  395    H    GLN 107           HN       GLN 107  12.810  -2.342   0.347
  396    HA   GLN 107           HA       GLN 107  11.545  -4.784  -0.511
  397    HB2  GLN 107           HB2      GLN 107  13.540  -3.018  -1.955
  398    HB3  GLN 107           HB1      GLN 107  12.514  -4.241  -2.687
  399    HG2  GLN 107           HG2      GLN 107  11.192  -2.059  -1.237
  400    HG3  GLN 107           HG1      GLN 107  11.998  -1.664  -2.753
  401   HE21  GLN 107          HE21      GLN 107  10.216  -1.241  -3.866
  402   HE22  GLN 107          HE22      GLN 107   9.047  -2.433  -4.348
  403    H    LEU 108           HN       LEU 108  14.467  -3.538   0.662
  404    HA   LEU 108           HA       LEU 108  16.201  -5.655  -0.217
  405    HB2  LEU 108           HB2      LEU 108  16.484  -3.204   1.446
  406    HB3  LEU 108           HB1      LEU 108  17.750  -4.414   1.431
  407    HG   LEU 108           HG       LEU 108  18.531  -3.784  -0.585
  408   HD11  LEU 108          HD11      LEU 108  15.715  -3.116  -1.430
  409   HD12  LEU 108          HD12      LEU 108  16.592  -4.601  -1.798
  410   HD13  LEU 108          HD13      LEU 108  17.142  -3.065  -2.469
  411   HD21  LEU 108          HD21      LEU 108  18.438  -1.730   0.710
  412   HD22  LEU 108          HD22      LEU 108  16.827  -1.389   0.067
  413   HD23  LEU 108          HD23      LEU 108  18.228  -1.401  -1.011
  414    H    VAL 109           HN       VAL 109  14.160  -5.092   2.443
  415    HA   VAL 109           HA       VAL 109  15.586  -6.882   4.146
  416    HB   VAL 109           HB       VAL 109  13.695  -6.709   5.627
  417   HG11  VAL 109          HG11      VAL 109  14.134  -4.059   4.283
  418   HG12  VAL 109          HG12      VAL 109  15.196  -4.769   5.502
  419   HG13  VAL 109          HG13      VAL 109  13.548  -4.307   5.930
  420   HG21  VAL 109          HG21      VAL 109  12.293  -5.417   3.315
  421   HG22  VAL 109          HG22      VAL 109  11.642  -5.546   4.954
  422   HG23  VAL 109          HG23      VAL 109  11.936  -7.003   4.000
  423    H    HIS 110           HN       HIS 110  13.372  -7.045   1.549
  424    HA   HIS 110           HA       HIS 110  12.574  -9.793   2.097
  425    HB2  HIS 110           HB2      HIS 110  12.047  -7.861  -0.136
  426    HB3  HIS 110           HB1      HIS 110  11.596  -9.540  -0.267
  427    HD1  HIS 110           HD1      HIS 110   9.376 -10.183   0.750
  428    HD2  HIS 110           HD2      HIS 110  10.760  -6.466   1.905
  429    HE1  HIS 110           HE1      HIS 110   7.458  -9.047   1.929
  430    H    SER 111           HN       SER 111  15.228  -8.244   0.775
  431    HA   SER 111           HA       SER 111  16.309 -10.719  -0.271
  432    HB2  SER 111           HB2      SER 111  16.958  -9.529  -2.442
  433    HB3  SER 111           HB1      SER 111  15.261  -9.982  -2.279
  434    HG   SER 111           HG       SER 111  14.789  -7.846  -1.711
  435    H    GLY 112           HN       GLY 112  17.083  -9.483   1.953
  436    HA2  GLY 112           HA2      GLY 112  19.672  -8.301   1.275
  437    HA3  GLY 112           HA1      GLY 112  18.563  -7.380   2.295
  Start of MODEL   15
    1    H    LYS  58           HT1      LYS  58 -18.432  -7.355  -3.445
    2    HA   LYS  58           HA       LYS  58 -16.717  -9.016  -3.683
    3    HB2  LYS  58           HB2      LYS  58 -16.257  -8.603  -6.070
    4    HB3  LYS  58           HB1      LYS  58 -15.555  -7.043  -5.668
    5    HG2  LYS  58           HG2      LYS  58 -13.806  -8.622  -6.084
    6    HG3  LYS  58           HG1      LYS  58 -13.806  -8.201  -4.372
    7    HD2  LYS  58           HD2      LYS  58 -14.975 -10.272  -3.851
    8    HD3  LYS  58           HD1      LYS  58 -15.033 -10.686  -5.566
    9    HE2  LYS  58           HE2      LYS  58 -12.527 -10.318  -3.928
   10    HE3  LYS  58           HE1      LYS  58 -13.227 -11.867  -4.396
   11    HZ1  LYS  58           HZ1      LYS  58 -12.888 -11.266  -6.723
   12    HZ2  LYS  58           HZ2      LYS  58 -11.422 -11.254  -5.869
   13    HZ3  LYS  58           HZ3      LYS  58 -12.184  -9.794  -6.258
   14    HA   PRO  59           HA       PRO  59 -15.202  -6.256  -0.527
   15    HB2  PRO  59           HB2      PRO  59 -14.426  -8.133   1.211
   16    HB3  PRO  59           HB1      PRO  59 -16.137  -7.807   0.909
   17    HG2  PRO  59           HG2      PRO  59 -14.413 -10.000  -0.157
   18    HG3  PRO  59           HG1      PRO  59 -16.083 -10.078   0.435
   19    HD2  PRO  59           HD2      PRO  59 -15.387  -9.941  -2.225
   20    HD3  PRO  59           HD1      PRO  59 -16.937  -9.400  -1.568
   21    H    TYR  60           HN       TYR  60 -13.424  -5.246  -0.916
   22    HA   TYR  60           HA       TYR  60 -10.872  -6.721  -0.781
   23    HB2  TYR  60           HB2      TYR  60 -11.469  -4.186  -2.334
   24    HB3  TYR  60           HB1      TYR  60  -9.855  -4.850  -2.086
   25    HD1  TYR  60           HD2      TYR  60  -9.842  -7.523  -2.644
   26    HD2  TYR  60           HD1      TYR  60 -12.291  -4.550  -4.446
   27    HE1  TYR  60           HE2      TYR  60 -10.062  -8.926  -4.636
   28    HE2  TYR  60           HE1      TYR  60 -12.520  -5.950  -6.444
   29    HH   TYR  60           HH       TYR  60 -11.302  -7.782  -7.579
   30    H    GLY  61           HN       GLY  61 -10.282  -6.437   1.296
   31    HA2  GLY  61           HA2      GLY  61 -10.791  -3.781   2.447
   32    HA3  GLY  61           HA1      GLY  61 -10.898  -5.275   3.366
   33    H    CYS  62           HN       CYS  62  -9.375  -2.805   3.643
   34    HA   CYS  62           HA       CYS  62  -6.634  -3.168   3.241
   35    HB2  CYS  62           HB2      CYS  62  -7.827  -1.049   3.918
   36    HB3  CYS  62           HB1      CYS  62  -7.964  -1.719   5.538
   37    H    GLU  63           HN       GLU  63  -5.254  -4.569   4.153
   38    HA   GLU  63           HA       GLU  63  -6.115  -6.351   6.233
   39    HB2  GLU  63           HB2      GLU  63  -4.576  -6.950   4.327
   40    HB3  GLU  63           HB1      GLU  63  -3.330  -5.994   5.111
   41    HG2  GLU  63           HG2      GLU  63  -2.971  -8.297   5.629
   42    HG3  GLU  63           HG1      GLU  63  -3.508  -7.468   7.090
   43    H    GLU  64           HN       GLU  64  -4.890  -3.265   6.217
   44    HA   GLU  64           HA       GLU  64  -3.193  -3.547   8.536
   45    HB2  GLU  64           HB2      GLU  64  -2.062  -2.123   7.238
   46    HB3  GLU  64           HB1      GLU  64  -3.474  -1.730   6.280
   47    HG2  GLU  64           HG2      GLU  64  -3.617  -0.571   8.895
   48    HG3  GLU  64           HG1      GLU  64  -2.151  -0.084   8.045
   49    H    CYS  65           HN       CYS  65  -6.240  -1.980   7.626
   50    HA   CYS  65           HA       CYS  65  -6.607  -1.232  10.450
   51    HB2  CYS  65           HB2      CYS  65  -8.082   0.600   9.585
   52    HB3  CYS  65           HB1      CYS  65  -6.393   0.770   9.114
   53    H    GLY  66           HN       GLY  66  -7.863  -2.683   7.602
   54    HA2  GLY  66           HA2      GLY  66  -9.248  -4.516   7.617
   55    HA3  GLY  66           HA1      GLY  66  -9.796  -4.069   9.227
   56    H    LYS  67           HN       LYS  67  -9.755  -1.587   6.841
   57    HA   LYS  67           HA       LYS  67 -12.665  -1.544   6.778
   58    HB2  LYS  67           HB2      LYS  67 -10.624   0.353   5.587
   59    HB3  LYS  67           HB1      LYS  67 -12.364   0.594   5.543
   60    HG2  LYS  67           HG2      LYS  67 -10.718   0.409   8.057
   61    HG3  LYS  67           HG1      LYS  67 -11.238   1.914   7.295
   62    HD2  LYS  67           HD2      LYS  67 -13.578   1.254   7.604
   63    HD3  LYS  67           HD1      LYS  67 -13.053  -0.244   8.373
   64    HE2  LYS  67           HE2      LYS  67 -11.993   1.015  10.160
   65    HE3  LYS  67           HE1      LYS  67 -12.429   2.532   9.374
   66    HZ1  LYS  67           HZ1      LYS  67 -14.304   0.525  10.503
   67    HZ2  LYS  67           HZ2      LYS  67 -14.777   1.911   9.649
   68    HZ3  LYS  67           HZ3      LYS  67 -13.968   2.064  11.133
   69    H    SER  68           HN       SER  68 -13.815  -2.457   5.185
   70    HA   SER  68           HA       SER  68 -12.390  -3.514   2.886
   71    HB2  SER  68           HB2      SER  68 -15.026  -4.297   2.631
   72    HB3  SER  68           HB1      SER  68 -13.726  -5.245   3.367
   73    HG   SER  68           HG       SER  68 -14.435  -4.731   5.337
   74    H    TYR  69           HN       TYR  69 -12.733  -2.988   0.817
   75    HA   TYR  69           HA       TYR  69 -14.772  -0.930   0.253
   76    HB2  TYR  69           HB2      TYR  69 -11.959  -1.194  -0.795
   77    HB3  TYR  69           HB1      TYR  69 -13.177  -0.250  -1.640
   78    HD1  TYR  69           HD2      TYR  69 -11.392  -0.606   1.577
   79    HD2  TYR  69           HD1      TYR  69 -13.675   1.917  -0.950
   80    HE1  TYR  69           HE2      TYR  69 -10.887   1.287   3.039
   81    HE2  TYR  69           HE1      TYR  69 -13.183   3.838   0.507
   82    HH   TYR  69           HH       TYR  69 -12.525   4.260   2.850
   83    H    ARG  70           HN       ARG  70 -15.516  -0.939  -2.001
   84    HA   ARG  70           HA       ARG  70 -16.106  -3.680  -2.766
   85    HB2  ARG  70           HB2      ARG  70 -17.243  -1.684  -4.532
   86    HB3  ARG  70           HB1      ARG  70 -18.057  -2.872  -3.530
   87    HG2  ARG  70           HG2      ARG  70 -17.056  -0.220  -2.528
   88    HG3  ARG  70           HG1      ARG  70 -18.699  -0.512  -3.096
   89    HD2  ARG  70           HD2      ARG  70 -17.360  -1.941  -0.796
   90    HD3  ARG  70           HD1      ARG  70 -18.523  -0.625  -0.646
   91    HE   ARG  70           HE       ARG  70 -20.012  -2.291  -1.984
   92   HH11  ARG  70          HH11      ARG  70 -17.768  -3.065   0.605
   93   HH12  ARG  70          HH12      ARG  70 -18.623  -4.505   1.071
   94   HH21  ARG  70          HH21      ARG  70 -21.168  -4.144  -1.296
   95   HH22  ARG  70          HH22      ARG  70 -20.567  -5.083   0.037
   96    H    LEU  71           HN       LEU  71 -14.464  -0.845  -4.004
   97    HA   LEU  71           HA       LEU  71 -13.793  -2.237  -6.486
   98    HB2  LEU  71           HB2      LEU  71 -13.774   0.631  -5.598
   99    HB3  LEU  71           HB1      LEU  71 -12.848   0.125  -7.001
  100    HG   LEU  71           HG       LEU  71 -14.750  -0.325  -8.256
  101   HD11  LEU  71          HD11      LEU  71 -16.432  -0.221  -5.768
  102   HD12  LEU  71          HD12      LEU  71 -15.944  -1.688  -6.618
  103   HD13  LEU  71          HD13      LEU  71 -17.007  -0.522  -7.409
  104   HD21  LEU  71          HD21      LEU  71 -16.122   1.674  -8.108
  105   HD22  LEU  71          HD22      LEU  71 -14.417   2.065  -7.871
  106   HD23  LEU  71          HD23      LEU  71 -15.510   1.980  -6.484
  107    H    ILE  72           HN       ILE  72 -11.654  -2.438  -7.168
  108    HA   ILE  72           HA       ILE  72  -9.652  -2.750  -5.186
  109    HB   ILE  72           HB       ILE  72  -9.555  -2.695  -8.194
  110   HG12  ILE  72          HG12      ILE  72 -10.389  -4.693  -6.945
  111   HG13  ILE  72          HG11      ILE  72  -8.984  -5.022  -7.954
  112   HG21  ILE  72          HG21      ILE  72  -7.187  -2.986  -6.354
  113   HG22  ILE  72          HG22      ILE  72  -7.486  -1.639  -7.453
  114   HG23  ILE  72          HG23      ILE  72  -7.173  -3.252  -8.097
  115   HD11  ILE  72          HD11      ILE  72  -8.942  -4.560  -4.977
  116   HD12  ILE  72          HD12      ILE  72  -7.547  -4.932  -5.993
  117   HD13  ILE  72          HD13      ILE  72  -8.828  -6.126  -5.783
  118    H    SER  73           HN       SER  73 -10.222  -0.217  -7.629
  119    HA   SER  73           HA       SER  73  -8.031   1.380  -6.850
  120    HB2  SER  73           HB2      SER  73 -10.602   2.181  -8.231
  121    HB3  SER  73           HB1      SER  73  -9.152   3.179  -8.127
  122    HG   SER  73           HG       SER  73  -8.690   2.205  -9.940
  123    H    LEU  74           HN       LEU  74 -11.267   1.073  -5.652
  124    HA   LEU  74           HA       LEU  74 -11.448   3.319  -4.046
  125    HB2  LEU  74           HB2      LEU  74 -12.776   0.780  -4.370
  126    HB3  LEU  74           HB1      LEU  74 -12.622   1.170  -2.663
  127    HG   LEU  74           HG       LEU  74 -13.942   2.859  -4.775
  128   HD11  LEU  74          HD11      LEU  74 -15.030   1.432  -2.349
  129   HD12  LEU  74          HD12      LEU  74 -15.272   0.941  -4.025
  130   HD13  LEU  74          HD13      LEU  74 -15.952   2.463  -3.444
  131   HD21  LEU  74          HD21      LEU  74 -14.465   4.249  -2.731
  132   HD22  LEU  74          HD22      LEU  74 -12.804   4.289  -3.337
  133   HD23  LEU  74          HD23      LEU  74 -13.199   3.312  -1.926
  134    H    LEU  75           HN       LEU  75 -10.383   0.101  -3.232
  135    HA   LEU  75           HA       LEU  75  -9.489   0.731  -0.621
  136    HB2  LEU  75           HB2      LEU  75 -10.073  -1.481  -0.991
  137    HB3  LEU  75           HB1      LEU  75  -9.223  -1.548  -2.530
  138    HG   LEU  75           HG       LEU  75  -7.078  -1.401  -1.190
  139   HD11  LEU  75          HD11      LEU  75  -7.260  -2.220   1.133
  140   HD12  LEU  75          HD12      LEU  75  -9.012  -2.009   1.033
  141   HD13  LEU  75          HD13      LEU  75  -7.940  -0.608   0.902
  142   HD21  LEU  75          HD21      LEU  75  -7.867  -3.376  -2.288
  143   HD22  LEU  75          HD22      LEU  75  -8.928  -3.746  -0.921
  144   HD23  LEU  75          HD23      LEU  75  -7.169  -3.800  -0.719
  145    H    ASN  76           HN       ASN  76  -8.166   0.831  -3.770
  146    HA   ASN  76           HA       ASN  76  -5.399   0.903  -3.085
  147    HB2  ASN  76           HB2      ASN  76  -6.884   0.768  -5.426
  148    HB3  ASN  76           HB1      ASN  76  -6.140   2.365  -5.506
  149   HD21  ASN  76          HD21      ASN  76  -5.646  -1.041  -5.535
  150   HD22  ASN  76          HD22      ASN  76  -3.978  -1.018  -6.015
  151    H    LEU  77           HN       LEU  77  -7.944   3.265  -3.571
  152    HA   LEU  77           HA       LEU  77  -6.249   5.517  -3.171
  153    HB2  LEU  77           HB2      LEU  77  -9.108   4.969  -3.646
  154    HB3  LEU  77           HB1      LEU  77  -8.746   6.445  -2.781
  155    HG   LEU  77           HG       LEU  77  -8.992   6.453  -5.371
  156   HD11  LEU  77          HD11      LEU  77  -7.421   8.327  -5.466
  157   HD12  LEU  77          HD12      LEU  77  -6.738   7.809  -3.923
  158   HD13  LEU  77          HD13      LEU  77  -8.409   8.357  -4.006
  159   HD21  LEU  77          HD21      LEU  77  -6.874   6.199  -6.551
  160   HD22  LEU  77          HD22      LEU  77  -7.380   4.676  -5.821
  161   HD23  LEU  77          HD23      LEU  77  -6.105   5.635  -5.065
  162    H    HIS  78           HN       HIS  78  -8.245   3.456  -1.209
  163    HA   HIS  78           HA       HIS  78  -8.199   4.905   1.198
  164    HB2  HIS  78           HB2      HIS  78  -9.615   2.971   1.048
  165    HB3  HIS  78           HB1      HIS  78  -8.255   1.935   0.613
  166    HD1  HIS  78           HD1      HIS  78  -9.958   3.478   3.566
  167    HD2  HIS  78           HD2      HIS  78  -6.677   1.062   2.734
  168    HE1  HIS  78           HE1      HIS  78  -9.156   2.571   5.787
  169    H    LYS  79           HN       LYS  79  -5.909   2.664  -0.268
  170    HA   LYS  79           HA       LYS  79  -4.079   2.721   1.935
  171    HB2  LYS  79           HB2      LYS  79  -4.345   0.997  -0.045
  172    HB3  LYS  79           HB1      LYS  79  -3.229   2.080  -0.873
  173    HG2  LYS  79           HG2      LYS  79  -1.798   0.532   0.054
  174    HG3  LYS  79           HG1      LYS  79  -1.787   1.804   1.276
  175    HD2  LYS  79           HD2      LYS  79  -2.021  -0.282   2.412
  176    HD3  LYS  79           HD1      LYS  79  -3.586   0.537   2.481
  177    HE2  LYS  79           HE2      LYS  79  -4.022  -1.741   1.938
  178    HE3  LYS  79           HE1      LYS  79  -4.264  -0.803   0.469
  179    HZ1  LYS  79           HZ1      LYS  79  -1.919  -2.493   1.149
  180    HZ2  LYS  79           HZ2      LYS  79  -1.954  -1.440  -0.174
  181    HZ3  LYS  79           HZ3      LYS  79  -3.038  -2.743  -0.101
  182    H    LYS  80           HN       LYS  80  -4.660   4.606  -0.917
  183    HA   LYS  80           HA       LYS  80  -2.340   6.236  -0.765
  184    HB2  LYS  80           HB2      LYS  80  -3.579   6.199  -2.821
  185    HB3  LYS  80           HB1      LYS  80  -5.059   6.679  -2.007
  186    HG2  LYS  80           HG2      LYS  80  -4.239   8.879  -1.658
  187    HG3  LYS  80           HG1      LYS  80  -2.621   8.429  -2.163
  188    HD2  LYS  80           HD2      LYS  80  -4.970   8.195  -4.014
  189    HD3  LYS  80           HD1      LYS  80  -4.093   9.714  -3.821
  190    HE2  LYS  80           HE2      LYS  80  -2.005   8.570  -4.421
  191    HE3  LYS  80           HE1      LYS  80  -2.915   7.078  -4.650
  192    HZ1  LYS  80           HZ1      LYS  80  -2.501   8.197  -6.757
  193    HZ2  LYS  80           HZ2      LYS  80  -3.314   9.580  -6.205
  194    HZ3  LYS  80           HZ3      LYS  80  -4.163   8.136  -6.432
  195    H    ARG  81           HN       ARG  81  -5.581   6.396   0.670
  196    HA   ARG  81           HA       ARG  81  -5.553   8.958   1.703
  197    HB2  ARG  81           HB2      ARG  81  -6.677   6.513   3.065
  198    HB3  ARG  81           HB1      ARG  81  -7.140   8.172   3.362
  199    HG2  ARG  81           HG2      ARG  81  -7.558   6.667   0.811
  200    HG3  ARG  81           HG1      ARG  81  -8.785   7.014   2.024
  201    HD2  ARG  81           HD2      ARG  81  -8.504   9.409   1.615
  202    HD3  ARG  81           HD1      ARG  81  -7.271   9.055   0.402
  203    HE   ARG  81           HE       ARG  81  -9.679   7.671  -0.182
  204   HH11  ARG  81          HH11      ARG  81  -8.234  10.856  -0.328
  205   HH12  ARG  81          HH12      ARG  81  -9.246  11.391  -1.633
  206   HH21  ARG  81          HH21      ARG  81 -11.000   8.368  -1.896
  207   HH22  ARG  81          HH22      ARG  81 -10.803   9.970  -2.546
  208    H    HIS  82           HN       HIS  82  -4.274   5.990   3.138
  209    HA   HIS  82           HA       HIS  82  -3.708   7.042   5.678
  210    HB2  HIS  82           HB2      HIS  82  -2.768   4.612   4.200
  211    HB3  HIS  82           HB1      HIS  82  -2.139   4.996   5.784
  212    HD1  HIS  82           HD1      HIS  82  -4.016   5.082   7.738
  213    HD2  HIS  82           HD2      HIS  82  -5.082   3.326   4.129
  214    HE1  HIS  82           HE1      HIS  82  -6.057   3.675   8.201
  215    H    SER  83           HN       SER  83  -1.941   7.299   2.720
  216    HA   SER  83           HA       SER  83   0.323   8.411   4.241
  217    HB2  SER  83           HB2      SER  83   0.373   7.219   1.458
  218    HB3  SER  83           HB1      SER  83   1.766   7.810   2.364
  219    HG   SER  83           HG       SER  83   0.716   6.133   3.982
  220    H    GLY  84           HN       GLY  84  -2.302   9.504   2.979
  221    HA2  GLY  84           HA2      GLY  84  -2.891  11.598   2.180
  222    HA3  GLY  84           HA1      GLY  84  -1.182  11.982   2.004
  223    H    GLU  85           HN       GLU  85  -0.191  10.248   0.321
  224    HA   GLU  85           HA       GLU  85  -1.937  10.039  -1.995
  225    HB2  GLU  85           HB2      GLU  85  -0.316  10.955  -3.453
  226    HB3  GLU  85           HB1      GLU  85  -0.348  12.064  -2.089
  227    HG2  GLU  85           HG2      GLU  85   1.575  10.360  -1.290
  228    HG3  GLU  85           HG1      GLU  85   1.766  10.279  -3.036
  229    H    ALA  86           HN       ALA  86  -0.798   8.560  -3.595
  230    HA   ALA  86           HA       ALA  86   0.658   6.455  -2.157
  231    HB1  ALA  86           HB1      ALA  86  -1.632   5.694  -2.485
  232    HB2  ALA  86           HB2      ALA  86  -0.526   4.773  -3.505
  233    HB3  ALA  86           HB3      ALA  86  -1.515   6.047  -4.208
  234    H    ARG  87           HN       ARG  87   2.636   6.716  -2.904
  235    HA   ARG  87           HA       ARG  87   2.990   7.494  -5.652
  236    HB2  ARG  87           HB2      ARG  87   5.089   7.083  -3.536
  237    HB3  ARG  87           HB1      ARG  87   5.279   7.944  -5.057
  238    HG2  ARG  87           HG2      ARG  87   3.350   8.748  -2.921
  239    HG3  ARG  87           HG1      ARG  87   5.020   9.310  -3.002
  240    HD2  ARG  87           HD2      ARG  87   2.940   9.648  -5.153
  241    HD3  ARG  87           HD1      ARG  87   3.426  10.903  -4.013
  242    HE   ARG  87           HE       ARG  87   5.358   9.707  -5.894
  243   HH11  ARG  87          HH11      ARG  87   3.760  12.484  -4.478
  244   HH12  ARG  87          HH12      ARG  87   4.752  13.641  -5.325
  245   HH21  ARG  87          HH21      ARG  87   6.687  11.214  -6.985
  246   HH22  ARG  87          HH22      ARG  87   6.424  12.915  -6.739
  247    H    TYR  88           HN       TYR  88   5.039   5.404  -3.778
  248    HA   TYR  88           HA       TYR  88   5.163   3.478  -5.974
  249    HB2  TYR  88           HB2      TYR  88   6.765   3.707  -3.424
  250    HB3  TYR  88           HB1      TYR  88   7.053   2.546  -4.708
  251    HD1  TYR  88           HD1      TYR  88   6.803   6.213  -4.151
  252    HD2  TYR  88           HD2      TYR  88   8.588   3.046  -6.338
  253    HE1  TYR  88           HE1      TYR  88   8.286   7.827  -5.263
  254    HE2  TYR  88           HE2      TYR  88  10.075   4.624  -7.448
  255    HH   TYR  88           HH       TYR  88  10.061   7.098  -8.010
  256    H    ARG  89           HN       ARG  89   4.770   1.279  -5.696
  257    HA   ARG  89           HA       ARG  89   3.494   0.488  -3.155
  258    HB2  ARG  89           HB2      ARG  89   3.231  -0.643  -5.932
  259    HB3  ARG  89           HB1      ARG  89   2.993  -1.666  -4.538
  260    HG2  ARG  89           HG2      ARG  89   1.146  -0.449  -3.827
  261    HG3  ARG  89           HG1      ARG  89   1.461   0.856  -4.987
  262    HD2  ARG  89           HD2      ARG  89   1.274  -1.065  -6.729
  263    HD3  ARG  89           HD1      ARG  89   0.404  -1.885  -5.439
  264    HE   ARG  89           HE       ARG  89  -0.943   0.369  -5.508
  265   HH11  ARG  89          HH11      ARG  89   0.252  -1.582  -8.153
  266   HH12  ARG  89          HH12      ARG  89  -0.999  -1.080  -9.260
  267   HH21  ARG  89          HH21      ARG  89  -2.599   1.029  -6.953
  268   HH22  ARG  89          HH22      ARG  89  -2.605   0.413  -8.585
  269    H    CYS  90           HN       CYS  90   4.278  -1.316  -2.179
  270    HA   CYS  90           HA       CYS  90   6.742  -2.543  -2.951
  271    HB2  CYS  90           HB2      CYS  90   5.542  -2.518  -0.662
  272    HB3  CYS  90           HB1      CYS  90   4.530  -3.755  -1.324
  273    H    GLU  91           HN       GLU  91   6.810  -3.708  -4.862
  274    HA   GLU  91           HA       GLU  91   4.505  -4.425  -6.286
  275    HB2  GLU  91           HB2      GLU  91   5.939  -5.558  -7.833
  276    HB3  GLU  91           HB1      GLU  91   6.743  -4.081  -7.296
  277    HG2  GLU  91           HG2      GLU  91   8.198  -5.248  -5.904
  278    HG3  GLU  91           HG1      GLU  91   7.242  -6.716  -6.031
  279    H    ASP  92           HN       ASP  92   5.422  -5.729  -3.482
  280    HA   ASP  92           HA       ASP  92   4.642  -8.453  -4.237
  281    HB2  ASP  92           HB2      ASP  92   6.251  -9.236  -2.877
  282    HB3  ASP  92           HB1      ASP  92   6.847  -7.583  -2.767
  283    H    CYS  93           HN       CYS  93   3.996  -5.777  -1.936
  284    HA   CYS  93           HA       CYS  93   1.672  -7.321  -1.123
  285    HB2  CYS  93           HB2      CYS  93   2.141  -7.118   1.153
  286    HB3  CYS  93           HB1      CYS  93   3.700  -7.473   0.441
  287    H    GLY  94           HN       GLY  94   2.751  -4.563  -2.465
  288    HA2  GLY  94           HA2      GLY  94   1.740  -2.704  -3.140
  289    HA3  GLY  94           HA1      GLY  94   0.216  -3.467  -2.723
  290    H    LYS  95           HN       LYS  95   2.805  -2.688  -0.485
  291    HA   LYS  95           HA       LYS  95   1.193  -0.787   0.921
  292    HB2  LYS  95           HB2      LYS  95   4.032  -1.737   1.190
  293    HB3  LYS  95           HB1      LYS  95   3.420  -0.360   2.119
  294    HG2  LYS  95           HG2      LYS  95   1.591  -1.840   2.901
  295    HG3  LYS  95           HG1      LYS  95   2.446  -3.196   2.166
  296    HD2  LYS  95           HD2      LYS  95   4.302  -2.896   3.614
  297    HD3  LYS  95           HD1      LYS  95   3.671  -1.358   4.214
  298    HE2  LYS  95           HE2      LYS  95   1.747  -2.537   5.161
  299    HE3  LYS  95           HE1      LYS  95   2.412  -4.066   4.600
  300    HZ1  LYS  95           HZ1      LYS  95   2.853  -3.585   6.978
  301    HZ2  LYS  95           HZ2      LYS  95   3.802  -2.259   6.508
  302    HZ3  LYS  95           HZ3      LYS  95   4.264  -3.832   6.073
  303    H    LEU  96           HN       LEU  96   1.224   1.371   0.639
  304    HA   LEU  96           HA       LEU  96   2.674   2.280  -1.726
  305    HB2  LEU  96           HB2      LEU  96   0.239   3.249  -0.294
  306    HB3  LEU  96           HB1      LEU  96   1.083   4.303  -1.416
  307    HG   LEU  96           HG       LEU  96  -0.796   3.273  -2.530
  308   HD11  LEU  96          HD11      LEU  96   1.755   1.941  -3.410
  309   HD12  LEU  96          HD12      LEU  96   1.272   3.594  -3.821
  310   HD13  LEU  96          HD13      LEU  96   0.319   2.222  -4.400
  311   HD21  LEU  96          HD21      LEU  96  -0.965   0.860  -2.828
  312   HD22  LEU  96          HD22      LEU  96  -1.062   1.307  -1.123
  313   HD23  LEU  96          HD23      LEU  96   0.434   0.636  -1.776
  314    H    PHE  97           HN       PHE  97   4.507   3.266  -1.420
  315    HA   PHE  97           HA       PHE  97   4.819   4.858   1.039
  316    HB2  PHE  97           HB2      PHE  97   6.991   3.620  -0.659
  317    HB3  PHE  97           HB1      PHE  97   7.245   4.595   0.782
  318    HD1  PHE  97           HD2      PHE  97   5.752   1.415  -0.413
  319    HD2  PHE  97           HD1      PHE  97   7.140   3.666   2.921
  320    HE1  PHE  97           HE2      PHE  97   5.483  -0.571   1.037
  321    HE2  PHE  97           HE1      PHE  97   6.895   1.693   4.365
  322    HZ   PHE  97           HZ       PHE  97   6.068  -0.427   3.423
  323    H    THR  98           HN       THR  98   5.334   6.898   0.939
  324    HA   THR  98           HA       THR  98   5.026   8.246  -1.575
  325    HB   THR  98           HB       THR  98   5.112  10.273  -0.156
  326    HG1  THR  98           HG1      THR  98   5.672  10.111   1.954
  327   HG21  THR  98          HG21      THR  98   3.104   9.689   1.179
  328   HG22  THR  98          HG22      THR  98   3.428   7.981   0.840
  329   HG23  THR  98          HG23      THR  98   3.026   9.082  -0.481
  330    H    THR  99           HN       THR  99   7.532   6.910   0.124
  331    HA   THR  99           HA       THR  99   9.477   8.397  -1.476
  332    HB   THR  99           HB       THR  99   9.712   7.555   1.420
  333    HG1  THR  99           HG1      THR  99   9.394   9.611   1.790
  334   HG21  THR  99          HG21      THR  99  12.009   8.305   1.342
  335   HG22  THR  99          HG22      THR  99  11.852   8.682  -0.375
  336   HG23  THR  99          HG23      THR  99  11.743   7.011   0.175
  337    H    SER 100           HN       SER 100  10.718   7.097  -2.662
  338    HA   SER 100           HA       SER 100  10.204   4.341  -2.851
  339    HB2  SER 100           HB2      SER 100  12.242   4.489  -4.435
  340    HB3  SER 100           HB1      SER 100  10.799   5.425  -4.846
  341    HG   SER 100           HG       SER 100  13.314   6.287  -4.110
  342    H    GLY 101           HN       GLY 101  12.568   6.227  -1.148
  343    HA2  GLY 101           HA2      GLY 101  14.322   4.076  -0.508
  344    HA3  GLY 101           HA1      GLY 101  14.230   5.613   0.319
  345    H    ASN 102           HN       ASN 102  11.688   5.658   1.342
  346    HA   ASN 102           HA       ASN 102  11.671   3.955   3.552
  347    HB2  ASN 102           HB2      ASN 102   9.346   5.239   2.101
  348    HB3  ASN 102           HB1      ASN 102   9.192   4.393   3.629
  349   HD21  ASN 102          HD21      ASN 102   8.455   6.205   4.713
  350   HD22  ASN 102          HD22      ASN 102   9.492   7.533   5.111
  351    H    LEU 103           HN       LEU 103  10.328   3.709   0.362
  352    HA   LEU 103           HA       LEU 103   8.890   1.348   0.717
  353    HB2  LEU 103           HB2      LEU 103   8.424   2.653  -1.168
  354    HB3  LEU 103           HB1      LEU 103  10.127   2.772  -1.604
  355    HG   LEU 103           HG       LEU 103  10.037   0.293  -2.092
  356   HD11  LEU 103          HD11      LEU 103   7.084   0.687  -2.334
  357   HD12  LEU 103          HD12      LEU 103   7.802   0.152  -0.802
  358   HD13  LEU 103          HD13      LEU 103   8.030  -0.819  -2.260
  359   HD21  LEU 103          HD21      LEU 103   8.929   0.725  -4.270
  360   HD22  LEU 103          HD22      LEU 103  10.144   1.925  -3.807
  361   HD23  LEU 103          HD23      LEU 103   8.432   2.290  -3.626
  362    H    LYS 104           HN       LYS 104  12.062   2.031  -0.604
  363    HA   LYS 104           HA       LYS 104  13.007  -0.441  -1.248
  364    HB2  LYS 104           HB2      LYS 104  14.039   1.717  -1.769
  365    HB3  LYS 104           HB1      LYS 104  14.489   1.911  -0.085
  366    HG2  LYS 104           HG2      LYS 104  16.073   0.199  -0.196
  367    HG3  LYS 104           HG1      LYS 104  15.445  -0.401  -1.737
  368    HD2  LYS 104           HD2      LYS 104  17.471   0.809  -2.176
  369    HD3  LYS 104           HD1      LYS 104  16.113   1.767  -2.769
  370    HE2  LYS 104           HE2      LYS 104  17.338   3.373  -1.682
  371    HE3  LYS 104           HE1      LYS 104  16.240   2.866  -0.400
  372    HZ1  LYS 104           HZ1      LYS 104  18.510   3.029   0.403
  373    HZ2  LYS 104           HZ2      LYS 104  19.033   1.930  -0.774
  374    HZ3  LYS 104           HZ3      LYS 104  17.990   1.415   0.459
  375    H    ARG 105           HN       ARG 105  13.259   1.180   1.925
  376    HA   ARG 105           HA       ARG 105  14.739  -0.793   3.246
  377    HB2  ARG 105           HB2      ARG 105  12.484   0.759   4.518
  378    HB3  ARG 105           HB1      ARG 105  13.925   0.135   5.305
  379    HG2  ARG 105           HG2      ARG 105  13.828   2.369   3.293
  380    HG3  ARG 105           HG1      ARG 105  13.992   2.547   5.038
  381    HD2  ARG 105           HD2      ARG 105  16.130   1.341   4.946
  382    HD3  ARG 105           HD1      ARG 105  15.959   1.197   3.195
  383    HE   ARG 105           HE       ARG 105  15.717   3.888   3.761
  384   HH11  ARG 105          HH11      ARG 105  18.187   1.428   4.202
  385   HH12  ARG 105          HH12      ARG 105  19.503   2.561   4.087
  386   HH21  ARG 105          HH21      ARG 105  17.443   5.360   3.608
  387   HH22  ARG 105          HH22      ARG 105  19.079   4.785   3.738
  388    H    HIS 106           HN       HIS 106  11.303  -0.430   2.685
  389    HA   HIS 106           HA       HIS 106  10.505  -2.768   4.130
  390    HB2  HIS 106           HB2      HIS 106   9.002  -0.864   3.880
  391    HB3  HIS 106           HB1      HIS 106   9.039  -1.039   2.129
  392    HD1  HIS 106           HD1      HIS 106   7.716  -2.805   5.222
  393    HD2  HIS 106           HD2      HIS 106   7.362  -2.848   1.081
  394    HE1  HIS 106           HE1      HIS 106   5.747  -4.298   4.693
  395    H    GLN 107           HN       GLN 107  11.810  -2.303   1.029
  396    HA   GLN 107           HA       GLN 107  10.439  -4.505  -0.234
  397    HB2  GLN 107           HB2      GLN 107  12.876  -2.962  -1.176
  398    HB3  GLN 107           HB1      GLN 107  11.891  -4.035  -2.156
  399    HG2  GLN 107           HG2      GLN 107  10.347  -1.905  -0.981
  400    HG3  GLN 107           HG1      GLN 107  11.699  -1.308  -1.931
  401   HE21  GLN 107          HE21      GLN 107   8.699  -3.021  -2.018
  402   HE22  GLN 107          HE22      GLN 107   8.539  -3.028  -3.752
  403    H    LEU 108           HN       LEU 108  13.191  -3.680   1.537
  404    HA   LEU 108           HA       LEU 108  14.820  -5.952   0.917
  405    HB2  LEU 108           HB2      LEU 108  15.002  -3.694   2.864
  406    HB3  LEU 108           HB1      LEU 108  16.115  -5.046   2.935
  407    HG   LEU 108           HG       LEU 108  17.344  -4.312   1.198
  408   HD11  LEU 108          HD11      LEU 108  15.531  -4.702  -0.416
  409   HD12  LEU 108          HD12      LEU 108  16.500  -3.282  -0.806
  410   HD13  LEU 108          HD13      LEU 108  14.906  -3.088  -0.070
  411   HD21  LEU 108          HD21      LEU 108  17.201  -2.427   2.732
  412   HD22  LEU 108          HD22      LEU 108  15.824  -1.794   1.824
  413   HD23  LEU 108          HD23      LEU 108  17.416  -1.889   1.064
  414    H    VAL 109           HN       VAL 109  12.442  -5.108   3.300
  415    HA   VAL 109           HA       VAL 109  13.273  -7.067   5.154
  416    HB   VAL 109           HB       VAL 109  11.198  -6.675   6.273
  417   HG11  VAL 109          HG11      VAL 109  12.793  -4.805   6.317
  418   HG12  VAL 109          HG12      VAL 109  11.120  -4.263   6.443
  419   HG13  VAL 109          HG13      VAL 109  11.981  -4.116   4.910
  420   HG21  VAL 109          HG21      VAL 109  10.284  -5.469   3.689
  421   HG22  VAL 109          HG22      VAL 109   9.360  -5.435   5.199
  422   HG23  VAL 109          HG23      VAL 109   9.711  -6.975   4.408
  423    H    HIS 110           HN       HIS 110  11.504  -7.093   2.189
  424    HA   HIS 110           HA       HIS 110  10.397  -9.752   2.705
  425    HB2  HIS 110           HB2      HIS 110  10.305  -7.922   0.329
  426    HB3  HIS 110           HB1      HIS 110   9.628  -9.527   0.304
  427    HD1  HIS 110           HD1      HIS 110   7.358  -9.855   1.585
  428    HD2  HIS 110           HD2      HIS 110   8.978  -6.046   1.679
  429    HE1  HIS 110           HE1      HIS 110   5.457  -8.277   2.176
  430    H    SER 111           HN       SER 111  13.374  -8.632   1.862
  431    HA   SER 111           HA       SER 111  14.207 -11.176   0.776
  432    HB2  SER 111           HB2      SER 111  13.372  -9.773  -1.195
  433    HB3  SER 111           HB1      SER 111  14.728  -8.692  -0.875
  434    HG   SER 111           HG       SER 111  14.710 -11.323  -1.845
  435    H    GLY 112           HN       GLY 112  14.723  -9.870   3.158
  436    HA2  GLY 112           HA2      GLY 112  17.554  -9.122   2.912
  437    HA3  GLY 112           HA1      GLY 112  16.414  -8.042   3.731
  Start of MODEL   16
    1    H    LYS  58           HT1      LYS  58 -15.046  -6.881  -6.497
    2    HA   LYS  58           HA       LYS  58 -15.744  -8.743  -5.068
    3    HB2  LYS  58           HB2      LYS  58 -12.778  -9.328  -5.057
    4    HB3  LYS  58           HB1      LYS  58 -13.988 -10.126  -4.069
    5    HG2  LYS  58           HG2      LYS  58 -15.015 -11.052  -6.100
    6    HG3  LYS  58           HG1      LYS  58 -13.754 -10.278  -7.066
    7    HD2  LYS  58           HD2      LYS  58 -13.376 -12.394  -4.946
    8    HD3  LYS  58           HD1      LYS  58 -13.150 -12.587  -6.687
    9    HE2  LYS  58           HE2      LYS  58 -11.268 -11.109  -6.676
   10    HE3  LYS  58           HE1      LYS  58 -11.576 -10.641  -5.006
   11    HZ1  LYS  58           HZ1      LYS  58 -11.102 -12.955  -4.358
   12    HZ2  LYS  58           HZ2      LYS  58  -9.770 -12.181  -5.071
   13    HZ3  LYS  58           HZ3      LYS  58 -10.674 -13.305  -5.963
   14    HA   PRO  59           HA       PRO  59 -14.829  -5.941  -1.707
   15    HB2  PRO  59           HB2      PRO  59 -14.713  -8.322   0.055
   16    HB3  PRO  59           HB1      PRO  59 -15.737  -6.886   0.168
   17    HG2  PRO  59           HG2      PRO  59 -16.729  -9.239  -0.617
   18    HG3  PRO  59           HG1      PRO  59 -17.287  -7.712  -1.331
   19    HD2  PRO  59           HD2      PRO  59 -15.396  -9.742  -2.441
   20    HD3  PRO  59           HD1      PRO  59 -16.640  -8.791  -3.264
   21    H    TYR  60           HN       TYR  60 -12.984  -5.116  -1.530
   22    HA   TYR  60           HA       TYR  60 -10.597  -6.757  -0.949
   23    HB2  TYR  60           HB2      TYR  60 -11.012  -4.388  -2.716
   24    HB3  TYR  60           HB1      TYR  60  -9.470  -4.555  -1.902
   25    HD1  TYR  60           HD2      TYR  60 -11.165  -7.579  -2.775
   26    HD2  TYR  60           HD1      TYR  60  -8.443  -4.639  -4.195
   27    HE1  TYR  60           HE2      TYR  60 -10.424  -9.125  -4.503
   28    HE2  TYR  60           HE1      TYR  60  -7.696  -6.180  -5.954
   29    HH   TYR  60           HH       TYR  60  -9.372  -9.071  -6.708
   30    H    GLY  61           HN       GLY  61  -9.833  -6.421   1.067
   31    HA2  GLY  61           HA2      GLY  61 -10.584  -3.865   2.295
   32    HA3  GLY  61           HA1      GLY  61 -10.808  -5.384   3.141
   33    H    CYS  62           HN       CYS  62  -9.325  -2.903   3.615
   34    HA   CYS  62           HA       CYS  62  -6.543  -3.292   3.611
   35    HB2  CYS  62           HB2      CYS  62  -8.279  -1.297   4.315
   36    HB3  CYS  62           HB1      CYS  62  -7.704  -1.828   5.877
   37    H    GLU  63           HN       GLU  63  -5.359  -4.696   4.770
   38    HA   GLU  63           HA       GLU  63  -6.568  -6.407   6.708
   39    HB2  GLU  63           HB2      GLU  63  -3.676  -6.060   5.917
   40    HB3  GLU  63           HB1      GLU  63  -4.316  -7.385   6.878
   41    HG2  GLU  63           HG2      GLU  63  -5.589  -8.203   5.043
   42    HG3  GLU  63           HG1      GLU  63  -5.232  -6.767   4.085
   43    H    GLU  64           HN       GLU  64  -5.246  -3.328   6.945
   44    HA   GLU  64           HA       GLU  64  -4.122  -3.739   9.597
   45    HB2  GLU  64           HB2      GLU  64  -3.565  -1.257   9.279
   46    HB3  GLU  64           HB1      GLU  64  -2.689  -2.447   8.340
   47    HG2  GLU  64           HG2      GLU  64  -3.378  -1.563   6.427
   48    HG3  GLU  64           HG1      GLU  64  -5.062  -1.538   6.970
   49    H    CYS  65           HN       CYS  65  -6.862  -2.134   8.080
   50    HA   CYS  65           HA       CYS  65  -7.636  -1.136  10.735
   51    HB2  CYS  65           HB2      CYS  65  -8.831   0.695   9.383
   52    HB3  CYS  65           HB1      CYS  65  -7.073   0.798   9.492
   53    H    GLY  66           HN       GLY  66  -8.189  -3.223   8.318
   54    HA2  GLY  66           HA2      GLY  66  -9.778  -4.759   7.959
   55    HA3  GLY  66           HA1      GLY  66 -10.479  -4.266   9.495
   56    H    LYS  67           HN       LYS  67 -10.085  -2.279   6.613
   57    HA   LYS  67           HA       LYS  67 -13.014  -2.034   6.484
   58    HB2  LYS  67           HB2      LYS  67 -10.915  -0.085   5.502
   59    HB3  LYS  67           HB1      LYS  67 -12.654   0.158   5.460
   60    HG2  LYS  67           HG2      LYS  67 -10.954  -0.088   7.931
   61    HG3  LYS  67           HG1      LYS  67 -11.669   1.393   7.292
   62    HD2  LYS  67           HD2      LYS  67 -13.909   0.438   7.631
   63    HD3  LYS  67           HD1      LYS  67 -13.174  -1.023   8.294
   64    HE2  LYS  67           HE2      LYS  67 -13.920   0.420  10.091
   65    HE3  LYS  67           HE1      LYS  67 -12.160   0.322  10.086
   66    HZ1  LYS  67           HZ1      LYS  67 -13.045   2.595  10.415
   67    HZ2  LYS  67           HZ2      LYS  67 -13.702   2.540   8.857
   68    HZ3  LYS  67           HZ3      LYS  67 -12.020   2.459   9.072
   69    H    SER  68           HN       SER  68 -13.869  -3.174   4.847
   70    HA   SER  68           HA       SER  68 -12.233  -3.754   2.517
   71    HB2  SER  68           HB2      SER  68 -14.860  -4.892   2.339
   72    HB3  SER  68           HB1      SER  68 -13.298  -5.710   2.470
   73    HG   SER  68           HG       SER  68 -14.010  -6.266   4.379
   74    H    TYR  69           HN       TYR  69 -12.548  -2.987   0.558
   75    HA   TYR  69           HA       TYR  69 -14.815  -1.144   0.171
   76    HB2  TYR  69           HB2      TYR  69 -11.992  -1.055  -0.842
   77    HB3  TYR  69           HB1      TYR  69 -13.270  -0.187  -1.669
   78    HD1  TYR  69           HD2      TYR  69 -11.666  -0.614   1.630
   79    HD2  TYR  69           HD1      TYR  69 -13.905   1.930  -0.924
   80    HE1  TYR  69           HE2      TYR  69 -11.415   1.213   3.251
   81    HE2  TYR  69           HE1      TYR  69 -13.655   3.769   0.672
   82    HH   TYR  69           HH       TYR  69 -11.505   3.603   3.365
   83    H    ARG  70           HN       ARG  70 -15.913  -1.135  -1.720
   84    HA   ARG  70           HA       ARG  70 -16.234  -3.658  -3.004
   85    HB2  ARG  70           HB2      ARG  70 -18.120  -2.161  -2.580
   86    HB3  ARG  70           HB1      ARG  70 -17.403  -0.936  -3.617
   87    HG2  ARG  70           HG2      ARG  70 -19.223  -2.096  -4.731
   88    HG3  ARG  70           HG1      ARG  70 -17.687  -2.378  -5.552
   89    HD2  ARG  70           HD2      ARG  70 -19.037  -4.426  -5.375
   90    HD3  ARG  70           HD1      ARG  70 -17.507  -4.564  -4.514
   91    HE   ARG  70           HE       ARG  70 -19.502  -3.693  -2.723
   92   HH11  ARG  70          HH11      ARG  70 -18.593  -6.524  -4.568
   93   HH12  ARG  70          HH12      ARG  70 -19.241  -7.653  -3.417
   94   HH21  ARG  70          HH21      ARG  70 -20.379  -5.169  -1.204
   95   HH22  ARG  70          HH22      ARG  70 -20.247  -6.880  -1.495
   96    H    LEU  71           HN       LEU  71 -14.752  -0.581  -3.928
   97    HA   LEU  71           HA       LEU  71 -14.077  -1.707  -6.548
   98    HB2  LEU  71           HB2      LEU  71 -14.255   1.072  -5.439
   99    HB3  LEU  71           HB1      LEU  71 -13.305   0.757  -6.882
  100    HG   LEU  71           HG       LEU  71 -15.187   0.195  -8.148
  101   HD11  LEU  71          HD11      LEU  71 -16.800   0.056  -5.621
  102   HD12  LEU  71          HD12      LEU  71 -16.275  -1.314  -6.604
  103   HD13  LEU  71          HD13      LEU  71 -17.427  -0.147  -7.258
  104   HD21  LEU  71          HD21      LEU  71 -16.077   2.374  -6.284
  105   HD22  LEU  71          HD22      LEU  71 -16.687   2.084  -7.912
  106   HD23  LEU  71          HD23      LEU  71 -15.013   2.585  -7.676
  107    H    ILE  72           HN       ILE  72 -11.970  -1.770  -7.271
  108    HA   ILE  72           HA       ILE  72 -10.006  -2.205  -5.248
  109    HB   ILE  72           HB       ILE  72  -9.256  -1.848  -8.129
  110   HG12  ILE  72          HG12      ILE  72 -11.195  -3.254  -8.285
  111   HG13  ILE  72          HG11      ILE  72  -9.783  -4.293  -8.424
  112   HG21  ILE  72          HG21      ILE  72  -8.294  -3.724  -5.989
  113   HG22  ILE  72          HG22      ILE  72  -7.528  -2.197  -6.428
  114   HG23  ILE  72          HG23      ILE  72  -7.603  -3.518  -7.599
  115   HD11  ILE  72          HD11      ILE  72 -11.577  -5.240  -7.017
  116   HD12  ILE  72          HD12      ILE  72 -11.366  -3.890  -5.894
  117   HD13  ILE  72          HD13      ILE  72 -10.050  -5.035  -6.158
  118    H    SER  73           HN       SER  73 -10.629   0.357  -7.597
  119    HA   SER  73           HA       SER  73  -8.395   1.941  -6.855
  120    HB2  SER  73           HB2      SER  73 -10.986   2.862  -8.119
  121    HB3  SER  73           HB1      SER  73  -9.428   3.689  -8.177
  122    HG   SER  73           HG       SER  73  -8.720   1.547  -9.171
  123    H    LEU  74           HN       LEU  74 -11.614   1.554  -5.641
  124    HA   LEU  74           HA       LEU  74 -11.792   3.736  -3.946
  125    HB2  LEU  74           HB2      LEU  74 -13.179   1.299  -4.458
  126    HB3  LEU  74           HB1      LEU  74 -12.929   1.426  -2.719
  127    HG   LEU  74           HG       LEU  74 -14.325   3.424  -4.483
  128   HD11  LEU  74          HD11      LEU  74 -15.316   1.712  -2.201
  129   HD12  LEU  74          HD12      LEU  74 -15.639   1.420  -3.910
  130   HD13  LEU  74          HD13      LEU  74 -16.270   2.871  -3.128
  131   HD21  LEU  74          HD21      LEU  74 -13.029   4.583  -2.915
  132   HD22  LEU  74          HD22      LEU  74 -13.449   3.451  -1.634
  133   HD23  LEU  74          HD23      LEU  74 -14.677   4.556  -2.274
  134    H    LEU  75           HN       LEU  75 -10.698   0.464  -3.259
  135    HA   LEU  75           HA       LEU  75  -9.735   1.081  -0.665
  136    HB2  LEU  75           HB2      LEU  75 -10.255  -1.168  -1.072
  137    HB3  LEU  75           HB1      LEU  75  -9.341  -1.201  -2.581
  138    HG   LEU  75           HG       LEU  75  -7.294  -0.768  -1.011
  139   HD11  LEU  75          HD11      LEU  75  -8.651  -0.392   1.011
  140   HD12  LEU  75          HD12      LEU  75  -7.516  -1.728   1.196
  141   HD13  LEU  75          HD13      LEU  75  -9.227  -2.057   0.909
  142   HD21  LEU  75          HD21      LEU  75  -8.537  -3.465  -0.852
  143   HD22  LEU  75          HD22      LEU  75  -6.845  -3.030  -1.130
  144   HD23  LEU  75          HD23      LEU  75  -8.050  -2.778  -2.403
  145    H    ASN  76           HN       ASN  76  -8.480   1.229  -3.867
  146    HA   ASN  76           HA       ASN  76  -5.714   1.395  -3.287
  147    HB2  ASN  76           HB2      ASN  76  -7.182   1.290  -5.567
  148    HB3  ASN  76           HB1      ASN  76  -6.786   3.011  -5.542
  149   HD21  ASN  76          HD21      ASN  76  -5.586  -0.222  -5.812
  150   HD22  ASN  76          HD22      ASN  76  -3.995   0.187  -6.378
  151    H    LEU  77           HN       LEU  77  -8.304   3.774  -3.469
  152    HA   LEU  77           HA       LEU  77  -6.546   5.955  -2.869
  153    HB2  LEU  77           HB2      LEU  77  -9.412   5.549  -3.452
  154    HB3  LEU  77           HB1      LEU  77  -9.000   6.950  -2.486
  155    HG   LEU  77           HG       LEU  77  -9.197   7.289  -4.996
  156   HD11  LEU  77          HD11      LEU  77  -7.306   8.837  -5.017
  157   HD12  LEU  77          HD12      LEU  77  -6.645   8.028  -3.595
  158   HD13  LEU  77          HD13      LEU  77  -8.176   8.888  -3.483
  159   HD21  LEU  77          HD21      LEU  77  -7.987   5.278  -5.695
  160   HD22  LEU  77          HD22      LEU  77  -6.514   5.916  -4.957
  161   HD23  LEU  77          HD23      LEU  77  -7.241   6.744  -6.334
  162    H    HIS  78           HN       HIS  78  -8.398   3.653  -1.137
  163    HA   HIS  78           HA       HIS  78  -8.408   4.993   1.373
  164    HB2  HIS  78           HB2      HIS  78  -9.906   3.122   1.035
  165    HB3  HIS  78           HB1      HIS  78  -8.555   2.052   0.661
  166    HD1  HIS  78           HD1      HIS  78 -10.322   3.673   3.561
  167    HD2  HIS  78           HD2      HIS  78  -7.196   1.026   2.841
  168    HE1  HIS  78           HE1      HIS  78  -9.702   2.677   5.799
  169    H    LYS  79           HN       LYS  79  -6.181   2.790  -0.258
  170    HA   LYS  79           HA       LYS  79  -4.389   2.765   2.006
  171    HB2  LYS  79           HB2      LYS  79  -2.889   1.437   0.515
  172    HB3  LYS  79           HB1      LYS  79  -4.482   0.743   0.735
  173    HG2  LYS  79           HG2      LYS  79  -5.149   1.521  -1.461
  174    HG3  LYS  79           HG1      LYS  79  -3.571   2.278  -1.684
  175    HD2  LYS  79           HD2      LYS  79  -3.807   0.041  -2.785
  176    HD3  LYS  79           HD1      LYS  79  -2.466   0.154  -1.644
  177    HE2  LYS  79           HE2      LYS  79  -4.037  -0.850   0.080
  178    HE3  LYS  79           HE1      LYS  79  -5.124  -1.204  -1.261
  179    HZ1  LYS  79           HZ1      LYS  79  -3.471  -2.597  -2.260
  180    HZ2  LYS  79           HZ2      LYS  79  -3.651  -3.078  -0.642
  181    HZ3  LYS  79           HZ3      LYS  79  -2.315  -2.151  -1.104
  182    H    LYS  80           HN       LYS  80  -4.773   4.535  -0.956
  183    HA   LYS  80           HA       LYS  80  -2.336   5.978  -0.795
  184    HB2  LYS  80           HB2      LYS  80  -3.549   6.120  -2.846
  185    HB3  LYS  80           HB1      LYS  80  -5.019   6.620  -2.025
  186    HG2  LYS  80           HG2      LYS  80  -4.152   8.776  -1.602
  187    HG3  LYS  80           HG1      LYS  80  -2.526   8.301  -2.054
  188    HD2  LYS  80           HD2      LYS  80  -4.820   8.223  -3.995
  189    HD3  LYS  80           HD1      LYS  80  -3.863   9.686  -3.728
  190    HE2  LYS  80           HE2      LYS  80  -1.828   8.400  -4.268
  191    HE3  LYS  80           HE1      LYS  80  -2.842   7.005  -4.633
  192    HZ1  LYS  80           HZ1      LYS  80  -3.017   9.625  -6.024
  193    HZ2  LYS  80           HZ2      LYS  80  -3.884   8.220  -6.417
  194    HZ3  LYS  80           HZ3      LYS  80  -2.201   8.268  -6.632
  195    H    ARG  81           HN       ARG  81  -5.503   6.317   0.680
  196    HA   ARG  81           HA       ARG  81  -5.263   8.887   1.734
  197    HB2  ARG  81           HB2      ARG  81  -7.364   7.632   1.658
  198    HB3  ARG  81           HB1      ARG  81  -6.752   6.508   2.859
  199    HG2  ARG  81           HG2      ARG  81  -6.873   9.404   3.522
  200    HG3  ARG  81           HG1      ARG  81  -8.358   8.456   3.524
  201    HD2  ARG  81           HD2      ARG  81  -7.438   6.938   5.154
  202    HD3  ARG  81           HD1      ARG  81  -5.871   7.742   5.068
  203    HE   ARG  81           HE       ARG  81  -7.504   9.748   5.808
  204   HH11  ARG  81          HH11      ARG  81  -7.119   6.492   7.011
  205   HH12  ARG  81          HH12      ARG  81  -7.459   6.908   8.664
  206   HH21  ARG  81          HH21      ARG  81  -8.004  10.316   7.979
  207   HH22  ARG  81          HH22      ARG  81  -7.968   9.087   9.210
  208    H    HIS  82           HN       HIS  82  -4.404   5.784   3.250
  209    HA   HIS  82           HA       HIS  82  -3.685   6.858   5.746
  210    HB2  HIS  82           HB2      HIS  82  -2.976   4.276   4.386
  211    HB3  HIS  82           HB1      HIS  82  -2.410   4.665   5.990
  212    HD1  HIS  82           HD1      HIS  82  -4.276   4.796   7.880
  213    HD2  HIS  82           HD2      HIS  82  -5.495   3.418   4.158
  214    HE1  HIS  82           HE1      HIS  82  -6.466   3.595   8.242
  215    H    SER  83           HN       SER  83  -1.783   6.293   2.828
  216    HA   SER  83           HA       SER  83   0.666   7.076   4.174
  217    HB2  SER  83           HB2      SER  83   0.160   6.393   1.266
  218    HB3  SER  83           HB1      SER  83   1.741   6.601   2.017
  219    HG   SER  83           HG       SER  83   1.404   4.450   2.080
  220    H    GLY  84           HN       GLY  84  -1.896   8.720   2.942
  221    HA2  GLY  84           HA2      GLY  84  -2.061  11.045   2.621
  222    HA3  GLY  84           HA1      GLY  84  -0.314  11.119   2.405
  223    H    GLU  85           HN       GLU  85   0.254   9.431   0.493
  224    HA   GLU  85           HA       GLU  85  -1.628   9.597  -1.690
  225    HB2  GLU  85           HB2      GLU  85  -0.139  10.619  -3.211
  226    HB3  GLU  85           HB1      GLU  85   0.019  11.588  -1.754
  227    HG2  GLU  85           HG2      GLU  85   1.955   9.858  -1.270
  228    HG3  GLU  85           HG1      GLU  85   1.927   9.739  -3.019
  229    H    ALA  86           HN       ALA  86  -0.783   8.146  -3.467
  230    HA   ALA  86           HA       ALA  86   0.715   5.915  -2.284
  231    HB1  ALA  86           HB1      ALA  86  -1.625   5.305  -2.525
  232    HB2  ALA  86           HB2      ALA  86  -0.619   4.376  -3.634
  233    HB3  ALA  86           HB3      ALA  86  -1.571   5.732  -4.234
  234    H    ARG  87           HN       ARG  87   2.646   6.539  -3.101
  235    HA   ARG  87           HA       ARG  87   2.874   7.121  -5.905
  236    HB2  ARG  87           HB2      ARG  87   5.058   6.966  -3.849
  237    HB3  ARG  87           HB1      ARG  87   5.151   7.721  -5.434
  238    HG2  ARG  87           HG2      ARG  87   3.336   8.566  -3.210
  239    HG3  ARG  87           HG1      ARG  87   4.909   9.266  -3.571
  240    HD2  ARG  87           HD2      ARG  87   2.553   9.187  -5.449
  241    HD3  ARG  87           HD1      ARG  87   3.028  10.587  -4.490
  242    HE   ARG  87           HE       ARG  87   4.724   9.422  -6.613
  243   HH11  ARG  87          HH11      ARG  87   3.444  12.174  -4.838
  244   HH12  ARG  87          HH12      ARG  87   4.202  13.351  -5.877
  245   HH21  ARG  87          HH21      ARG  87   5.716  10.990  -7.973
  246   HH22  ARG  87          HH22      ARG  87   5.483  12.683  -7.646
  247    H    TYR  88           HN       TYR  88   5.134   5.283  -4.016
  248    HA   TYR  88           HA       TYR  88   5.230   3.193  -6.049
  249    HB2  TYR  88           HB2      TYR  88   6.860   3.605  -3.535
  250    HB3  TYR  88           HB1      TYR  88   7.159   2.382  -4.756
  251    HD1  TYR  88           HD1      TYR  88   6.883   6.072  -4.365
  252    HD2  TYR  88           HD2      TYR  88   8.651   2.822  -6.445
  253    HE1  TYR  88           HE1      TYR  88   8.332   7.645  -5.575
  254    HE2  TYR  88           HE2      TYR  88  10.105   4.365  -7.653
  255    HH   TYR  88           HH       TYR  88  10.553   7.577  -6.732
  256    H    ARG  89           HN       ARG  89   4.851   0.980  -5.540
  257    HA   ARG  89           HA       ARG  89   3.905   0.506  -2.800
  258    HB2  ARG  89           HB2      ARG  89   2.356  -1.119  -3.482
  259    HB3  ARG  89           HB1      ARG  89   2.097   0.223  -4.581
  260    HG2  ARG  89           HG2      ARG  89   3.472  -0.967  -6.272
  261    HG3  ARG  89           HG1      ARG  89   3.569  -2.331  -5.151
  262    HD2  ARG  89           HD2      ARG  89   1.049  -2.309  -5.115
  263    HD3  ARG  89           HD1      ARG  89   1.133  -1.189  -6.474
  264    HE   ARG  89           HE       ARG  89   2.671  -3.528  -6.981
  265   HH11  ARG  89          HH11      ARG  89  -0.619  -2.331  -6.928
  266   HH12  ARG  89          HH12      ARG  89  -1.217  -3.539  -8.021
  267   HH21  ARG  89          HH21      ARG  89   1.908  -5.106  -8.410
  268   HH22  ARG  89          HH22      ARG  89   0.231  -5.123  -8.881
  269    H    CYS  90           HN       CYS  90   4.559  -1.383  -1.898
  270    HA   CYS  90           HA       CYS  90   7.022  -2.529  -2.644
  271    HB2  CYS  90           HB2      CYS  90   5.597  -2.576  -0.424
  272    HB3  CYS  90           HB1      CYS  90   4.958  -4.033  -1.102
  273    H    GLU  91           HN       GLU  91   7.306  -3.745  -4.466
  274    HA   GLU  91           HA       GLU  91   5.146  -4.629  -6.020
  275    HB2  GLU  91           HB2      GLU  91   6.811  -5.641  -7.476
  276    HB3  GLU  91           HB1      GLU  91   7.279  -4.012  -6.994
  277    HG2  GLU  91           HG2      GLU  91   8.864  -4.808  -5.468
  278    HG3  GLU  91           HG1      GLU  91   8.244  -6.446  -5.603
  279    H    ASP  92           HN       ASP  92   5.924  -5.892  -3.189
  280    HA   ASP  92           HA       ASP  92   5.320  -8.618  -4.102
  281    HB2  ASP  92           HB2      ASP  92   6.472  -9.419  -2.013
  282    HB3  ASP  92           HB1      ASP  92   7.520  -8.729  -3.244
  283    H    CYS  93           HN       CYS  93   4.565  -6.090  -1.718
  284    HA   CYS  93           HA       CYS  93   2.401  -7.856  -0.856
  285    HB2  CYS  93           HB2      CYS  93   2.799  -7.399   1.402
  286    HB3  CYS  93           HB1      CYS  93   4.401  -7.679   0.726
  287    H    GLY  94           HN       GLY  94   3.329  -4.855  -2.037
  288    HA2  GLY  94           HA2      GLY  94   2.009  -3.340  -3.071
  289    HA3  GLY  94           HA1      GLY  94   0.590  -4.182  -2.478
  290    H    LYS  95           HN       LYS  95   3.169  -2.926  -0.481
  291    HA   LYS  95           HA       LYS  95   1.328  -1.139   0.853
  292    HB2  LYS  95           HB2      LYS  95   4.242  -1.708   1.368
  293    HB3  LYS  95           HB1      LYS  95   3.173  -0.773   2.410
  294    HG2  LYS  95           HG2      LYS  95   1.723  -2.864   2.420
  295    HG3  LYS  95           HG1      LYS  95   3.148  -3.683   1.793
  296    HD2  LYS  95           HD2      LYS  95   4.403  -3.233   3.703
  297    HD3  LYS  95           HD1      LYS  95   3.261  -2.018   4.284
  298    HE2  LYS  95           HE2      LYS  95   1.598  -3.715   4.685
  299    HE3  LYS  95           HE1      LYS  95   2.633  -4.948   3.974
  300    HZ1  LYS  95           HZ1      LYS  95   4.194  -4.673   5.785
  301    HZ2  LYS  95           HZ2      LYS  95   2.654  -5.008   6.406
  302    HZ3  LYS  95           HZ3      LYS  95   3.260  -3.423   6.451
  303    H    LEU  96           HN       LEU  96   1.311   1.046   0.583
  304    HA   LEU  96           HA       LEU  96   2.853   2.001  -1.691
  305    HB2  LEU  96           HB2      LEU  96   0.459   3.105  -0.254
  306    HB3  LEU  96           HB1      LEU  96   1.320   4.016  -1.491
  307    HG   LEU  96           HG       LEU  96  -0.660   2.982  -2.436
  308   HD11  LEU  96          HD11      LEU  96   0.346   1.731  -4.265
  309   HD12  LEU  96          HD12      LEU  96   1.839   1.568  -3.337
  310   HD13  LEU  96          HD13      LEU  96   1.299   3.164  -3.871
  311   HD21  LEU  96          HD21      LEU  96  -0.922   0.567  -2.541
  312   HD22  LEU  96          HD22      LEU  96  -0.903   1.137  -0.872
  313   HD23  LEU  96          HD23      LEU  96   0.529   0.367  -1.558
  314    H    PHE  97           HN       PHE  97   4.605   3.096  -1.468
  315    HA   PHE  97           HA       PHE  97   4.936   4.799   0.924
  316    HB2  PHE  97           HB2      PHE  97   7.126   3.438  -0.662
  317    HB3  PHE  97           HB1      PHE  97   7.363   4.475   0.740
  318    HD1  PHE  97           HD2      PHE  97   6.241   1.180  -0.404
  319    HD2  PHE  97           HD1      PHE  97   6.851   3.696   2.977
  320    HE1  PHE  97           HE2      PHE  97   6.074  -0.776   1.083
  321    HE2  PHE  97           HE1      PHE  97   6.700   1.733   4.467
  322    HZ   PHE  97           HZ       PHE  97   6.124  -0.463   3.531
  323    H    THR  98           HN       THR  98   5.365   6.859   0.601
  324    HA   THR  98           HA       THR  98   5.034   7.887  -2.054
  325    HB   THR  98           HB       THR  98   4.890  10.035  -1.005
  326    HG1  THR  98           HG1      THR  98   6.046  10.467   0.722
  327   HG21  THR  98          HG21      THR  98   3.194   9.607   0.700
  328   HG22  THR  98          HG22      THR  98   3.756   7.937   0.840
  329   HG23  THR  98          HG23      THR  98   3.011   8.492  -0.658
  330    H    THR  99           HN       THR  99   7.579   6.812  -0.252
  331    HA   THR  99           HA       THR  99   9.517   8.313  -1.855
  332    HB   THR  99           HB       THR  99   9.673   7.500   1.049
  333    HG1  THR  99           HG1      THR  99  10.344  10.065   0.480
  334   HG21  THR  99          HG21      THR  99  11.768   7.071  -0.223
  335   HG22  THR  99          HG22      THR  99  11.930   8.231   1.094
  336   HG23  THR  99          HG23      THR  99  11.847   8.796  -0.576
  337    H    SER 100           HN       SER 100  10.882   7.045  -2.964
  338    HA   SER 100           HA       SER 100  10.450   4.265  -3.095
  339    HB2  SER 100           HB2      SER 100  12.363   4.306  -4.709
  340    HB3  SER 100           HB1      SER 100  11.081   5.462  -5.086
  341    HG   SER 100           HG       SER 100  13.705   5.902  -4.405
  342    H    GLY 101           HN       GLY 101  12.816   6.257  -1.413
  343    HA2  GLY 101           HA2      GLY 101  14.487   4.059  -0.655
  344    HA3  GLY 101           HA1      GLY 101  14.487   5.646   0.075
  345    H    ASN 102           HN       ASN 102  11.789   5.743   0.959
  346    HA   ASN 102           HA       ASN 102  11.766   4.227   3.331
  347    HB2  ASN 102           HB2      ASN 102   9.516   5.479   1.750
  348    HB3  ASN 102           HB1      ASN 102   9.255   4.649   3.276
  349   HD21  ASN 102          HD21      ASN 102   8.678   7.387   2.706
  350   HD22  ASN 102          HD22      ASN 102   9.638   8.347   3.776
  351    H    LEU 103           HN       LEU 103  10.402   3.802   0.159
  352    HA   LEU 103           HA       LEU 103   9.052   1.419   0.637
  353    HB2  LEU 103           HB2      LEU 103   8.551   2.615  -1.313
  354    HB3  LEU 103           HB1      LEU 103  10.246   2.745  -1.765
  355    HG   LEU 103           HG       LEU 103  10.199   0.240  -2.120
  356   HD11  LEU 103          HD11      LEU 103   7.224   0.655  -2.250
  357   HD12  LEU 103          HD12      LEU 103   8.040   0.001  -0.817
  358   HD13  LEU 103          HD13      LEU 103   8.137  -0.867  -2.351
  359   HD21  LEU 103          HD21      LEU 103  10.297   1.738  -3.932
  360   HD22  LEU 103          HD22      LEU 103   8.606   2.181  -3.734
  361   HD23  LEU 103          HD23      LEU 103   9.032   0.562  -4.310
  362    H    LYS 104           HN       LYS 104  12.155   2.064  -0.865
  363    HA   LYS 104           HA       LYS 104  13.234  -0.344  -1.338
  364    HB2  LYS 104           HB2      LYS 104  14.426   1.505  -2.029
  365    HB3  LYS 104           HB1      LYS 104  14.321   2.290  -0.463
  366    HG2  LYS 104           HG2      LYS 104  15.948   0.730   0.433
  367    HG3  LYS 104           HG1      LYS 104  16.051  -0.059  -1.152
  368    HD2  LYS 104           HD2      LYS 104  16.707   2.826  -0.570
  369    HD3  LYS 104           HD1      LYS 104  17.893   1.535  -0.762
  370    HE2  LYS 104           HE2      LYS 104  17.198   1.191  -3.052
  371    HE3  LYS 104           HE1      LYS 104  15.910   2.383  -2.870
  372    HZ1  LYS 104           HZ1      LYS 104  17.560   4.094  -2.537
  373    HZ2  LYS 104           HZ2      LYS 104  17.861   3.288  -3.999
  374    HZ3  LYS 104           HZ3      LYS 104  18.814   2.958  -2.639
  375    H    ARG 105           HN       ARG 105  13.579   1.362   1.818
  376    HA   ARG 105           HA       ARG 105  15.038  -0.748   2.983
  377    HB2  ARG 105           HB2      ARG 105  14.568   0.283   5.133
  378    HB3  ARG 105           HB1      ARG 105  15.044   1.485   3.945
  379    HG2  ARG 105           HG2      ARG 105  12.668   2.071   3.638
  380    HG3  ARG 105           HG1      ARG 105  12.256   0.923   4.924
  381    HD2  ARG 105           HD2      ARG 105  13.675   2.154   6.473
  382    HD3  ARG 105           HD1      ARG 105  14.087   3.295   5.197
  383    HE   ARG 105           HE       ARG 105  11.264   3.121   5.607
  384   HH11  ARG 105          HH11      ARG 105  14.213   4.558   6.812
  385   HH12  ARG 105          HH12      ARG 105  13.408   5.892   7.576
  386   HH21  ARG 105          HH21      ARG 105  10.186   4.864   6.598
  387   HH22  ARG 105          HH22      ARG 105  11.103   6.075   7.451
  388    H    HIS 106           HN       HIS 106  11.602  -0.183   2.651
  389    HA   HIS 106           HA       HIS 106  10.839  -2.432   4.267
  390    HB2  HIS 106           HB2      HIS 106   9.286  -0.568   3.934
  391    HB3  HIS 106           HB1      HIS 106   9.281  -0.863   2.199
  392    HD1  HIS 106           HD1      HIS 106   8.000  -2.365   5.436
  393    HD2  HIS 106           HD2      HIS 106   7.706  -2.872   1.328
  394    HE1  HIS 106           HE1      HIS 106   6.098  -3.985   5.060
  395    H    GLN 107           HN       GLN 107  12.037  -2.072   1.102
  396    HA   GLN 107           HA       GLN 107  10.828  -4.477   0.048
  397    HB2  GLN 107           HB2      GLN 107  13.115  -2.852  -1.101
  398    HB3  GLN 107           HB1      GLN 107  12.123  -4.015  -1.962
  399    HG2  GLN 107           HG2      GLN 107  10.560  -1.893  -0.819
  400    HG3  GLN 107           HG1      GLN 107  11.835  -1.289  -1.872
  401   HE21  GLN 107          HE21      GLN 107   8.893  -3.069  -1.702
  402   HE22  GLN 107          HE22      GLN 107   8.659  -3.232  -3.413
  403    H    LEU 108           HN       LEU 108  13.528  -3.305   1.704
  404    HA   LEU 108           HA       LEU 108  15.357  -5.451   1.174
  405    HB2  LEU 108           HB2      LEU 108  15.350  -3.020   2.903
  406    HB3  LEU 108           HB1      LEU 108  16.561  -4.266   3.137
  407    HG   LEU 108           HG       LEU 108  17.771  -3.618   1.357
  408   HD11  LEU 108          HD11      LEU 108  15.228  -2.918  -0.105
  409   HD12  LEU 108          HD12      LEU 108  16.122  -4.434  -0.235
  410   HD13  LEU 108          HD13      LEU 108  16.858  -2.932  -0.792
  411   HD21  LEU 108          HD21      LEU 108  16.001  -1.182   1.507
  412   HD22  LEU 108          HD22      LEU 108  17.670  -1.251   0.928
  413   HD23  LEU 108          HD23      LEU 108  17.313  -1.544   2.632
  414    H    VAL 109           HN       VAL 109  12.833  -4.864   3.390
  415    HA   VAL 109           HA       VAL 109  13.901  -6.692   5.315
  416    HB   VAL 109           HB       VAL 109  11.840  -6.369   6.508
  417   HG11  VAL 109          HG11      VAL 109  12.568  -3.782   5.171
  418   HG12  VAL 109          HG12      VAL 109  13.434  -4.492   6.540
  419   HG13  VAL 109          HG13      VAL 109  11.761  -3.962   6.730
  420   HG21  VAL 109          HG21      VAL 109  10.848  -5.075   3.993
  421   HG22  VAL 109          HG22      VAL 109   9.958  -5.148   5.520
  422   HG23  VAL 109          HG23      VAL 109  10.324  -6.633   4.640
  423    H    HIS 110           HN       HIS 110  12.055  -6.774   2.427
  424    HA   HIS 110           HA       HIS 110  10.981  -9.428   2.925
  425    HB2  HIS 110           HB2      HIS 110  10.987  -7.582   0.566
  426    HB3  HIS 110           HB1      HIS 110  10.453  -9.234   0.409
  427    HD1  HIS 110           HD1      HIS 110   8.058  -9.747   1.201
  428    HD2  HIS 110           HD2      HIS 110   9.453  -5.974   2.173
  429    HE1  HIS 110           HE1      HIS 110   6.033  -8.389   1.860
  430    H    SER 111           HN       SER 111  13.923  -8.133   1.954
  431    HA   SER 111           HA       SER 111  15.021 -10.691   1.277
  432    HB2  SER 111           HB2      SER 111  13.917  -9.965  -0.872
  433    HB3  SER 111           HB1      SER 111  15.000  -8.574  -0.895
  434    HG   SER 111           HG       SER 111  15.710 -10.441  -2.143
  435    H    GLY 112           HN       GLY 112  15.739  -9.317   3.340
  436    HA2  GLY 112           HA2      GLY 112  18.078  -7.691   2.583
  437    HA3  GLY 112           HA1      GLY 112  17.145  -7.482   4.065
  Start of MODEL   17
    1    H    LYS  58           HT1      LYS  58 -16.934  -6.702  -5.850
    2    HA   LYS  58           HA       LYS  58 -18.136  -8.218  -3.609
    3    HB2  LYS  58           HB2      LYS  58 -16.144  -9.631  -3.721
    4    HB3  LYS  58           HB1      LYS  58 -17.030  -9.688  -5.238
    5    HG2  LYS  58           HG2      LYS  58 -15.441  -8.233  -6.293
    6    HG3  LYS  58           HG1      LYS  58 -14.606  -7.971  -4.760
    7    HD2  LYS  58           HD2      LYS  58 -13.368  -9.561  -6.086
    8    HD3  LYS  58           HD1      LYS  58 -14.062 -10.383  -4.689
    9    HE2  LYS  58           HE2      LYS  58 -15.835 -11.291  -6.055
   10    HE3  LYS  58           HE1      LYS  58 -15.272 -10.376  -7.452
   11    HZ1  LYS  58           HZ1      LYS  58 -13.774 -12.537  -6.066
   12    HZ2  LYS  58           HZ2      LYS  58 -13.196 -11.636  -7.378
   13    HZ3  LYS  58           HZ3      LYS  58 -14.536 -12.660  -7.579
   14    HA   PRO  59           HA       PRO  59 -16.047  -5.384  -1.011
   15    HB2  PRO  59           HB2      PRO  59 -15.461  -7.596   0.835
   16    HB3  PRO  59           HB1      PRO  59 -16.475  -6.170   1.077
   17    HG2  PRO  59           HG2      PRO  59 -17.520  -8.630   0.790
   18    HG3  PRO  59           HG1      PRO  59 -18.338  -7.180   0.173
   19    HD2  PRO  59           HD2      PRO  59 -16.719  -9.221  -1.307
   20    HD3  PRO  59           HD1      PRO  59 -18.214  -8.403  -1.783
   21    H    TYR  60           HN       TYR  60 -14.207  -4.664  -1.595
   22    HA   TYR  60           HA       TYR  60 -11.773  -6.298  -1.271
   23    HB2  TYR  60           HB2      TYR  60 -12.240  -3.691  -2.736
   24    HB3  TYR  60           HB1      TYR  60 -10.642  -4.372  -2.449
   25    HD1  TYR  60           HD2      TYR  60 -10.981  -7.180  -2.984
   26    HD2  TYR  60           HD1      TYR  60 -12.637  -3.828  -5.004
   27    HE1  TYR  60           HE2      TYR  60 -11.092  -8.490  -5.049
   28    HE2  TYR  60           HE1      TYR  60 -12.750  -5.128  -7.076
   29    HH   TYR  60           HH       TYR  60 -11.476  -7.170  -8.049
   30    H    GLY  61           HN       GLY  61 -11.101  -6.108   0.807
   31    HA2  GLY  61           HA2      GLY  61 -11.662  -3.533   2.081
   32    HA3  GLY  61           HA1      GLY  61 -11.782  -5.074   2.915
   33    H    CYS  62           HN       CYS  62 -10.347  -2.662   3.478
   34    HA   CYS  62           HA       CYS  62  -7.545  -3.213   3.393
   35    HB2  CYS  62           HB2      CYS  62  -8.920  -1.007   3.974
   36    HB3  CYS  62           HB1      CYS  62  -8.811  -1.647   5.604
   37    H    GLU  63           HN       GLU  63  -7.066  -5.242   4.218
   38    HA   GLU  63           HA       GLU  63  -8.384  -6.332   6.494
   39    HB2  GLU  63           HB2      GLU  63  -7.119  -7.559   4.607
   40    HB3  GLU  63           HB1      GLU  63  -5.667  -7.189   5.526
   41    HG2  GLU  63           HG2      GLU  63  -6.467  -9.414   6.033
   42    HG3  GLU  63           HG1      GLU  63  -6.574  -8.362   7.447
   43    H    GLU  64           HN       GLU  64  -6.276  -3.890   6.165
   44    HA   GLU  64           HA       GLU  64  -4.571  -4.195   8.420
   45    HB2  GLU  64           HB2      GLU  64  -3.591  -2.805   6.898
   46    HB3  GLU  64           HB1      GLU  64  -5.128  -2.199   6.304
   47    HG2  GLU  64           HG2      GLU  64  -5.231  -0.990   8.590
   48    HG3  GLU  64           HG1      GLU  64  -3.482  -1.257   8.599
   49    H    CYS  65           HN       CYS  65  -7.599  -2.452   7.716
   50    HA   CYS  65           HA       CYS  65  -7.737  -1.750  10.560
   51    HB2  CYS  65           HB2      CYS  65  -8.936   0.353   9.751
   52    HB3  CYS  65           HB1      CYS  65  -7.199   0.274   9.448
   53    H    GLY  66           HN       GLY  66  -9.252  -2.969   7.752
   54    HA2  GLY  66           HA2      GLY  66 -10.847  -4.624   7.874
   55    HA3  GLY  66           HA1      GLY  66 -11.341  -4.009   9.446
   56    H    LYS  67           HN       LYS  67 -11.007  -1.945   6.638
   57    HA   LYS  67           HA       LYS  67 -13.936  -1.710   6.521
   58    HB2  LYS  67           HB2      LYS  67 -11.849   0.291   5.634
   59    HB3  LYS  67           HB1      LYS  67 -13.590   0.516   5.548
   60    HG2  LYS  67           HG2      LYS  67 -13.661   0.278   8.035
   61    HG3  LYS  67           HG1      LYS  67 -11.897   0.293   8.020
   62    HD2  LYS  67           HD2      LYS  67 -12.705   2.508   8.508
   63    HD3  LYS  67           HD1      LYS  67 -11.968   2.503   6.906
   64    HE2  LYS  67           HE2      LYS  67 -14.120   2.462   5.849
   65    HE3  LYS  67           HE1      LYS  67 -14.931   2.231   7.396
   66    HZ1  LYS  67           HZ1      LYS  67 -14.225   4.419   8.074
   67    HZ2  LYS  67           HZ2      LYS  67 -15.061   4.528   6.602
   68    HZ3  LYS  67           HZ3      LYS  67 -13.370   4.639   6.627
   69    H    SER  68           HN       SER  68 -14.886  -2.564   4.784
   70    HA   SER  68           HA       SER  68 -13.244  -3.315   2.510
   71    HB2  SER  68           HB2      SER  68 -15.999  -4.073   2.227
   72    HB3  SER  68           HB1      SER  68 -14.568  -5.102   2.394
   73    HG   SER  68           HG       SER  68 -16.262  -5.245   4.085
   74    H    TYR  69           HN       TYR  69 -13.434  -2.553   0.495
   75    HA   TYR  69           HA       TYR  69 -15.472  -0.476   0.020
   76    HB2  TYR  69           HB2      TYR  69 -12.628  -0.719  -0.935
   77    HB3  TYR  69           HB1      TYR  69 -13.792   0.294  -1.781
   78    HD1  TYR  69           HD2      TYR  69 -12.182  -0.269   1.504
   79    HD2  TYR  69           HD1      TYR  69 -14.294   2.435  -0.998
   80    HE1  TYR  69           HE2      TYR  69 -11.736   1.536   3.097
   81    HE2  TYR  69           HE1      TYR  69 -13.849   4.262   0.585
   82    HH   TYR  69           HH       TYR  69 -13.295   4.602   2.914
   83    H    ARG  70           HN       ARG  70 -15.953  -0.231  -2.396
   84    HA   ARG  70           HA       ARG  70 -16.756  -2.867  -3.305
   85    HB2  ARG  70           HB2      ARG  70 -17.391  -0.157  -4.485
   86    HB3  ARG  70           HB1      ARG  70 -18.148  -1.682  -4.923
   87    HG2  ARG  70           HG2      ARG  70 -19.022  -1.857  -2.615
   88    HG3  ARG  70           HG1      ARG  70 -18.351  -0.260  -2.281
   89    HD2  ARG  70           HD2      ARG  70 -20.482  -0.963  -4.295
   90    HD3  ARG  70           HD1      ARG  70 -20.686  -0.026  -2.817
   91    HE   ARG  70           HE       ARG  70 -19.041   1.582  -3.972
   92   HH11  ARG  70          HH11      ARG  70 -21.553  -0.276  -5.557
   93   HH12  ARG  70          HH12      ARG  70 -21.622   0.767  -6.950
   94   HH21  ARG  70          HH21      ARG  70 -19.140   2.963  -5.776
   95   HH22  ARG  70          HH22      ARG  70 -20.242   2.613  -7.077
   96    H    LEU  71           HN       LEU  71 -14.774  -0.147  -4.448
   97    HA   LEU  71           HA       LEU  71 -13.991  -1.772  -6.764
   98    HB2  LEU  71           HB2      LEU  71 -13.604   1.193  -6.317
   99    HB3  LEU  71           HB1      LEU  71 -13.181   0.305  -7.771
  100    HG   LEU  71           HG       LEU  71 -15.123   1.088  -8.534
  101   HD11  LEU  71          HD11      LEU  71 -15.592  -1.305  -8.294
  102   HD12  LEU  71          HD12      LEU  71 -17.051  -0.317  -8.200
  103   HD13  LEU  71          HD13      LEU  71 -16.336  -0.975  -6.726
  104   HD21  LEU  71          HD21      LEU  71 -16.910   2.010  -7.242
  105   HD22  LEU  71          HD22      LEU  71 -15.372   2.588  -6.600
  106   HD23  LEU  71          HD23      LEU  71 -16.253   1.307  -5.769
  107    H    ILE  72           HN       ILE  72 -11.730  -1.752  -7.409
  108    HA   ILE  72           HA       ILE  72  -9.943  -2.106  -5.255
  109    HB   ILE  72           HB       ILE  72  -9.409  -1.787  -8.208
  110   HG12  ILE  72          HG12      ILE  72 -10.616  -3.814  -7.383
  111   HG13  ILE  72          HG11      ILE  72  -9.079  -4.176  -8.162
  112   HG21  ILE  72          HG21      ILE  72  -7.460  -2.476  -6.011
  113   HG22  ILE  72          HG22      ILE  72  -7.434  -1.032  -7.023
  114   HG23  ILE  72          HG23      ILE  72  -7.136  -2.616  -7.739
  115   HD11  ILE  72          HD11      ILE  72  -9.542  -4.016  -5.191
  116   HD12  ILE  72          HD12      ILE  72  -8.029  -4.446  -5.993
  117   HD13  ILE  72          HD13      ILE  72  -9.434  -5.502  -6.138
  118    H    SER  73           HN       SER  73 -10.300   0.569  -7.597
  119    HA   SER  73           HA       SER  73  -8.194   2.103  -6.520
  120    HB2  SER  73           HB2      SER  73  -9.263   2.405  -8.804
  121    HB3  SER  73           HB1      SER  73 -10.585   3.232  -7.981
  122    HG   SER  73           HG       SER  73  -9.295   4.896  -7.514
  123    H    LEU  74           HN       LEU  74 -11.559   1.805  -5.674
  124    HA   LEU  74           HA       LEU  74 -11.877   3.899  -3.911
  125    HB2  LEU  74           HB2      LEU  74 -13.112   1.367  -4.505
  126    HB3  LEU  74           HB1      LEU  74 -13.050   1.599  -2.762
  127    HG   LEU  74           HG       LEU  74 -14.400   3.355  -4.794
  128   HD11  LEU  74          HD11      LEU  74 -15.406   1.829  -2.393
  129   HD12  LEU  74          HD12      LEU  74 -15.658   1.384  -4.083
  130   HD13  LEU  74          HD13      LEU  74 -16.378   2.860  -3.440
  131   HD21  LEU  74          HD21      LEU  74 -14.980   4.679  -2.712
  132   HD22  LEU  74          HD22      LEU  74 -13.338   4.829  -3.346
  133   HD23  LEU  74          HD23      LEU  74 -13.647   3.806  -1.945
  134    H    LEU  75           HN       LEU  75 -10.859   0.643  -3.228
  135    HA   LEU  75           HA       LEU  75 -10.170   1.107  -0.526
  136    HB2  LEU  75           HB2      LEU  75 -10.781  -1.062  -1.085
  137    HB3  LEU  75           HB1      LEU  75  -9.809  -1.059  -2.548
  138    HG   LEU  75           HG       LEU  75  -7.790  -1.024  -0.980
  139   HD11  LEU  75          HD11      LEU  75  -8.176  -2.001   1.218
  140   HD12  LEU  75          HD12      LEU  75  -9.918  -1.947   0.941
  141   HD13  LEU  75          HD13      LEU  75  -8.994  -0.447   1.057
  142   HD21  LEU  75          HD21      LEU  75  -7.934  -3.471  -0.775
  143   HD22  LEU  75          HD22      LEU  75  -8.412  -2.865  -2.367
  144   HD23  LEU  75          HD23      LEU  75  -9.648  -3.371  -1.206
  145    H    ASN  76           HN       ASN  76  -8.638   1.374  -3.550
  146    HA   ASN  76           HA       ASN  76  -5.918   1.324  -2.706
  147    HB2  ASN  76           HB2      ASN  76  -7.293   1.371  -5.126
  148    HB3  ASN  76           HB1      ASN  76  -6.454   2.921  -5.085
  149   HD21  ASN  76          HD21      ASN  76  -6.136   0.385  -6.645
  150   HD22  ASN  76          HD22      ASN  76  -4.445   0.001  -6.493
  151    H    LEU  77           HN       LEU  77  -8.390   3.784  -3.143
  152    HA   LEU  77           HA       LEU  77  -6.608   5.944  -2.544
  153    HB2  LEU  77           HB2      LEU  77  -9.461   5.568  -3.211
  154    HB3  LEU  77           HB1      LEU  77  -9.061   6.993  -2.275
  155    HG   LEU  77           HG       LEU  77  -9.146   7.134  -4.865
  156   HD11  LEU  77          HD11      LEU  77  -6.834   8.186  -3.261
  157   HD12  LEU  77          HD12      LEU  77  -8.436   8.908  -3.376
  158   HD13  LEU  77          HD13      LEU  77  -7.394   8.845  -4.800
  159   HD21  LEU  77          HD21      LEU  77  -7.690   5.215  -5.306
  160   HD22  LEU  77          HD22      LEU  77  -6.371   6.028  -4.464
  161   HD23  LEU  77          HD23      LEU  77  -7.013   6.708  -5.959
  162    H    HIS  78           HN       HIS  78  -8.698   3.809  -0.829
  163    HA   HIS  78           HA       HIS  78  -8.650   5.178   1.663
  164    HB2  HIS  78           HB2      HIS  78 -10.264   3.417   1.343
  165    HB3  HIS  78           HB1      HIS  78  -8.996   2.253   0.947
  166    HD1  HIS  78           HD1      HIS  78 -10.811   3.757   3.831
  167    HD2  HIS  78           HD2      HIS  78  -7.509   1.318   3.148
  168    HE1  HIS  78           HE1      HIS  78 -10.199   2.737   6.065
  169    H    LYS  79           HN       LYS  79  -6.587   2.810   0.093
  170    HA   LYS  79           HA       LYS  79  -4.776   2.477   2.278
  171    HB2  LYS  79           HB2      LYS  79  -5.171   0.871   0.335
  172    HB3  LYS  79           HB1      LYS  79  -4.221   1.974  -0.653
  173    HG2  LYS  79           HG2      LYS  79  -2.729   0.302   0.011
  174    HG3  LYS  79           HG1      LYS  79  -2.370   1.677   1.055
  175    HD2  LYS  79           HD2      LYS  79  -2.397  -0.381   2.347
  176    HD3  LYS  79           HD1      LYS  79  -3.734   0.664   2.833
  177    HE2  LYS  79           HE2      LYS  79  -5.292  -0.644   1.558
  178    HE3  LYS  79           HE1      LYS  79  -3.992  -1.605   0.861
  179    HZ1  LYS  79           HZ1      LYS  79  -3.488  -2.438   3.091
  180    HZ2  LYS  79           HZ2      LYS  79  -5.075  -2.815   2.620
  181    HZ3  LYS  79           HZ3      LYS  79  -4.794  -1.557   3.718
  182    H    LYS  80           HN       LYS  80  -4.860   4.378  -0.677
  183    HA   LYS  80           HA       LYS  80  -2.481   5.804  -0.415
  184    HB2  LYS  80           HB2      LYS  80  -3.676   5.987  -2.458
  185    HB3  LYS  80           HB1      LYS  80  -5.152   6.484  -1.647
  186    HG2  LYS  80           HG2      LYS  80  -4.241   8.635  -1.176
  187    HG3  LYS  80           HG1      LYS  80  -2.649   8.150  -1.732
  188    HD2  LYS  80           HD2      LYS  80  -5.026   8.046  -3.550
  189    HD3  LYS  80           HD1      LYS  80  -4.142   9.553  -3.295
  190    HE2  LYS  80           HE2      LYS  80  -2.082   8.482  -4.017
  191    HE3  LYS  80           HE1      LYS  80  -2.939   6.957  -4.228
  192    HZ1  LYS  80           HZ1      LYS  80  -4.064   7.744  -6.081
  193    HZ2  LYS  80           HZ2      LYS  80  -2.532   8.450  -6.269
  194    HZ3  LYS  80           HZ3      LYS  80  -3.825   9.371  -5.671
  195    H    ARG  81           HN       ARG  81  -5.683   6.356   1.003
  196    HA   ARG  81           HA       ARG  81  -5.220   8.878   2.109
  197    HB2  ARG  81           HB2      ARG  81  -7.415   7.609   1.984
  198    HB3  ARG  81           HB1      ARG  81  -6.893   6.734   3.418
  199    HG2  ARG  81           HG2      ARG  81  -8.322   8.496   4.122
  200    HG3  ARG  81           HG1      ARG  81  -6.674   8.932   4.582
  201    HD2  ARG  81           HD2      ARG  81  -7.756  10.870   3.656
  202    HD3  ARG  81           HD1      ARG  81  -6.522  10.312   2.523
  203    HE   ARG  81           HE       ARG  81  -9.198   9.312   2.046
  204   HH11  ARG  81          HH11      ARG  81  -6.800  11.745   1.246
  205   HH12  ARG  81          HH12      ARG  81  -7.598  12.215  -0.221
  206   HH21  ARG  81          HH21      ARG  81 -10.227   9.910   0.125
  207   HH22  ARG  81          HH22      ARG  81  -9.565  11.194  -0.852
  208    H    HIS  82           HN       HIS  82  -4.610   5.671   3.523
  209    HA   HIS  82           HA       HIS  82  -3.743   6.600   6.044
  210    HB2  HIS  82           HB2      HIS  82  -3.276   4.020   4.566
  211    HB3  HIS  82           HB1      HIS  82  -2.590   4.314   6.143
  212    HD1  HIS  82           HD1      HIS  82  -4.270   4.335   8.166
  213    HD2  HIS  82           HD2      HIS  82  -5.885   3.389   4.459
  214    HE1  HIS  82           HE1      HIS  82  -6.496   3.222   8.614
  215    H    SER  83           HN       SER  83  -2.076   6.106   2.992
  216    HA   SER  83           HA       SER  83   0.509   6.555   4.304
  217    HB2  SER  83           HB2      SER  83  -0.027   5.649   1.469
  218    HB3  SER  83           HB1      SER  83   1.510   5.592   2.332
  219    HG   SER  83           HG       SER  83  -0.759   3.971   2.606
  220    H    GLY  84           HN       GLY  84  -1.617   8.606   3.475
  221    HA2  GLY  84           HA2      GLY  84  -1.478  10.827   2.798
  222    HA3  GLY  84           HA1      GLY  84   0.218  10.561   2.409
  223    H    GLU  85           HN       GLU  85   0.499   8.970   0.499
  224    HA   GLU  85           HA       GLU  85  -1.637   8.971  -1.420
  225    HB2  GLU  85           HB2      GLU  85  -0.583  10.178  -3.157
  226    HB3  GLU  85           HB1      GLU  85  -0.447  11.189  -1.735
  227    HG2  GLU  85           HG2      GLU  85   1.874  10.155  -1.459
  228    HG3  GLU  85           HG1      GLU  85   1.658   9.614  -3.114
  229    H    ALA  86           HN       ALA  86  -1.501   7.230  -2.700
  230    HA   ALA  86           HA       ALA  86   0.496   5.286  -2.029
  231    HB1  ALA  86           HB1      ALA  86  -1.806   5.115  -3.961
  232    HB2  ALA  86           HB2      ALA  86  -1.830   4.598  -2.275
  233    HB3  ALA  86           HB3      ALA  86  -0.794   3.771  -3.439
  234    H    ARG  87           HN       ARG  87   2.385   6.099  -2.848
  235    HA   ARG  87           HA       ARG  87   2.582   6.670  -5.645
  236    HB2  ARG  87           HB2      ARG  87   4.740   6.484  -3.566
  237    HB3  ARG  87           HB1      ARG  87   4.911   7.159  -5.181
  238    HG2  ARG  87           HG2      ARG  87   3.080   8.158  -3.044
  239    HG3  ARG  87           HG1      ARG  87   4.664   8.817  -3.449
  240    HD2  ARG  87           HD2      ARG  87   2.259   8.655  -5.245
  241    HD3  ARG  87           HD1      ARG  87   2.905  10.124  -4.509
  242    HE   ARG  87           HE       ARG  87   4.522   8.551  -6.409
  243   HH11  ARG  87          HH11      ARG  87   3.001  11.561  -5.445
  244   HH12  ARG  87          HH12      ARG  87   3.777  12.491  -6.699
  245   HH21  ARG  87          HH21      ARG  87   5.543   9.750  -8.023
  246   HH22  ARG  87          HH22      ARG  87   5.221  11.460  -8.176
  247    H    TYR  88           HN       TYR  88   4.951   4.856  -3.907
  248    HA   TYR  88           HA       TYR  88   5.040   2.833  -6.000
  249    HB2  TYR  88           HB2      TYR  88   6.790   3.247  -3.567
  250    HB3  TYR  88           HB1      TYR  88   7.095   2.128  -4.881
  251    HD1  TYR  88           HD1      TYR  88   6.593   5.744  -4.228
  252    HD2  TYR  88           HD2      TYR  88   8.458   2.777  -6.622
  253    HE1  TYR  88           HE1      TYR  88   7.847   7.494  -5.383
  254    HE2  TYR  88           HE2      TYR  88   9.733   4.517  -7.800
  255    HH   TYR  88           HH       TYR  88   9.648   6.883  -8.256
  256    H    ARG  89           HN       ARG  89   4.882   0.594  -5.539
  257    HA   ARG  89           HA       ARG  89   3.918  -0.056  -2.835
  258    HB2  ARG  89           HB2      ARG  89   3.370  -1.341  -5.481
  259    HB3  ARG  89           HB1      ARG  89   3.462  -2.355  -4.059
  260    HG2  ARG  89           HG2      ARG  89   1.702  -1.222  -3.021
  261    HG3  ARG  89           HG1      ARG  89   1.678   0.025  -4.279
  262    HD2  ARG  89           HD2      ARG  89   1.218  -1.891  -5.891
  263    HD3  ARG  89           HD1      ARG  89   0.847  -2.838  -4.445
  264    HE   ARG  89           HE       ARG  89  -0.559  -0.333  -5.142
  265   HH11  ARG  89          HH11      ARG  89  -0.614  -3.677  -4.072
  266   HH12  ARG  89          HH12      ARG  89  -2.300  -3.640  -3.663
  267   HH21  ARG  89          HH21      ARG  89  -2.766  -0.288  -4.605
  268   HH22  ARG  89          HH22      ARG  89  -3.531  -1.712  -3.959
  269    H    CYS  90           HN       CYS  90   4.884  -1.714  -1.822
  270    HA   CYS  90           HA       CYS  90   7.487  -2.618  -2.488
  271    HB2  CYS  90           HB2      CYS  90   6.011  -2.710  -0.276
  272    HB3  CYS  90           HB1      CYS  90   5.560  -4.256  -0.917
  273    H    GLU  91           HN       GLU  91   7.796  -3.774  -4.354
  274    HA   GLU  91           HA       GLU  91   5.763  -4.940  -5.849
  275    HB2  GLU  91           HB2      GLU  91   7.537  -5.931  -7.205
  276    HB3  GLU  91           HB1      GLU  91   7.874  -4.245  -6.821
  277    HG2  GLU  91           HG2      GLU  91   9.482  -4.806  -5.237
  278    HG3  GLU  91           HG1      GLU  91   8.951  -6.482  -5.201
  279    H    ASP  92           HN       ASP  92   6.708  -6.016  -2.951
  280    HA   ASP  92           HA       ASP  92   6.388  -8.840  -3.689
  281    HB2  ASP  92           HB2      ASP  92   7.561  -9.308  -1.495
  282    HB3  ASP  92           HB1      ASP  92   8.555  -8.579  -2.753
  283    H    CYS  93           HN       CYS  93   5.266  -6.247  -1.517
  284    HA   CYS  93           HA       CYS  93   3.288  -8.174  -0.601
  285    HB2  CYS  93           HB2      CYS  93   3.558  -7.589   1.652
  286    HB3  CYS  93           HB1      CYS  93   5.189  -7.810   1.037
  287    H    GLY  94           HN       GLY  94   3.977  -4.971  -1.671
  288    HA2  GLY  94           HA2      GLY  94   2.480  -3.753  -2.886
  289    HA3  GLY  94           HA1      GLY  94   1.149  -4.648  -2.165
  290    H    LYS  95           HN       LYS  95   3.630  -3.270  -0.189
  291    HA   LYS  95           HA       LYS  95   1.784  -1.478   1.065
  292    HB2  LYS  95           HB2      LYS  95   4.726  -1.961   1.449
  293    HB3  LYS  95           HB1      LYS  95   3.755  -0.895   2.456
  294    HG2  LYS  95           HG2      LYS  95   2.277  -2.988   2.738
  295    HG3  LYS  95           HG1      LYS  95   3.717  -3.851   2.214
  296    HD2  LYS  95           HD2      LYS  95   4.979  -3.105   4.011
  297    HD3  LYS  95           HD1      LYS  95   3.836  -1.820   4.407
  298    HE2  LYS  95           HE2      LYS  95   2.188  -3.489   5.075
  299    HE3  LYS  95           HE1      LYS  95   3.318  -4.777   4.671
  300    HZ1  LYS  95           HZ1      LYS  95   4.747  -4.141   6.424
  301    HZ2  LYS  95           HZ2      LYS  95   3.186  -4.165   7.087
  302    HZ3  LYS  95           HZ3      LYS  95   3.917  -2.685   6.688
  303    H    LEU  96           HN       LEU  96   1.768   0.724   0.925
  304    HA   LEU  96           HA       LEU  96   2.999   1.748  -1.512
  305    HB2  LEU  96           HB2      LEU  96   0.737   2.673   0.200
  306    HB3  LEU  96           HB1      LEU  96   1.415   3.708  -1.046
  307    HG   LEU  96           HG       LEU  96  -0.536   2.672  -1.946
  308   HD11  LEU  96          HD11      LEU  96   1.905   1.214  -2.935
  309   HD12  LEU  96          HD12      LEU  96   1.362   2.816  -3.459
  310   HD13  LEU  96          HD13      LEU  96   0.377   1.391  -3.806
  311   HD21  LEU  96          HD21      LEU  96   0.654   0.057  -1.056
  312   HD22  LEU  96          HD22      LEU  96  -0.801   0.229  -2.042
  313   HD23  LEU  96          HD23      LEU  96  -0.778   0.839  -0.385
  314    H    PHE  97           HN       PHE  97   4.717   2.937  -1.474
  315    HA   PHE  97           HA       PHE  97   5.200   4.630   0.900
  316    HB2  PHE  97           HB2      PHE  97   7.300   3.346  -0.863
  317    HB3  PHE  97           HB1      PHE  97   7.612   4.416   0.502
  318    HD1  PHE  97           HD2      PHE  97   6.458   1.066  -0.472
  319    HD2  PHE  97           HD1      PHE  97   7.370   3.672   2.768
  320    HE1  PHE  97           HE2      PHE  97   6.364  -0.843   1.084
  321    HE2  PHE  97           HE1      PHE  97   7.277   1.768   4.323
  322    HZ   PHE  97           HZ       PHE  97   6.773  -0.487   3.481
  323    H    THR  98           HN       THR  98   5.643   6.709   0.572
  324    HA   THR  98           HA       THR  98   4.946   7.776  -2.004
  325    HB   THR  98           HB       THR  98   4.944   9.922  -0.880
  326    HG1  THR  98           HG1      THR  98   6.011  10.253   0.964
  327   HG21  THR  98          HG21      THR  98   3.841   7.690   0.826
  328   HG22  THR  98          HG22      THR  98   3.023   8.486  -0.521
  329   HG23  THR  98          HG23      THR  98   3.366   9.387   0.960
  330    H    THR  99           HN       THR  99   7.725   6.729  -0.600
  331    HA   THR  99           HA       THR  99   9.364   8.196  -2.514
  332    HB   THR  99           HB       THR  99   9.794   7.954   0.454
  333    HG1  THR  99           HG1      THR  99   8.881   9.879  -0.795
  334   HG21  THR  99          HG21      THR  99  11.959   8.723  -1.478
  335   HG22  THR  99          HG22      THR  99  11.772   7.094  -0.831
  336   HG23  THR  99          HG23      THR  99  12.089   8.441   0.262
  337    H    SER 100           HN       SER 100  10.666   6.866  -3.608
  338    HA   SER 100           HA       SER 100  10.412   4.074  -3.373
  339    HB2  SER 100           HB2      SER 100  12.268   4.085  -5.116
  340    HB3  SER 100           HB1      SER 100  10.797   4.976  -5.534
  341    HG   SER 100           HG       SER 100  13.043   5.994  -5.786
  342    H    GLY 101           HN       GLY 101  12.727   6.342  -2.098
  343    HA2  GLY 101           HA2      GLY 101  14.697   4.433  -1.354
  344    HA3  GLY 101           HA1      GLY 101  14.510   6.036  -0.682
  345    H    ASN 102           HN       ASN 102  11.995   5.909   0.467
  346    HA   ASN 102           HA       ASN 102  12.328   4.423   2.828
  347    HB2  ASN 102           HB2      ASN 102   9.818   5.482   1.518
  348    HB3  ASN 102           HB1      ASN 102   9.846   4.737   3.106
  349   HD21  ASN 102          HD21      ASN 102  10.991   5.798   4.796
  350   HD22  ASN 102          HD22      ASN 102  11.256   7.507   4.732
  351    H    LEU 103           HN       LEU 103  10.720   3.851  -0.205
  352    HA   LEU 103           HA       LEU 103   9.457   1.467   0.439
  353    HB2  LEU 103           HB2      LEU 103   8.818   2.554  -1.531
  354    HB3  LEU 103           HB1      LEU 103  10.483   2.724  -2.078
  355    HG   LEU 103           HG       LEU 103  10.523   0.219  -2.374
  356   HD11  LEU 103          HD11      LEU 103   7.541   0.366  -2.399
  357   HD12  LEU 103          HD12      LEU 103   8.412   0.046  -0.885
  358   HD13  LEU 103          HD13      LEU 103   8.614  -1.048  -2.256
  359   HD21  LEU 103          HD21      LEU 103   8.580   1.880  -3.930
  360   HD22  LEU 103          HD22      LEU 103   9.272   0.345  -4.471
  361   HD23  LEU 103          HD23      LEU 103  10.314   1.750  -4.207
  362    H    LYS 104           HN       LYS 104  12.536   2.206  -1.040
  363    HA   LYS 104           HA       LYS 104  13.611  -0.257  -1.508
  364    HB2  LYS 104           HB2      LYS 104  14.511   1.882  -2.254
  365    HB3  LYS 104           HB1      LYS 104  14.938   2.299  -0.604
  366    HG2  LYS 104           HG2      LYS 104  16.661   0.724  -0.535
  367    HG3  LYS 104           HG1      LYS 104  16.081  -0.098  -1.995
  368    HD2  LYS 104           HD2      LYS 104  18.020   1.258  -2.537
  369    HD3  LYS 104           HD1      LYS 104  16.578   1.928  -3.299
  370    HE2  LYS 104           HE2      LYS 104  17.686   3.797  -2.447
  371    HE3  LYS 104           HE1      LYS 104  16.430   3.463  -1.258
  372    HZ1  LYS 104           HZ1      LYS 104  18.528   3.950  -0.186
  373    HZ2  LYS 104           HZ2      LYS 104  19.293   2.695  -1.034
  374    HZ3  LYS 104           HZ3      LYS 104  18.098   2.336   0.110
  375    H    ARG 105           HN       ARG 105  13.878   1.656   1.514
  376    HA   ARG 105           HA       ARG 105  15.435  -0.115   2.993
  377    HB2  ARG 105           HB2      ARG 105  13.119   1.598   3.934
  378    HB3  ARG 105           HB1      ARG 105  14.295   0.839   4.997
  379    HG2  ARG 105           HG2      ARG 105  14.996   2.846   2.872
  380    HG3  ARG 105           HG1      ARG 105  14.688   3.251   4.564
  381    HD2  ARG 105           HD2      ARG 105  16.503   1.694   5.210
  382    HD3  ARG 105           HD1      ARG 105  16.848   1.440   3.501
  383    HE   ARG 105           HE       ARG 105  16.909   4.189   3.970
  384   HH11  ARG 105          HH11      ARG 105  18.678   1.317   4.937
  385   HH12  ARG 105          HH12      ARG 105  20.191   2.156   5.122
  386   HH21  ARG 105          HH21      ARG 105  18.900   5.296   4.215
  387   HH22  ARG 105          HH22      ARG 105  20.315   4.418   4.734
  388    H    HIS 106           HN       HIS 106  11.974  -0.001   2.511
  389    HA   HIS 106           HA       HIS 106  11.390  -2.252   4.155
  390    HB2  HIS 106           HB2      HIS 106   9.795  -0.417   3.775
  391    HB3  HIS 106           HB1      HIS 106   9.705  -0.855   2.069
  392    HD1  HIS 106           HD1      HIS 106   8.416  -1.837   5.439
  393    HD2  HIS 106           HD2      HIS 106   8.307  -3.125   1.502
  394    HE1  HIS 106           HE1      HIS 106   6.599  -3.595   5.323
  395    H    GLN 107           HN       GLN 107  12.571  -1.951   0.973
  396    HA   GLN 107           HA       GLN 107  11.406  -4.407  -0.020
  397    HB2  GLN 107           HB2      GLN 107  13.657  -2.740  -1.173
  398    HB3  GLN 107           HB1      GLN 107  12.753  -3.991  -2.013
  399    HG2  GLN 107           HG2      GLN 107  11.119  -1.829  -0.958
  400    HG3  GLN 107           HG1      GLN 107  12.315  -1.333  -2.151
  401   HE21  GLN 107          HE21      GLN 107   9.439  -3.114  -1.566
  402   HE22  GLN 107          HE22      GLN 107   9.096  -3.511  -3.217
  403    H    LEU 108           HN       LEU 108  14.159  -3.139   1.518
  404    HA   LEU 108           HA       LEU 108  15.975  -5.294   1.032
  405    HB2  LEU 108           HB2      LEU 108  15.968  -2.861   2.754
  406    HB3  LEU 108           HB1      LEU 108  17.206  -4.086   2.954
  407    HG   LEU 108           HG       LEU 108  18.342  -3.440   1.106
  408   HD11  LEU 108          HD11      LEU 108  16.533  -4.133  -0.411
  409   HD12  LEU 108          HD12      LEU 108  17.361  -2.675  -0.960
  410   HD13  LEU 108          HD13      LEU 108  15.774  -2.555  -0.190
  411   HD21  LEU 108          HD21      LEU 108  16.609  -1.023   1.548
  412   HD22  LEU 108          HD22      LEU 108  18.190  -1.042   0.754
  413   HD23  LEU 108          HD23      LEU 108  18.058  -1.443   2.469
  414    H    VAL 109           HN       VAL 109  13.521  -4.626   3.328
  415    HA   VAL 109           HA       VAL 109  14.601  -6.429   5.247
  416    HB   VAL 109           HB       VAL 109  12.546  -6.153   6.435
  417   HG11  VAL 109          HG11      VAL 109  14.034  -4.213   6.445
  418   HG12  VAL 109          HG12      VAL 109  12.342  -3.730   6.567
  419   HG13  VAL 109          HG13      VAL 109  13.190  -3.579   5.028
  420   HG21  VAL 109          HG21      VAL 109  11.011  -6.535   4.629
  421   HG22  VAL 109          HG22      VAL 109  11.484  -5.006   3.885
  422   HG23  VAL 109          HG23      VAL 109  10.615  -5.007   5.426
  423    H    HIS 110           HN       HIS 110  12.724  -6.628   2.361
  424    HA   HIS 110           HA       HIS 110  11.864  -9.367   2.921
  425    HB2  HIS 110           HB2      HIS 110  11.561  -7.559   0.541
  426    HB3  HIS 110           HB1      HIS 110  11.045  -9.223   0.522
  427    HD1  HIS 110           HD1      HIS 110   8.775  -9.741   1.637
  428    HD2  HIS 110           HD2      HIS 110  10.142  -5.866   2.112
  429    HE1  HIS 110           HE1      HIS 110   6.790  -8.372   2.407
  430    H    SER 111           HN       SER 111  14.655  -7.896   1.909
  431    HA   SER 111           HA       SER 111  15.754 -10.390   0.939
  432    HB2  SER 111           HB2      SER 111  16.734  -9.179  -1.095
  433    HB3  SER 111           HB1      SER 111  15.022  -9.586  -1.173
  434    HG   SER 111           HG       SER 111  14.633  -7.382  -0.424
  435    H    GLY 112           HN       GLY 112  16.231  -9.170   3.277
  436    HA2  GLY 112           HA2      GLY 112  18.970  -8.174   3.002
  437    HA3  GLY 112           HA1      GLY 112  17.780  -7.167   3.839
  Start of MODEL   18
    1    H    LYS  58           HT1      LYS  58 -15.221  -7.575  -7.439
    2    HA   LYS  58           HA       LYS  58 -14.335  -8.896  -5.587
    3    HB2  LYS  58           HB2      LYS  58 -12.377  -7.128  -7.067
    4    HB3  LYS  58           HB1      LYS  58 -11.917  -8.563  -6.164
    5    HG2  LYS  58           HG2      LYS  58 -13.352  -9.912  -7.662
    6    HG3  LYS  58           HG1      LYS  58 -13.678  -8.454  -8.603
    7    HD2  LYS  58           HD2      LYS  58 -11.299  -8.219  -9.088
    8    HD3  LYS  58           HD1      LYS  58 -10.946  -9.646  -8.114
    9    HE2  LYS  58           HE2      LYS  58 -12.585  -9.558 -10.645
   10    HE3  LYS  58           HE1      LYS  58 -10.955 -10.208 -10.474
   11    HZ1  LYS  58           HZ1      LYS  58 -11.908 -11.813  -8.838
   12    HZ2  LYS  58           HZ2      LYS  58 -12.452 -12.020 -10.431
   13    HZ3  LYS  58           HZ3      LYS  58 -13.454 -11.277  -9.288
   14    HA   PRO  59           HA       PRO  59 -13.615  -6.533  -1.888
   15    HB2  PRO  59           HB2      PRO  59 -12.295  -8.954  -0.884
   16    HB3  PRO  59           HB1      PRO  59 -13.733  -8.129  -0.279
   17    HG2  PRO  59           HG2      PRO  59 -13.862 -10.514  -1.535
   18    HG3  PRO  59           HG1      PRO  59 -15.153  -9.303  -1.655
   19    HD2  PRO  59           HD2      PRO  59 -13.013  -9.996  -3.625
   20    HD3  PRO  59           HD1      PRO  59 -14.705  -9.557  -3.899
   21    H    TYR  60           HN       TYR  60 -12.095  -5.115  -2.007
   22    HA   TYR  60           HA       TYR  60  -9.286  -6.012  -1.970
   23    HB2  TYR  60           HB2      TYR  60 -10.381  -3.401  -3.050
   24    HB3  TYR  60           HB1      TYR  60  -8.677  -3.851  -2.975
   25    HD1  TYR  60           HD2      TYR  60  -8.368  -6.377  -4.058
   26    HD2  TYR  60           HD1      TYR  60 -11.218  -3.429  -5.171
   27    HE1  TYR  60           HE2      TYR  60  -8.492  -7.352  -6.302
   28    HE2  TYR  60           HE1      TYR  60 -11.346  -4.394  -7.419
   29    HH   TYR  60           HH       TYR  60  -9.964  -5.754  -8.920
   30    H    GLY  61           HN       GLY  61  -9.255  -6.135   0.269
   31    HA2  GLY  61           HA2      GLY  61 -10.197  -3.761   1.694
   32    HA3  GLY  61           HA1      GLY  61 -10.132  -5.383   2.364
   33    H    CYS  62           HN       CYS  62  -9.036  -2.756   3.129
   34    HA   CYS  62           HA       CYS  62  -6.197  -2.984   3.163
   35    HB2  CYS  62           HB2      CYS  62  -8.065  -1.091   3.933
   36    HB3  CYS  62           HB1      CYS  62  -7.445  -1.670   5.466
   37    H    GLU  63           HN       GLU  63  -5.512  -4.983   3.950
   38    HA   GLU  63           HA       GLU  63  -6.838  -6.398   5.998
   39    HB2  GLU  63           HB2      GLU  63  -4.006  -6.682   5.003
   40    HB3  GLU  63           HB1      GLU  63  -4.866  -7.853   5.986
   41    HG2  GLU  63           HG2      GLU  63  -5.605  -6.991   3.202
   42    HG3  GLU  63           HG1      GLU  63  -4.852  -8.519   3.653
   43    H    GLU  64           HN       GLU  64  -5.089  -3.645   6.237
   44    HA   GLU  64           HA       GLU  64  -3.791  -4.197   8.763
   45    HB2  GLU  64           HB2      GLU  64  -3.440  -1.619   8.582
   46    HB3  GLU  64           HB1      GLU  64  -2.505  -2.707   7.573
   47    HG2  GLU  64           HG2      GLU  64  -3.647  -2.135   5.669
   48    HG3  GLU  64           HG1      GLU  64  -5.078  -1.610   6.563
   49    H    CYS  65           HN       CYS  65  -6.663  -2.499   7.576
   50    HA   CYS  65           HA       CYS  65  -7.291  -1.795  10.364
   51    HB2  CYS  65           HB2      CYS  65  -8.625   0.127   9.132
   52    HB3  CYS  65           HB1      CYS  65  -6.903   0.308   9.485
   53    H    GLY  66           HN       GLY  66  -8.060  -3.503   7.661
   54    HA2  GLY  66           HA2      GLY  66  -9.613  -5.116   7.436
   55    HA3  GLY  66           HA1      GLY  66 -10.313  -4.610   8.966
   56    H    LYS  67           HN       LYS  67  -9.896  -2.299   6.419
   57    HA   LYS  67           HA       LYS  67 -12.802  -2.327   5.983
   58    HB2  LYS  67           HB2      LYS  67 -10.773  -0.159   5.386
   59    HB3  LYS  67           HB1      LYS  67 -12.491  -0.055   5.031
   60    HG2  LYS  67           HG2      LYS  67 -12.952  -0.298   7.459
   61    HG3  LYS  67           HG1      LYS  67 -11.213  -0.233   7.748
   62    HD2  LYS  67           HD2      LYS  67 -11.896   1.965   8.099
   63    HD3  LYS  67           HD1      LYS  67 -11.293   1.989   6.445
   64    HE2  LYS  67           HE2      LYS  67 -14.196   1.707   7.213
   65    HE3  LYS  67           HE1      LYS  67 -13.428   3.222   6.757
   66    HZ1  LYS  67           HZ1      LYS  67 -13.827   0.830   5.043
   67    HZ2  LYS  67           HZ2      LYS  67 -12.890   2.168   4.589
   68    HZ3  LYS  67           HZ3      LYS  67 -14.549   2.352   4.863
   69    H    SER  68           HN       SER  68 -13.330  -3.552   4.278
   70    HA   SER  68           HA       SER  68 -11.478  -3.788   2.052
   71    HB2  SER  68           HB2      SER  68 -14.108  -5.101   1.823
   72    HB3  SER  68           HB1      SER  68 -12.486  -5.755   1.575
   73    HG   SER  68           HG       SER  68 -14.007  -6.230   3.612
   74    H    TYR  69           HN       TYR  69 -11.851  -3.087   0.005
   75    HA   TYR  69           HA       TYR  69 -14.242  -1.407  -0.355
   76    HB2  TYR  69           HB2      TYR  69 -11.403  -0.910  -1.202
   77    HB3  TYR  69           HB1      TYR  69 -12.750  -0.103  -1.992
   78    HD1  TYR  69           HD2      TYR  69 -11.204  -0.687   1.339
   79    HD2  TYR  69           HD1      TYR  69 -13.649   1.810  -1.062
   80    HE1  TYR  69           HE2      TYR  69 -11.233   0.984   3.127
   81    HE2  TYR  69           HE1      TYR  69 -13.684   3.503   0.714
   82    HH   TYR  69           HH       TYR  69 -13.291   3.823   2.971
   83    H    ARG  70           HN       ARG  70 -15.114  -1.250  -2.397
   84    HA   ARG  70           HA       ARG  70 -15.235  -3.727  -3.796
   85    HB2  ARG  70           HB2      ARG  70 -17.207  -2.354  -3.490
   86    HB3  ARG  70           HB1      ARG  70 -16.449  -1.009  -4.331
   87    HG2  ARG  70           HG2      ARG  70 -16.535  -2.181  -6.412
   88    HG3  ARG  70           HG1      ARG  70 -17.127  -3.645  -5.615
   89    HD2  ARG  70           HD2      ARG  70 -18.847  -2.145  -6.785
   90    HD3  ARG  70           HD1      ARG  70 -19.212  -2.681  -5.144
   91    HE   ARG  70           HE       ARG  70 -18.302  -0.426  -4.443
   92   HH11  ARG  70          HH11      ARG  70 -19.842  -0.928  -7.555
   93   HH12  ARG  70          HH12      ARG  70 -20.326   0.735  -7.719
   94   HH21  ARG  70          HH21      ARG  70 -18.946   1.726  -4.642
   95   HH22  ARG  70          HH22      ARG  70 -19.810   2.256  -6.058
   96    H    LEU  71           HN       LEU  71 -13.852  -0.557  -4.490
   97    HA   LEU  71           HA       LEU  71 -12.780  -1.565  -7.022
   98    HB2  LEU  71           HB2      LEU  71 -13.412   1.146  -5.929
   99    HB3  LEU  71           HB1      LEU  71 -12.215   0.986  -7.203
  100    HG   LEU  71           HG       LEU  71 -13.801   0.215  -8.750
  101   HD11  LEU  71          HD11      LEU  71 -16.103  -0.333  -8.229
  102   HD12  LEU  71          HD12      LEU  71 -15.790  -0.035  -6.518
  103   HD13  LEU  71          HD13      LEU  71 -14.982  -1.371  -7.342
  104   HD21  LEU  71          HD21      LEU  71 -13.903   2.618  -8.287
  105   HD22  LEU  71          HD22      LEU  71 -15.165   2.312  -7.090
  106   HD23  LEU  71          HD23      LEU  71 -15.465   1.975  -8.794
  107    H    ILE  72           HN       ILE  72 -10.606  -1.292  -7.538
  108    HA   ILE  72           HA       ILE  72  -8.706  -1.381  -5.430
  109    HB   ILE  72           HB       ILE  72  -8.423  -1.033  -8.410
  110   HG12  ILE  72          HG12      ILE  72  -8.959  -3.255  -7.359
  111   HG13  ILE  72          HG11      ILE  72  -7.495  -3.237  -8.338
  112   HG21  ILE  72          HG21      ILE  72  -6.004  -1.122  -8.177
  113   HG22  ILE  72          HG22      ILE  72  -6.162  -1.096  -6.422
  114   HG23  ILE  72          HG23      ILE  72  -6.655   0.306  -7.372
  115   HD11  ILE  72          HD11      ILE  72  -7.598  -3.043  -5.333
  116   HD12  ILE  72          HD12      ILE  72  -6.139  -3.089  -6.325
  117   HD13  ILE  72          HD13      ILE  72  -7.204  -4.494  -6.260
  118    H    SER  73           HN       SER  73  -9.813   1.145  -7.628
  119    HA   SER  73           HA       SER  73  -8.051   3.146  -6.689
  120    HB2  SER  73           HB2      SER  73  -9.758   4.685  -7.799
  121    HB3  SER  73           HB1      SER  73  -9.033   3.453  -8.835
  122    HG   SER  73           HG       SER  73 -11.589   3.854  -8.407
  123    H    LEU  74           HN       LEU  74 -11.159   2.007  -5.648
  124    HA   LEU  74           HA       LEU  74 -11.832   3.998  -3.834
  125    HB2  LEU  74           HB2      LEU  74 -12.661   1.345  -4.550
  126    HB3  LEU  74           HB1      LEU  74 -12.614   1.490  -2.796
  127    HG   LEU  74           HG       LEU  74 -14.180   3.210  -4.705
  128   HD11  LEU  74          HD11      LEU  74 -15.039   1.321  -2.515
  129   HD12  LEU  74          HD12      LEU  74 -15.147   0.998  -4.247
  130   HD13  LEU  74          HD13      LEU  74 -16.104   2.295  -3.529
  131   HD21  LEU  74          HD21      LEU  74 -13.369   4.628  -3.064
  132   HD22  LEU  74          HD22      LEU  74 -13.525   3.403  -1.810
  133   HD23  LEU  74          HD23      LEU  74 -14.974   4.167  -2.483
  134    H    LEU  75           HN       LEU  75 -10.165   0.965  -3.319
  135    HA   LEU  75           HA       LEU  75  -9.528   1.449  -0.598
  136    HB2  LEU  75           HB2      LEU  75  -9.623  -0.791  -1.240
  137    HB3  LEU  75           HB1      LEU  75  -8.707  -0.499  -2.715
  138    HG   LEU  75           HG       LEU  75  -6.732  -0.012  -1.147
  139   HD11  LEU  75          HD11      LEU  75  -8.007   0.117   0.926
  140   HD12  LEU  75          HD12      LEU  75  -6.809  -1.177   0.991
  141   HD13  LEU  75          HD13      LEU  75  -8.513  -1.564   0.728
  142   HD21  LEU  75          HD21      LEU  75  -6.208  -2.394  -1.118
  143   HD22  LEU  75          HD22      LEU  75  -6.928  -1.875  -2.650
  144   HD23  LEU  75          HD23      LEU  75  -7.907  -2.759  -1.466
  145    H    ASN  76           HN       ASN  76  -8.178   2.176  -3.644
  146    HA   ASN  76           HA       ASN  76  -5.513   2.751  -2.964
  147    HB2  ASN  76           HB2      ASN  76  -7.028   2.760  -5.241
  148    HB3  ASN  76           HB1      ASN  76  -6.751   4.485  -4.988
  149   HD21  ASN  76          HD21      ASN  76  -5.364   1.420  -5.698
  150   HD22  ASN  76          HD22      ASN  76  -3.803   1.995  -6.214
  151    H    LEU  77           HN       LEU  77  -8.456   4.703  -3.038
  152    HA   LEU  77           HA       LEU  77  -7.119   7.054  -2.118
  153    HB2  LEU  77           HB2      LEU  77  -9.864   6.248  -2.866
  154    HB3  LEU  77           HB1      LEU  77  -9.708   7.605  -1.774
  155    HG   LEU  77           HG       LEU  77  -9.900   8.194  -4.206
  156   HD11  LEU  77          HD11      LEU  77  -8.986   9.713  -2.541
  157   HD12  LEU  77          HD12      LEU  77  -8.172   9.905  -4.093
  158   HD13  LEU  77          HD13      LEU  77  -7.384   9.021  -2.786
  159   HD21  LEU  77          HD21      LEU  77  -7.921   7.963  -5.609
  160   HD22  LEU  77          HD22      LEU  77  -8.533   6.383  -5.119
  161   HD23  LEU  77          HD23      LEU  77  -7.111   7.058  -4.328
  162    H    HIS  78           HN       HIS  78  -8.699   4.334  -0.677
  163    HA   HIS  78           HA       HIS  78  -8.897   5.431   1.948
  164    HB2  HIS  78           HB2      HIS  78 -10.152   3.437   1.502
  165    HB3  HIS  78           HB1      HIS  78  -8.709   2.588   0.929
  166    HD1  HIS  78           HD1      HIS  78 -10.426   3.663   4.106
  167    HD2  HIS  78           HD2      HIS  78  -7.093   1.506   2.877
  168    HE1  HIS  78           HE1      HIS  78  -9.502   2.539   6.178
  169    H    LYS  79           HN       LYS  79  -6.433   3.740   0.114
  170    HA   LYS  79           HA       LYS  79  -4.536   3.575   2.224
  171    HB2  LYS  79           HB2      LYS  79  -4.548   2.238   0.068
  172    HB3  LYS  79           HB1      LYS  79  -3.956   3.687  -0.738
  173    HG2  LYS  79           HG2      LYS  79  -2.087   2.304  -0.292
  174    HG3  LYS  79           HG1      LYS  79  -2.013   3.660   0.834
  175    HD2  LYS  79           HD2      LYS  79  -1.491   1.578   1.973
  176    HD3  LYS  79           HD1      LYS  79  -3.007   2.245   2.581
  177    HE2  LYS  79           HE2      LYS  79  -4.267   0.701   1.186
  178    HE3  LYS  79           HE1      LYS  79  -2.774   0.066   0.505
  179    HZ1  LYS  79           HZ1      LYS  79  -3.952  -0.380   3.148
  180    HZ2  LYS  79           HZ2      LYS  79  -2.262  -0.356   3.036
  181    HZ3  LYS  79           HZ3      LYS  79  -3.154  -1.466   2.114
  182    H    LYS  80           HN       LYS  80  -5.254   5.872  -0.315
  183    HA   LYS  80           HA       LYS  80  -3.245   7.760   0.176
  184    HB2  LYS  80           HB2      LYS  80  -6.024   8.003  -0.948
  185    HB3  LYS  80           HB1      LYS  80  -4.898   9.366  -0.856
  186    HG2  LYS  80           HG2      LYS  80  -3.234   7.842  -1.975
  187    HG3  LYS  80           HG1      LYS  80  -4.606   6.803  -2.357
  188    HD2  LYS  80           HD2      LYS  80  -5.579   8.447  -3.727
  189    HD3  LYS  80           HD1      LYS  80  -4.497   9.709  -3.109
  190    HE2  LYS  80           HE2      LYS  80  -2.597   8.292  -3.956
  191    HE3  LYS  80           HE1      LYS  80  -3.808   7.343  -4.826
  192    HZ1  LYS  80           HZ1      LYS  80  -4.541   9.449  -5.898
  193    HZ2  LYS  80           HZ2      LYS  80  -2.977   8.953  -6.328
  194    HZ3  LYS  80           HZ3      LYS  80  -3.191  10.222  -5.220
  195    H    ARG  81           HN       ARG  81  -6.318   7.103   1.744
  196    HA   ARG  81           HA       ARG  81  -6.515   9.446   3.289
  197    HB2  ARG  81           HB2      ARG  81  -8.333   7.771   2.997
  198    HB3  ARG  81           HB1      ARG  81  -7.442   6.667   4.037
  199    HG2  ARG  81           HG2      ARG  81  -9.190   7.758   5.287
  200    HG3  ARG  81           HG1      ARG  81  -7.609   8.282   5.876
  201    HD2  ARG  81           HD2      ARG  81  -7.827  10.298   4.425
  202    HD3  ARG  81           HD1      ARG  81  -9.471   9.788   4.048
  203    HE   ARG  81           HE       ARG  81  -9.312   9.865   6.804
  204   HH11  ARG  81          HH11      ARG  81  -8.915  12.121   4.150
  205   HH12  ARG  81          HH12      ARG  81  -9.416  13.502   5.088
  206   HH21  ARG  81          HH21      ARG  81  -9.965  11.689   8.027
  207   HH22  ARG  81          HH22      ARG  81 -10.014  13.252   7.275
  208    H    HIS  82           HN       HIS  82  -4.819   6.391   3.891
  209    HA   HIS  82           HA       HIS  82  -4.007   7.184   6.543
  210    HB2  HIS  82           HB2      HIS  82  -3.300   4.832   4.804
  211    HB3  HIS  82           HB1      HIS  82  -2.578   5.095   6.363
  212    HD1  HIS  82           HD1      HIS  82  -3.843   4.207   8.364
  213    HD2  HIS  82           HD2      HIS  82  -6.031   4.246   4.844
  214    HE1  HIS  82           HE1      HIS  82  -5.848   2.724   8.757
  215    H    SER  83           HN       SER  83  -2.384   6.691   3.404
  216    HA   SER  83           HA       SER  83   0.089   7.706   4.638
  217    HB2  SER  83           HB2      SER  83  -0.183   5.780   2.323
  218    HB3  SER  83           HB1      SER  83   1.319   6.269   3.107
  219    HG   SER  83           HG       SER  83   0.868   5.034   4.799
  220    H    GLY  84           HN       GLY  84  -1.955   9.348   3.307
  221    HA2  GLY  84           HA2      GLY  84  -1.754  11.324   2.116
  222    HA3  GLY  84           HA1      GLY  84  -0.107  10.871   1.711
  223    H    GLU  85           HN       GLU  85  -0.173   8.729   0.256
  224    HA   GLU  85           HA       GLU  85  -2.328   8.567  -1.580
  225    HB2  GLU  85           HB2      GLU  85  -1.304   9.469  -3.547
  226    HB3  GLU  85           HB1      GLU  85  -1.276  10.704  -2.304
  227    HG2  GLU  85           HG2      GLU  85   1.112   9.833  -1.844
  228    HG3  GLU  85           HG1      GLU  85   0.951   9.126  -3.443
  229    H    ALA  86           HN       ALA  86  -2.189   6.776  -2.840
  230    HA   ALA  86           HA       ALA  86  -0.258   4.819  -2.012
  231    HB1  ALA  86           HB1      ALA  86  -2.558   4.156  -2.186
  232    HB2  ALA  86           HB2      ALA  86  -1.616   3.290  -3.399
  233    HB3  ALA  86           HB3      ALA  86  -2.615   4.663  -3.874
  234    H    ARG  87           HN       ARG  87   1.616   5.760  -2.926
  235    HA   ARG  87           HA       ARG  87   1.778   6.045  -5.759
  236    HB2  ARG  87           HB2      ARG  87   3.960   6.162  -3.696
  237    HB3  ARG  87           HB1      ARG  87   4.105   6.653  -5.380
  238    HG2  ARG  87           HG2      ARG  87   2.229   7.822  -3.378
  239    HG3  ARG  87           HG1      ARG  87   3.800   8.482  -3.829
  240    HD2  ARG  87           HD2      ARG  87   1.545   7.977  -5.761
  241    HD3  ARG  87           HD1      ARG  87   1.855   9.541  -5.009
  242    HE   ARG  87           HE       ARG  87   4.177   9.219  -6.125
  243   HH11  ARG  87          HH11      ARG  87   1.084   8.225  -7.481
  244   HH12  ARG  87          HH12      ARG  87   1.584   8.495  -9.123
  245   HH21  ARG  87          HH21      ARG  87   4.800   9.588  -8.307
  246   HH22  ARG  87          HH22      ARG  87   3.673   9.264  -9.588
  247    H    TYR  88           HN       TYR  88   4.313   4.542  -3.974
  248    HA   TYR  88           HA       TYR  88   4.488   2.390  -5.911
  249    HB2  TYR  88           HB2      TYR  88   6.212   3.035  -3.515
  250    HB3  TYR  88           HB1      TYR  88   6.576   1.857  -4.763
  251    HD1  TYR  88           HD1      TYR  88   5.909   5.482  -4.299
  252    HD2  TYR  88           HD2      TYR  88   7.885   2.480  -6.565
  253    HE1  TYR  88           HE1      TYR  88   7.081   7.225  -5.553
  254    HE2  TYR  88           HE2      TYR  88   9.071   4.217  -7.836
  255    HH   TYR  88           HH       TYR  88   8.756   6.613  -8.427
  256    H    ARG  89           HN       ARG  89   4.236   0.223  -5.422
  257    HA   ARG  89           HA       ARG  89   3.267  -0.382  -2.715
  258    HB2  ARG  89           HB2      ARG  89   2.793  -1.672  -5.353
  259    HB3  ARG  89           HB1      ARG  89   2.964  -2.731  -3.972
  260    HG2  ARG  89           HG2      ARG  89   1.118  -1.753  -2.888
  261    HG3  ARG  89           HG1      ARG  89   1.009  -0.477  -4.110
  262    HD2  ARG  89           HD2      ARG  89   0.609  -2.222  -5.813
  263    HD3  ARG  89           HD1      ARG  89   0.572  -3.402  -4.505
  264    HE   ARG  89           HE       ARG  89  -1.530  -2.688  -3.917
  265   HH11  ARG  89          HH11      ARG  89  -0.140  -0.389  -6.179
  266   HH12  ARG  89          HH12      ARG  89  -1.662   0.386  -6.509
  267   HH21  ARG  89          HH21      ARG  89  -3.508  -1.683  -4.350
  268   HH22  ARG  89          HH22      ARG  89  -3.576  -0.353  -5.466
  269    H    CYS  90           HN       CYS  90   4.225  -1.988  -1.621
  270    HA   CYS  90           HA       CYS  90   6.860  -2.856  -2.274
  271    HB2  CYS  90           HB2      CYS  90   5.664  -2.784   0.020
  272    HB3  CYS  90           HB1      CYS  90   4.930  -4.280  -0.455
  273    H    GLU  91           HN       GLU  91   7.089  -4.058  -4.110
  274    HA   GLU  91           HA       GLU  91   4.991  -5.433  -5.330
  275    HB2  GLU  91           HB2      GLU  91   6.800  -6.439  -6.759
  276    HB3  GLU  91           HB1      GLU  91   6.734  -4.677  -6.713
  277    HG2  GLU  91           HG2      GLU  91   8.491  -4.708  -5.031
  278    HG3  GLU  91           HG1      GLU  91   8.605  -6.452  -5.186
  279    H    ASP  92           HN       ASP  92   6.038  -6.284  -2.502
  280    HA   ASP  92           HA       ASP  92   5.700  -9.140  -3.099
  281    HB2  ASP  92           HB2      ASP  92   6.859  -9.576  -0.905
  282    HB3  ASP  92           HB1      ASP  92   7.880  -8.930  -2.185
  283    H    CYS  93           HN       CYS  93   4.732  -6.438  -0.933
  284    HA   CYS  93           HA       CYS  93   2.638  -8.243   0.010
  285    HB2  CYS  93           HB2      CYS  93   2.980  -7.660   2.257
  286    HB3  CYS  93           HB1      CYS  93   4.584  -7.981   1.615
  287    H    GLY  94           HN       GLY  94   3.423  -5.277  -1.330
  288    HA2  GLY  94           HA2      GLY  94   2.060  -3.812  -2.340
  289    HA3  GLY  94           HA1      GLY  94   0.672  -4.684  -1.713
  290    H    LYS  95           HN       LYS  95   3.251  -3.220   0.217
  291    HA   LYS  95           HA       LYS  95   1.390  -1.411   1.466
  292    HB2  LYS  95           HB2      LYS  95   4.394  -1.396   1.635
  293    HB3  LYS  95           HB1      LYS  95   3.271  -0.626   2.738
  294    HG2  LYS  95           HG2      LYS  95   2.442  -2.991   3.192
  295    HG3  LYS  95           HG1      LYS  95   3.946  -3.507   2.425
  296    HD2  LYS  95           HD2      LYS  95   4.609  -3.357   4.619
  297    HD3  LYS  95           HD1      LYS  95   5.026  -1.765   4.008
  298    HE2  LYS  95           HE2      LYS  95   2.939  -0.858   4.903
  299    HE3  LYS  95           HE1      LYS  95   2.512  -2.449   5.525
  300    HZ1  LYS  95           HZ1      LYS  95   3.417  -1.146   7.292
  301    HZ2  LYS  95           HZ2      LYS  95   4.795  -0.748   6.386
  302    HZ3  LYS  95           HZ3      LYS  95   4.552  -2.347   6.904
  303    H    LEU  96           HN       LEU  96   1.417   0.865   1.187
  304    HA   LEU  96           HA       LEU  96   2.490   1.577  -1.449
  305    HB2  LEU  96           HB2      LEU  96   0.123   2.553   0.090
  306    HB3  LEU  96           HB1      LEU  96   0.770   3.477  -1.254
  307    HG   LEU  96           HG       LEU  96  -1.109   2.190  -2.013
  308   HD11  LEU  96          HD11      LEU  96   0.777   2.405  -3.555
  309   HD12  LEU  96          HD12      LEU  96  -0.109   0.896  -3.796
  310   HD13  LEU  96          HD13      LEU  96   1.436   0.882  -2.940
  311   HD21  LEU  96          HD21      LEU  96   0.341  -0.214  -0.937
  312   HD22  LEU  96          HD22      LEU  96  -1.128  -0.262  -1.916
  313   HD23  LEU  96          HD23      LEU  96  -1.161   0.473  -0.312
  314    H    PHE  97           HN       PHE  97   4.366   2.527  -1.262
  315    HA   PHE  97           HA       PHE  97   4.734   4.521   0.873
  316    HB2  PHE  97           HB2      PHE  97   6.850   3.212  -0.860
  317    HB3  PHE  97           HB1      PHE  97   7.144   4.369   0.424
  318    HD1  PHE  97           HD2      PHE  97   5.973   0.952  -0.285
  319    HD2  PHE  97           HD1      PHE  97   7.185   3.716   2.723
  320    HE1  PHE  97           HE2      PHE  97   6.118  -0.886   1.341
  321    HE2  PHE  97           HE1      PHE  97   7.344   1.860   4.358
  322    HZ   PHE  97           HZ       PHE  97   6.750  -0.369   3.728
  323    H    THR  98           HN       THR  98   5.044   6.572   0.430
  324    HA   THR  98           HA       THR  98   4.518   7.508  -2.235
  325    HB   THR  98           HB       THR  98   4.526   9.721  -1.219
  326    HG1  THR  98           HG1      THR  98   4.931   9.666   1.199
  327   HG21  THR  98          HG21      THR  98   3.234   7.598   0.490
  328   HG22  THR  98          HG22      THR  98   2.532   8.375  -0.935
  329   HG23  THR  98          HG23      THR  98   2.815   9.315   0.534
  330    H    THR  99           HN       THR  99   7.211   6.612  -0.472
  331    HA   THR  99           HA       THR  99   8.992   8.020  -2.332
  332    HB   THR  99           HB       THR  99   9.531   7.133   0.510
  333    HG1  THR  99           HG1      THR  99   9.562   9.795  -0.500
  334   HG21  THR  99          HG21      THR  99  11.440   6.945  -1.075
  335   HG22  THR  99          HG22      THR  99  11.711   8.061   0.264
  336   HG23  THR  99          HG23      THR  99  11.327   8.685  -1.342
  337    H    SER 100           HN       SER 100  10.117   6.696  -3.618
  338    HA   SER 100           HA       SER 100   9.828   3.897  -3.545
  339    HB2  SER 100           HB2      SER 100  11.664   4.002  -5.310
  340    HB3  SER 100           HB1      SER 100  10.192   4.922  -5.658
  341    HG   SER 100           HG       SER 100  12.261   6.044  -6.000
  342    H    GLY 101           HN       GLY 101  12.308   6.116  -2.410
  343    HA2  GLY 101           HA2      GLY 101  14.241   4.179  -1.713
  344    HA3  GLY 101           HA1      GLY 101  14.111   5.785  -1.028
  345    H    ASN 102           HN       ASN 102  11.613   5.659   0.184
  346    HA   ASN 102           HA       ASN 102  12.115   4.250   2.580
  347    HB2  ASN 102           HB2      ASN 102   9.586   5.413   1.413
  348    HB3  ASN 102           HB1      ASN 102   9.619   4.607   2.974
  349   HD21  ASN 102          HD21      ASN 102   9.012   6.478   4.067
  350   HD22  ASN 102          HD22      ASN 102  10.102   7.802   4.297
  351    H    LEU 103           HN       LEU 103  10.394   3.601  -0.352
  352    HA   LEU 103           HA       LEU 103   9.043   1.310   0.482
  353    HB2  LEU 103           HB2      LEU 103   8.264   2.308  -1.464
  354    HB3  LEU 103           HB1      LEU 103   9.886   2.500  -2.121
  355    HG   LEU 103           HG       LEU 103   9.939  -0.026  -2.343
  356   HD11  LEU 103          HD11      LEU 103   6.964   0.120  -2.331
  357   HD12  LEU 103          HD12      LEU 103   7.839  -0.123  -0.803
  358   HD13  LEU 103          HD13      LEU 103   8.045  -1.283  -2.123
  359   HD21  LEU 103          HD21      LEU 103   8.098   1.758  -3.863
  360   HD22  LEU 103          HD22      LEU 103   8.464   0.106  -4.380
  361   HD23  LEU 103          HD23      LEU 103   9.756   1.311  -4.254
  362    H    LYS 104           HN       LYS 104  12.008   1.861  -1.308
  363    HA   LYS 104           HA       LYS 104  12.857  -0.719  -1.724
  364    HB2  LYS 104           HB2      LYS 104  14.233   1.917  -1.440
  365    HB3  LYS 104           HB1      LYS 104  15.176   0.448  -1.690
  366    HG2  LYS 104           HG2      LYS 104  13.846   0.013  -3.747
  367    HG3  LYS 104           HG1      LYS 104  13.051   1.576  -3.505
  368    HD2  LYS 104           HD2      LYS 104  14.823   1.842  -5.109
  369    HD3  LYS 104           HD1      LYS 104  15.283   2.659  -3.612
  370    HE2  LYS 104           HE2      LYS 104  17.154   1.401  -4.550
  371    HE3  LYS 104           HE1      LYS 104  16.664   0.758  -2.983
  372    HZ1  LYS 104           HZ1      LYS 104  17.108  -0.982  -4.642
  373    HZ2  LYS 104           HZ2      LYS 104  15.840  -0.386  -5.599
  374    HZ3  LYS 104           HZ3      LYS 104  15.515  -1.034  -4.070
  375    H    ARG 105           HN       ARG 105  13.512   1.388   1.072
  376    HA   ARG 105           HA       ARG 105  15.160  -0.344   2.495
  377    HB2  ARG 105           HB2      ARG 105  13.030   1.518   3.577
  378    HB3  ARG 105           HB1      ARG 105  14.300   0.779   4.539
  379    HG2  ARG 105           HG2      ARG 105  14.803   2.627   2.219
  380    HG3  ARG 105           HG1      ARG 105  14.720   3.144   3.906
  381    HD2  ARG 105           HD2      ARG 105  16.578   1.615   4.437
  382    HD3  ARG 105           HD1      ARG 105  16.674   1.167   2.735
  383    HE   ARG 105           HE       ARG 105  16.882   3.964   2.957
  384   HH11  ARG 105          HH11      ARG 105  18.711   1.079   3.741
  385   HH12  ARG 105          HH12      ARG 105  20.255   1.855   3.574
  386   HH21  ARG 105          HH21      ARG 105  18.923   4.988   2.739
  387   HH22  ARG 105          HH22      ARG 105  20.376   4.070   3.005
  388    H    HIS 106           HN       HIS 106  11.628  -0.159   2.402
  389    HA   HIS 106           HA       HIS 106  11.208  -2.349   4.175
  390    HB2  HIS 106           HB2      HIS 106   9.509  -0.606   3.860
  391    HB3  HIS 106           HB1      HIS 106   9.330  -1.078   2.172
  392    HD1  HIS 106           HD1      HIS 106   8.586  -2.358   5.669
  393    HD2  HIS 106           HD2      HIS 106   7.757  -3.199   1.691
  394    HE1  HIS 106           HE1      HIS 106   6.814  -4.171   5.684
  395    H    GLN 107           HN       GLN 107  12.086  -2.235   0.893
  396    HA   GLN 107           HA       GLN 107  10.788  -4.672   0.116
  397    HB2  GLN 107           HB2      GLN 107  13.028  -3.152  -1.257
  398    HB3  GLN 107           HB1      GLN 107  12.064  -4.437  -1.971
  399    HG2  GLN 107           HG2      GLN 107  10.587  -2.112  -0.988
  400    HG3  GLN 107           HG1      GLN 107  11.658  -1.833  -2.358
  401   HE21  GLN 107          HE21      GLN 107   8.764  -3.240  -1.274
  402   HE22  GLN 107          HE22      GLN 107   8.237  -3.882  -2.790
  403    H    LEU 108           HN       LEU 108  13.673  -3.473   1.437
  404    HA   LEU 108           HA       LEU 108  15.330  -5.755   0.966
  405    HB2  LEU 108           HB2      LEU 108  15.615  -3.262   2.599
  406    HB3  LEU 108           HB1      LEU 108  16.797  -4.554   2.678
  407    HG   LEU 108           HG       LEU 108  17.801  -3.925   0.779
  408   HD11  LEU 108          HD11      LEU 108  15.946  -4.730  -0.592
  409   HD12  LEU 108          HD12      LEU 108  16.673  -3.266  -1.258
  410   HD13  LEU 108          HD13      LEU 108  15.132  -3.177  -0.395
  411   HD21  LEU 108          HD21      LEU 108  17.590  -1.550   0.270
  412   HD22  LEU 108          HD22      LEU 108  17.610  -1.837   2.010
  413   HD23  LEU 108          HD23      LEU 108  16.086  -1.486   1.190
  414    H    VAL 109           HN       VAL 109  13.267  -4.561   3.509
  415    HA   VAL 109           HA       VAL 109  14.367  -6.153   5.545
  416    HB   VAL 109           HB       VAL 109  12.427  -5.638   6.821
  417   HG11  VAL 109          HG11      VAL 109  12.215  -3.248   6.587
  418   HG12  VAL 109          HG12      VAL 109  12.839  -3.338   4.939
  419   HG13  VAL 109          HG13      VAL 109  13.890  -3.725   6.306
  420   HG21  VAL 109          HG21      VAL 109  11.124  -5.001   4.202
  421   HG22  VAL 109          HG22      VAL 109  10.394  -4.690   5.784
  422   HG23  VAL 109          HG23      VAL 109  10.738  -6.346   5.277
  423    H    HIS 110           HN       HIS 110  12.318  -6.797   2.853
  424    HA   HIS 110           HA       HIS 110  11.203  -9.232   3.946
  425    HB2  HIS 110           HB2      HIS 110  11.247  -7.967   1.245
  426    HB3  HIS 110           HB1      HIS 110  10.711  -9.620   1.420
  427    HD1  HIS 110           HD1      HIS 110   8.347  -9.974   2.330
  428    HD2  HIS 110           HD2      HIS 110   9.723  -6.072   2.521
  429    HE1  HIS 110           HE1      HIS 110   6.335  -8.532   2.854
  430    H    SER 111           HN       SER 111  14.271  -8.474   2.702
  431    HA   SER 111           HA       SER 111  15.063 -11.251   2.731
  432    HB2  SER 111           HB2      SER 111  16.003 -11.116   0.368
  433    HB3  SER 111           HB1      SER 111  14.249 -11.251   0.485
  434    HG   SER 111           HG       SER 111  15.605  -8.767   0.244
  435    H    GLY 112           HN       GLY 112  15.728  -8.913   4.182
  436    HA2  GLY 112           HA2      GLY 112  18.451  -8.310   3.240
  437    HA3  GLY 112           HA1      GLY 112  17.402  -7.152   4.064
  Start of MODEL   19
    1    H    LYS  58           HT1      LYS  58 -15.990  -8.351  -5.426
    2    HA   LYS  58           HA       LYS  58 -18.257  -8.325  -3.523
    3    HB2  LYS  58           HB2      LYS  58 -17.039  -9.918  -2.276
    4    HB3  LYS  58           HB1      LYS  58 -16.915 -10.465  -3.941
    5    HG2  LYS  58           HG2      LYS  58 -14.679  -9.678  -4.120
    6    HG3  LYS  58           HG1      LYS  58 -14.796  -8.824  -2.580
    7    HD2  LYS  58           HD2      LYS  58 -15.229 -11.103  -1.533
    8    HD3  LYS  58           HD1      LYS  58 -14.690 -11.790  -3.068
    9    HE2  LYS  58           HE2      LYS  58 -12.545 -10.718  -2.845
   10    HE3  LYS  58           HE1      LYS  58 -13.085  -9.863  -1.400
   11    HZ1  LYS  58           HZ1      LYS  58 -11.889 -11.631  -0.559
   12    HZ2  LYS  58           HZ2      LYS  58 -12.448 -12.725  -1.730
   13    HZ3  LYS  58           HZ3      LYS  58 -13.480 -12.215  -0.483
   14    HA   PRO  59           HA       PRO  59 -16.487  -4.945  -1.242
   15    HB2  PRO  59           HB2      PRO  59 -16.609  -6.768   1.108
   16    HB3  PRO  59           HB1      PRO  59 -17.237  -5.125   0.921
   17    HG2  PRO  59           HG2      PRO  59 -18.882  -7.206   0.852
   18    HG3  PRO  59           HG1      PRO  59 -19.109  -5.836  -0.254
   19    HD2  PRO  59           HD2      PRO  59 -17.943  -8.533  -0.798
   20    HD3  PRO  59           HD1      PRO  59 -18.981  -7.526  -1.820
   21    H    TYR  60           HN       TYR  60 -14.549  -4.411  -1.308
   22    HA   TYR  60           HA       TYR  60 -12.352  -6.261  -0.689
   23    HB2  TYR  60           HB2      TYR  60 -12.359  -3.614  -2.162
   24    HB3  TYR  60           HB1      TYR  60 -10.925  -4.589  -1.858
   25    HD1  TYR  60           HD2      TYR  60 -11.256  -7.144  -2.683
   26    HD2  TYR  60           HD1      TYR  60 -13.238  -3.731  -4.254
   27    HE1  TYR  60           HE2      TYR  60 -11.607  -8.326  -4.802
   28    HE2  TYR  60           HE1      TYR  60 -13.590  -4.903  -6.376
   29    HH   TYR  60           HH       TYR  60 -12.773  -6.717  -7.648
   30    H    GLY  61           HN       GLY  61 -11.949  -6.090   1.468
   31    HA2  GLY  61           HA2      GLY  61 -12.177  -3.422   2.639
   32    HA3  GLY  61           HA1      GLY  61 -12.323  -4.929   3.521
   33    H    CYS  62           HN       CYS  62 -10.724  -2.585   3.923
   34    HA   CYS  62           HA       CYS  62  -8.050  -2.823   3.185
   35    HB2  CYS  62           HB2      CYS  62  -9.587  -1.003   4.487
   36    HB3  CYS  62           HB1      CYS  62  -8.550  -1.593   5.778
   37    H    GLU  63           HN       GLU  63  -6.223  -3.287   4.420
   38    HA   GLU  63           HA       GLU  63  -6.371  -5.853   5.656
   39    HB2  GLU  63           HB2      GLU  63  -4.527  -5.083   4.151
   40    HB3  GLU  63           HB1      GLU  63  -4.024  -3.959   5.403
   41    HG2  GLU  63           HG2      GLU  63  -2.574  -5.690   5.738
   42    HG3  GLU  63           HG1      GLU  63  -3.856  -6.103   6.870
   43    H    GLU  64           HN       GLU  64  -5.973  -2.541   6.787
   44    HA   GLU  64           HA       GLU  64  -5.055  -3.510   9.384
   45    HB2  GLU  64           HB2      GLU  64  -4.001  -1.503   9.660
   46    HB3  GLU  64           HB1      GLU  64  -3.775  -1.805   7.968
   47    HG2  GLU  64           HG2      GLU  64  -5.796   0.079   9.175
   48    HG3  GLU  64           HG1      GLU  64  -4.228   0.551   8.512
   49    H    CYS  65           HN       CYS  65  -7.513  -1.531   7.883
   50    HA   CYS  65           HA       CYS  65  -8.660  -0.953  10.541
   51    HB2  CYS  65           HB2      CYS  65  -9.751   0.994   9.367
   52    HB3  CYS  65           HB1      CYS  65  -7.993   1.077   9.413
   53    H    GLY  66           HN       GLY  66  -8.944  -2.509   7.628
   54    HA2  GLY  66           HA2      GLY  66 -10.366  -4.047   6.851
   55    HA3  GLY  66           HA1      GLY  66 -10.995  -4.137   8.490
   56    H    LYS  67           HN       LYS  67 -11.168  -1.239   6.498
   57    HA   LYS  67           HA       LYS  67 -14.070  -1.389   6.535
   58    HB2  LYS  67           HB2      LYS  67 -12.236   0.695   5.324
   59    HB3  LYS  67           HB1      LYS  67 -13.984   0.824   5.435
   60    HG2  LYS  67           HG2      LYS  67 -13.785   0.735   7.904
   61    HG3  LYS  67           HG1      LYS  67 -12.028   0.749   7.717
   62    HD2  LYS  67           HD2      LYS  67 -12.186   2.899   6.539
   63    HD3  LYS  67           HD1      LYS  67 -13.936   2.893   6.768
   64    HE2  LYS  67           HE2      LYS  67 -13.580   2.869   9.213
   65    HE3  LYS  67           HE1      LYS  67 -11.839   2.952   8.940
   66    HZ1  LYS  67           HZ1      LYS  67 -13.857   5.008   8.207
   67    HZ2  LYS  67           HZ2      LYS  67 -12.225   5.075   7.751
   68    HZ3  LYS  67           HZ3      LYS  67 -12.650   5.135   9.392
   69    H    SER  68           HN       SER  68 -15.307  -2.089   4.860
   70    HA   SER  68           HA       SER  68 -13.878  -3.203   2.597
   71    HB2  SER  68           HB2      SER  68 -16.563  -3.758   2.208
   72    HB3  SER  68           HB1      SER  68 -15.347  -4.830   2.912
   73    HG   SER  68           HG       SER  68 -16.018  -4.329   4.916
   74    H    TYR  69           HN       TYR  69 -13.821  -2.482   0.673
   75    HA   TYR  69           HA       TYR  69 -15.753  -0.400  -0.159
   76    HB2  TYR  69           HB2      TYR  69 -12.810  -0.642  -0.802
   77    HB3  TYR  69           HB1      TYR  69 -13.909   0.423  -1.657
   78    HD1  TYR  69           HD2      TYR  69 -12.686  -0.361   1.737
   79    HD2  TYR  69           HD1      TYR  69 -14.251   2.588  -0.869
   80    HE1  TYR  69           HE2      TYR  69 -12.295   1.339   3.457
   81    HE2  TYR  69           HE1      TYR  69 -13.867   4.309   0.830
   82    HH   TYR  69           HH       TYR  69 -13.570   4.515   3.206
   83    H    ARG  70           HN       ARG  70 -16.868  -0.820  -2.011
   84    HA   ARG  70           HA       ARG  70 -16.578  -3.478  -3.022
   85    HB2  ARG  70           HB2      ARG  70 -18.518  -3.025  -4.411
   86    HB3  ARG  70           HB1      ARG  70 -18.792  -2.556  -2.743
   87    HG2  ARG  70           HG2      ARG  70 -18.389  -0.204  -3.382
   88    HG3  ARG  70           HG1      ARG  70 -18.243  -0.720  -5.067
   89    HD2  ARG  70           HD2      ARG  70 -20.511  -1.735  -4.884
   90    HD3  ARG  70           HD1      ARG  70 -20.650  -1.035  -3.277
   91    HE   ARG  70           HE       ARG  70 -20.061   0.960  -5.231
   92   HH11  ARG  70          HH11      ARG  70 -22.632  -1.001  -3.884
   93   HH12  ARG  70          HH12      ARG  70 -23.901   0.047  -4.433
   94   HH21  ARG  70          HH21      ARG  70 -21.727   2.353  -5.948
   95   HH22  ARG  70          HH22      ARG  70 -23.387   1.967  -5.598
   96    H    LEU  71           HN       LEU  71 -15.325  -0.409  -4.092
   97    HA   LEU  71           HA       LEU  71 -14.427  -1.766  -6.536
   98    HB2  LEU  71           HB2      LEU  71 -14.253   1.139  -5.740
   99    HB3  LEU  71           HB1      LEU  71 -13.552   0.470  -7.201
  100    HG   LEU  71           HG       LEU  71 -15.440   1.135  -8.160
  101   HD11  LEU  71          HD11      LEU  71 -16.662  -1.166  -6.685
  102   HD12  LEU  71          HD12      LEU  71 -15.718  -1.290  -8.171
  103   HD13  LEU  71          HD13      LEU  71 -17.266  -0.442  -8.177
  104   HD21  LEU  71          HD21      LEU  71 -17.434   1.818  -7.058
  105   HD22  LEU  71          HD22      LEU  71 -16.044   2.422  -6.153
  106   HD23  LEU  71          HD23      LEU  71 -16.934   1.013  -5.572
  107    H    ILE  72           HN       ILE  72 -12.238  -1.890  -7.045
  108    HA   ILE  72           HA       ILE  72 -10.449  -2.216  -4.851
  109    HB   ILE  72           HB       ILE  72 -10.053  -2.271  -7.840
  110   HG12  ILE  72          HG12      ILE  72 -11.151  -4.170  -6.605
  111   HG13  ILE  72          HG11      ILE  72  -9.716  -4.619  -7.517
  112   HG21  ILE  72          HG21      ILE  72  -8.021  -1.323  -6.917
  113   HG22  ILE  72          HG22      ILE  72  -7.733  -2.980  -7.450
  114   HG23  ILE  72          HG23      ILE  72  -7.928  -2.626  -5.734
  115   HD11  ILE  72          HD11      ILE  72  -9.849  -4.138  -4.545
  116   HD12  ILE  72          HD12      ILE  72  -8.402  -4.577  -5.454
  117   HD13  ILE  72          HD13      ILE  72  -9.754  -5.707  -5.348
  118    H    SER  73           HN       SER  73 -10.868   0.219  -7.389
  119    HA   SER  73           HA       SER  73  -8.730   1.885  -6.676
  120    HB2  SER  73           HB2      SER  73 -11.398   2.746  -7.820
  121    HB3  SER  73           HB1      SER  73  -9.865   3.606  -7.954
  122    HG   SER  73           HG       SER  73  -9.069   1.954  -9.244
  123    H    LEU  74           HN       LEU  74 -12.052   1.778  -5.553
  124    HA   LEU  74           HA       LEU  74 -12.183   3.869  -3.819
  125    HB2  LEU  74           HB2      LEU  74 -13.423   1.260  -4.162
  126    HB3  LEU  74           HB1      LEU  74 -13.349   1.745  -2.474
  127    HG   LEU  74           HG       LEU  74 -14.654   3.310  -4.693
  128   HD11  LEU  74          HD11      LEU  74 -16.720   2.766  -3.480
  129   HD12  LEU  74          HD12      LEU  74 -15.798   1.777  -2.347
  130   HD13  LEU  74          HD13      LEU  74 -15.913   1.303  -4.047
  131   HD21  LEU  74          HD21      LEU  74 -14.960   3.898  -1.826
  132   HD22  LEU  74          HD22      LEU  74 -14.931   4.995  -3.211
  133   HD23  LEU  74          HD23      LEU  74 -13.424   4.307  -2.580
  134    H    LEU  75           HN       LEU  75 -11.130   0.639  -3.060
  135    HA   LEU  75           HA       LEU  75 -10.359   1.221  -0.397
  136    HB2  LEU  75           HB2      LEU  75 -11.029  -0.969  -0.925
  137    HB3  LEU  75           HB1      LEU  75  -9.971  -1.040  -2.329
  138    HG   LEU  75           HG       LEU  75  -8.039  -0.954  -0.683
  139   HD11  LEU  75          HD11      LEU  75 -10.255  -1.667   1.230
  140   HD12  LEU  75          HD12      LEU  75  -9.319  -0.170   1.245
  141   HD13  LEU  75          HD13      LEU  75  -8.525  -1.711   1.575
  142   HD21  LEU  75          HD21      LEU  75  -8.242  -3.366  -0.290
  143   HD22  LEU  75          HD22      LEU  75  -8.694  -2.893  -1.936
  144   HD23  LEU  75          HD23      LEU  75  -9.950  -3.269  -0.748
  145    H    ASN  76           HN       ASN  76  -8.923   1.349  -3.483
  146    HA   ASN  76           HA       ASN  76  -6.176   1.259  -2.681
  147    HB2  ASN  76           HB2      ASN  76  -7.508   1.072  -5.079
  148    HB3  ASN  76           HB1      ASN  76  -6.812   2.693  -5.176
  149   HD21  ASN  76          HD21      ASN  76  -6.160  -0.707  -4.921
  150   HD22  ASN  76          HD22      ASN  76  -4.486  -0.630  -5.364
  151    H    LEU  77           HN       LEU  77  -8.553   3.761  -3.368
  152    HA   LEU  77           HA       LEU  77  -6.680   5.873  -2.886
  153    HB2  LEU  77           HB2      LEU  77  -9.493   5.585  -3.707
  154    HB3  LEU  77           HB1      LEU  77  -9.107   7.047  -2.826
  155    HG   LEU  77           HG       LEU  77  -9.023   7.087  -5.394
  156   HD11  LEU  77          HD11      LEU  77  -8.247   8.862  -3.933
  157   HD12  LEU  77          HD12      LEU  77  -7.180   8.681  -5.326
  158   HD13  LEU  77          HD13      LEU  77  -6.698   8.047  -3.751
  159   HD21  LEU  77          HD21      LEU  77  -6.892   6.450  -6.383
  160   HD22  LEU  77          HD22      LEU  77  -7.700   5.045  -5.687
  161   HD23  LEU  77          HD23      LEU  77  -6.355   5.799  -4.834
  162    H    HIS  78           HN       HIS  78  -8.801   3.913  -1.084
  163    HA   HIS  78           HA       HIS  78  -8.919   5.577   1.229
  164    HB2  HIS  78           HB2      HIS  78 -10.609   3.938   1.117
  165    HB3  HIS  78           HB1      HIS  78  -9.458   2.659   0.718
  166    HD1  HIS  78           HD1      HIS  78 -10.514   4.795   3.695
  167    HD2  HIS  78           HD2      HIS  78  -8.477   1.280   2.810
  168    HE1  HIS  78           HE1      HIS  78 -10.050   3.666   5.908
  169    H    LYS  79           HN       LYS  79  -6.779   2.978   0.104
  170    HA   LYS  79           HA       LYS  79  -5.255   3.049   2.559
  171    HB2  LYS  79           HB2      LYS  79  -3.759   1.438   1.519
  172    HB3  LYS  79           HB1      LYS  79  -5.428   0.944   1.301
  173    HG2  LYS  79           HG2      LYS  79  -5.393   1.616  -0.995
  174    HG3  LYS  79           HG1      LYS  79  -3.786   2.324  -0.809
  175    HD2  LYS  79           HD2      LYS  79  -3.770   0.081  -1.890
  176    HD3  LYS  79           HD1      LYS  79  -2.817   0.160  -0.409
  177    HE2  LYS  79           HE2      LYS  79  -4.792  -0.780   0.811
  178    HE3  LYS  79           HE1      LYS  79  -5.567  -1.026  -0.752
  179    HZ1  LYS  79           HZ1      LYS  79  -2.952  -2.203   0.019
  180    HZ2  LYS  79           HZ2      LYS  79  -3.844  -2.532  -1.387
  181    HZ3  LYS  79           HZ3      LYS  79  -4.432  -3.014   0.124
  182    H    LYS  80           HN       LYS  80  -5.104   4.416  -0.634
  183    HA   LYS  80           HA       LYS  80  -2.649   5.752  -0.418
  184    HB2  LYS  80           HB2      LYS  80  -3.695   5.750  -2.539
  185    HB3  LYS  80           HB1      LYS  80  -5.215   6.344  -1.884
  186    HG2  LYS  80           HG2      LYS  80  -4.351   8.521  -1.632
  187    HG3  LYS  80           HG1      LYS  80  -2.702   7.984  -1.900
  188    HD2  LYS  80           HD2      LYS  80  -4.899   7.855  -3.957
  189    HD3  LYS  80           HD1      LYS  80  -3.721   9.167  -3.839
  190    HE2  LYS  80           HE2      LYS  80  -1.923   7.472  -4.060
  191    HE3  LYS  80           HE1      LYS  80  -3.166   6.260  -4.363
  192    HZ1  LYS  80           HZ1      LYS  80  -3.881   7.598  -6.295
  193    HZ2  LYS  80           HZ2      LYS  80  -2.286   7.046  -6.443
  194    HZ3  LYS  80           HZ3      LYS  80  -2.588   8.660  -6.018
  195    H    ARG  81           HN       ARG  81  -5.861   6.455   0.799
  196    HA   ARG  81           HA       ARG  81  -5.438   9.123   1.579
  197    HB2  ARG  81           HB2      ARG  81  -7.637   7.956   1.323
  198    HB3  ARG  81           HB1      ARG  81  -7.325   7.146   2.849
  199    HG2  ARG  81           HG2      ARG  81  -7.406   9.190   4.044
  200    HG3  ARG  81           HG1      ARG  81  -7.419  10.130   2.548
  201    HD2  ARG  81           HD2      ARG  81  -9.560   8.994   1.958
  202    HD3  ARG  81           HD1      ARG  81  -9.570   8.293   3.574
  203    HE   ARG  81           HE       ARG  81  -9.578  10.669   4.387
  204   HH11  ARG  81          HH11      ARG  81 -10.849   9.807   1.228
  205   HH12  ARG  81          HH12      ARG  81 -11.982  11.129   1.190
  206   HH21  ARG  81          HH21      ARG  81 -11.022  12.444   4.297
  207   HH22  ARG  81          HH22      ARG  81 -12.039  12.656   2.903
  208    H    HIS  82           HN       HIS  82  -4.775   6.083   3.242
  209    HA   HIS  82           HA       HIS  82  -4.419   7.165   5.828
  210    HB2  HIS  82           HB2      HIS  82  -3.467   4.625   4.535
  211    HB3  HIS  82           HB1      HIS  82  -3.017   5.039   6.169
  212    HD1  HIS  82           HD1      HIS  82  -4.930   4.961   7.966
  213    HD2  HIS  82           HD2      HIS  82  -5.964   3.700   4.151
  214    HE1  HIS  82           HE1      HIS  82  -7.071   3.640   8.206
  215    H    SER  83           HN       SER  83  -2.364   7.128   3.040
  216    HA   SER  83           HA       SER  83  -0.103   8.030   4.705
  217    HB2  SER  83           HB2      SER  83   0.055   6.624   2.028
  218    HB3  SER  83           HB1      SER  83   1.406   7.053   3.076
  219    HG   SER  83           HG       SER  83  -0.269   4.901   3.180
  220    H    GLY  84           HN       GLY  84  -2.375   9.447   3.180
  221    HA2  GLY  84           HA2      GLY  84  -2.489  11.550   2.186
  222    HA3  GLY  84           HA1      GLY  84  -0.735  11.542   2.039
  223    H    GLU  85           HN       GLU  85  -0.143   9.427   0.561
  224    HA   GLU  85           HA       GLU  85  -1.975   9.112  -1.638
  225    HB2  GLU  85           HB2      GLU  85  -0.328   9.676  -3.323
  226    HB3  GLU  85           HB1      GLU  85  -0.550  11.057  -2.256
  227    HG2  GLU  85           HG2      GLU  85   1.508   9.572  -1.114
  228    HG3  GLU  85           HG1      GLU  85   1.813   9.542  -2.845
  229    H    ALA  86           HN       ALA  86  -0.724   7.566  -3.241
  230    HA   ALA  86           HA       ALA  86   0.862   5.610  -1.749
  231    HB1  ALA  86           HB1      ALA  86  -1.464   4.937  -3.553
  232    HB2  ALA  86           HB2      ALA  86  -1.418   4.737  -1.802
  233    HB3  ALA  86           HB3      ALA  86  -0.358   3.770  -2.829
  234    H    ARG  87           HN       ARG  87   2.761   5.925  -2.732
  235    HA   ARG  87           HA       ARG  87   2.766   6.669  -5.530
  236    HB2  ARG  87           HB2      ARG  87   5.078   6.594  -3.609
  237    HB3  ARG  87           HB1      ARG  87   5.026   7.395  -5.174
  238    HG2  ARG  87           HG2      ARG  87   3.244   8.073  -2.873
  239    HG3  ARG  87           HG1      ARG  87   4.798   8.834  -3.185
  240    HD2  ARG  87           HD2      ARG  87   2.445   8.794  -5.068
  241    HD3  ARG  87           HD1      ARG  87   2.902  10.159  -4.053
  242    HE   ARG  87           HE       ARG  87   4.753   9.117  -6.095
  243   HH11  ARG  87          HH11      ARG  87   2.910  11.752  -4.677
  244   HH12  ARG  87          HH12      ARG  87   3.540  12.941  -5.780
  245   HH21  ARG  87          HH21      ARG  87   5.586  10.684  -7.523
  246   HH22  ARG  87          HH22      ARG  87   5.075  12.341  -7.383
  247    H    TYR  88           HN       TYR  88   5.249   4.935  -3.853
  248    HA   TYR  88           HA       TYR  88   5.439   3.004  -6.024
  249    HB2  TYR  88           HB2      TYR  88   7.114   3.411  -3.539
  250    HB3  TYR  88           HB1      TYR  88   7.466   2.260  -4.817
  251    HD1  TYR  88           HD1      TYR  88   6.855   5.886  -4.321
  252    HD2  TYR  88           HD2      TYR  88   8.947   2.886  -6.471
  253    HE1  TYR  88           HE1      TYR  88   8.119   7.620  -5.476
  254    HE2  TYR  88           HE2      TYR  88  10.232   4.615  -7.651
  255    HH   TYR  88           HH       TYR  88   9.990   7.001  -8.256
  256    H    ARG  89           HN       ARG  89   5.466   0.718  -5.595
  257    HA   ARG  89           HA       ARG  89   4.510  -0.022  -2.920
  258    HB2  ARG  89           HB2      ARG  89   3.216  -1.820  -3.778
  259    HB3  ARG  89           HB1      ARG  89   2.767  -0.384  -4.690
  260    HG2  ARG  89           HG2      ARG  89   4.261  -1.147  -6.519
  261    HG3  ARG  89           HG1      ARG  89   4.534  -2.635  -5.601
  262    HD2  ARG  89           HD2      ARG  89   2.143  -3.091  -5.625
  263    HD3  ARG  89           HD1      ARG  89   1.871  -1.610  -6.547
  264    HE   ARG  89           HE       ARG  89   3.688  -3.544  -7.743
  265   HH11  ARG  89          HH11      ARG  89   0.450  -2.237  -7.581
  266   HH12  ARG  89          HH12      ARG  89  -0.051  -2.910  -9.099
  267   HH21  ARG  89          HH21      ARG  89   3.053  -4.436  -9.755
  268   HH22  ARG  89          HH22      ARG  89   1.434  -4.165 -10.346
  269    H    CYS  90           HN       CYS  90   5.330  -1.937  -2.127
  270    HA   CYS  90           HA       CYS  90   7.976  -2.644  -2.807
  271    HB2  CYS  90           HB2      CYS  90   6.577  -3.062  -0.647
  272    HB3  CYS  90           HB1      CYS  90   6.048  -4.497  -1.475
  273    H    GLU  91           HN       GLU  91   8.723  -4.145  -4.281
  274    HA   GLU  91           HA       GLU  91   6.837  -4.987  -6.265
  275    HB2  GLU  91           HB2      GLU  91   8.785  -5.879  -7.451
  276    HB3  GLU  91           HB1      GLU  91   9.014  -4.203  -6.956
  277    HG2  GLU  91           HG2      GLU  91  10.254  -5.010  -5.022
  278    HG3  GLU  91           HG1      GLU  91  10.123  -6.651  -5.633
  279    H    ASP  92           HN       ASP  92   7.333  -6.219  -3.365
  280    HA   ASP  92           HA       ASP  92   7.046  -8.986  -4.311
  281    HB2  ASP  92           HB2      ASP  92   7.960  -9.651  -2.040
  282    HB3  ASP  92           HB1      ASP  92   9.108  -8.944  -3.170
  283    H    CYS  93           HN       CYS  93   5.948  -6.585  -1.906
  284    HA   CYS  93           HA       CYS  93   3.833  -8.483  -1.239
  285    HB2  CYS  93           HB2      CYS  93   4.144  -8.135   1.065
  286    HB3  CYS  93           HB1      CYS  93   5.766  -8.311   0.424
  287    H    GLY  94           HN       GLY  94   4.509  -5.663  -2.611
  288    HA2  GLY  94           HA2      GLY  94   3.245  -3.986  -3.376
  289    HA3  GLY  94           HA1      GLY  94   1.845  -4.963  -2.953
  290    H    LYS  95           HN       LYS  95   4.188  -3.715  -0.648
  291    HA   LYS  95           HA       LYS  95   2.200  -2.126   0.675
  292    HB2  LYS  95           HB2      LYS  95   5.123  -2.635   1.127
  293    HB3  LYS  95           HB1      LYS  95   4.251  -1.394   2.034
  294    HG2  LYS  95           HG2      LYS  95   2.620  -3.116   2.673
  295    HG3  LYS  95           HG1      LYS  95   3.652  -4.333   1.931
  296    HD2  LYS  95           HD2      LYS  95   5.383  -3.926   3.495
  297    HD3  LYS  95           HD1      LYS  95   4.583  -2.472   4.104
  298    HE2  LYS  95           HE2      LYS  95   2.806  -3.766   5.043
  299    HE3  LYS  95           HE1      LYS  95   3.412  -5.239   4.290
  300    HZ1  LYS  95           HZ1      LYS  95   3.948  -4.953   6.713
  301    HZ2  LYS  95           HZ2      LYS  95   4.986  -3.687   6.270
  302    HZ3  LYS  95           HZ3      LYS  95   5.274  -5.261   5.710
  303    H    LEU  96           HN       LEU  96   1.894   0.037   0.466
  304    HA   LEU  96           HA       LEU  96   3.278   1.285  -1.772
  305    HB2  LEU  96           HB2      LEU  96   0.833   2.124  -0.232
  306    HB3  LEU  96           HB1      LEU  96   1.553   3.091  -1.513
  307    HG   LEU  96           HG       LEU  96  -0.352   1.921  -2.391
  308   HD11  LEU  96          HD11      LEU  96   1.522   2.135  -3.901
  309   HD12  LEU  96          HD12      LEU  96   0.677   0.614  -4.192
  310   HD13  LEU  96          HD13      LEU  96   2.201   0.619  -3.303
  311   HD21  LEU  96          HD21      LEU  96  -0.544   0.133  -0.792
  312   HD22  LEU  96          HD22      LEU  96   0.967  -0.579  -1.366
  313   HD23  LEU  96          HD23      LEU  96  -0.450  -0.545  -2.421
  314    H    PHE  97           HN       PHE  97   4.869   2.593  -1.506
  315    HA   PHE  97           HA       PHE  97   5.022   4.140   1.003
  316    HB2  PHE  97           HB2      PHE  97   7.369   3.171  -0.639
  317    HB3  PHE  97           HB1      PHE  97   7.454   4.134   0.829
  318    HD1  PHE  97           HD2      PHE  97   6.420   0.821  -0.478
  319    HD2  PHE  97           HD1      PHE  97   7.391   3.144   2.954
  320    HE1  PHE  97           HE2      PHE  97   6.344  -1.218   0.921
  321    HE2  PHE  97           HE1      PHE  97   7.346   1.116   4.345
  322    HZ   PHE  97           HZ       PHE  97   6.825  -1.063   3.326
  323    H    THR  98           HN       THR  98   5.288   6.239   0.857
  324    HA   THR  98           HA       THR  98   4.800   7.455  -1.691
  325    HB   THR  98           HB       THR  98   4.596   9.516  -0.363
  326    HG1  THR  98           HG1      THR  98   5.891   9.481   1.362
  327   HG21  THR  98          HG21      THR  98   2.746   8.714   1.083
  328   HG22  THR  98          HG22      THR  98   3.312   7.057   0.820
  329   HG23  THR  98          HG23      THR  98   2.703   8.007  -0.536
  330    H    THR  99           HN       THR  99   7.494   6.567   0.059
  331    HA   THR  99           HA       THR  99   9.186   8.289  -1.591
  332    HB   THR  99           HB       THR  99   9.452   7.607   1.331
  333    HG1  THR  99           HG1      THR  99   8.389   9.600   0.548
  334   HG21  THR  99          HG21      THR  99  11.558   7.126   0.026
  335   HG22  THR  99          HG22      THR  99  11.703   8.273   1.358
  336   HG23  THR  99          HG23      THR  99  11.638   8.856  -0.309
  337    H    SER 100           HN       SER 100  10.632   7.190  -2.739
  338    HA   SER 100           HA       SER 100  10.441   4.387  -2.944
  339    HB2  SER 100           HB2      SER 100  12.409   4.780  -4.564
  340    HB3  SER 100           HB1      SER 100  10.862   5.547  -4.936
  341    HG   SER 100           HG       SER 100  13.013   6.820  -4.898
  342    H    GLY 101           HN       GLY 101  12.611   6.542  -1.277
  343    HA2  GLY 101           HA2      GLY 101  14.634   4.628  -0.699
  344    HA3  GLY 101           HA1      GLY 101  14.368   6.135   0.145
  345    H    ASN 102           HN       ASN 102  11.833   5.805   1.201
  346    HA   ASN 102           HA       ASN 102  12.162   4.092   3.405
  347    HB2  ASN 102           HB2      ASN 102   9.657   5.179   2.106
  348    HB3  ASN 102           HB1      ASN 102   9.641   4.236   3.587
  349   HD21  ASN 102          HD21      ASN 102  10.498   5.120   5.472
  350   HD22  ASN 102          HD22      ASN 102  10.729   6.827   5.654
  351    H    LEU 103           HN       LEU 103  10.744   3.758   0.257
  352    HA   LEU 103           HA       LEU 103   9.534   1.276   0.614
  353    HB2  LEU 103           HB2      LEU 103   8.894   2.518  -1.245
  354    HB3  LEU 103           HB1      LEU 103  10.559   2.854  -1.703
  355    HG   LEU 103           HG       LEU 103  10.771   0.402  -2.265
  356   HD11  LEU 103          HD11      LEU 103   8.678  -0.145  -0.923
  357   HD12  LEU 103          HD12      LEU 103   8.873  -0.936  -2.488
  358   HD13  LEU 103          HD13      LEU 103   7.772   0.453  -2.324
  359   HD21  LEU 103          HD21      LEU 103   9.556   0.741  -4.407
  360   HD22  LEU 103          HD22      LEU 103  10.605   2.083  -3.937
  361   HD23  LEU 103          HD23      LEU 103   8.864   2.202  -3.700
  362    H    LYS 104           HN       LYS 104  12.622   2.274  -0.702
  363    HA   LYS 104           HA       LYS 104  13.689  -0.134  -1.492
  364    HB2  LYS 104           HB2      LYS 104  14.543   2.115  -2.015
  365    HB3  LYS 104           HB1      LYS 104  15.071   2.295  -0.351
  366    HG2  LYS 104           HG2      LYS 104  16.613   0.432  -0.640
  367    HG3  LYS 104           HG1      LYS 104  16.097   0.270  -2.325
  368    HD2  LYS 104           HD2      LYS 104  17.307   2.753  -1.119
  369    HD3  LYS 104           HD1      LYS 104  18.209   1.556  -2.052
  370    HE2  LYS 104           HE2      LYS 104  15.921   3.270  -3.018
  371    HE3  LYS 104           HE1      LYS 104  17.618   3.422  -3.471
  372    HZ1  LYS 104           HZ1      LYS 104  17.459   1.160  -4.434
  373    HZ2  LYS 104           HZ2      LYS 104  16.463   2.295  -5.206
  374    HZ3  LYS 104           HZ3      LYS 104  15.790   1.179  -4.127
  375    H    ARG 105           HN       ARG 105  14.012   1.508   1.668
  376    HA   ARG 105           HA       ARG 105  15.655  -0.387   2.886
  377    HB2  ARG 105           HB2      ARG 105  13.435   1.197   4.192
  378    HB3  ARG 105           HB1      ARG 105  14.772   0.418   5.025
  379    HG2  ARG 105           HG2      ARG 105  16.319   1.899   3.724
  380    HG3  ARG 105           HG1      ARG 105  14.890   2.774   3.162
  381    HD2  ARG 105           HD2      ARG 105  14.281   3.223   5.508
  382    HD3  ARG 105           HD1      ARG 105  15.759   2.411   6.026
  383    HE   ARG 105           HE       ARG 105  15.771   4.842   4.345
  384   HH11  ARG 105          HH11      ARG 105  16.943   2.987   7.071
  385   HH12  ARG 105          HH12      ARG 105  18.191   4.123   7.477
  386   HH21  ARG 105          HH21      ARG 105  17.404   6.335   4.866
  387   HH22  ARG 105          HH22      ARG 105  18.467   6.031   6.205
  388    H    HIS 106           HN       HIS 106  12.158  -0.261   2.543
  389    HA   HIS 106           HA       HIS 106  11.665  -2.662   3.997
  390    HB2  HIS 106           HB2      HIS 106   9.932  -0.962   3.757
  391    HB3  HIS 106           HB1      HIS 106   9.942  -1.171   2.008
  392    HD1  HIS 106           HD1      HIS 106   8.794  -2.880   5.173
  393    HD2  HIS 106           HD2      HIS 106   8.590  -3.312   1.052
  394    HE1  HIS 106           HE1      HIS 106   7.139  -4.744   4.740
  395    H    GLN 107           HN       GLN 107  12.764  -2.068   0.809
  396    HA   GLN 107           HA       GLN 107  11.829  -4.555  -0.277
  397    HB2  GLN 107           HB2      GLN 107  13.924  -2.645  -1.349
  398    HB3  GLN 107           HB1      GLN 107  13.110  -3.912  -2.255
  399    HG2  GLN 107           HG2      GLN 107  11.421  -1.860  -1.014
  400    HG3  GLN 107           HG1      GLN 107  12.444  -1.362  -2.358
  401   HE21  GLN 107          HE21      GLN 107  10.754  -1.005  -3.705
  402   HE22  GLN 107          HE22      GLN 107   9.808  -2.279  -4.412
  403    H    LEU 108           HN       LEU 108  14.450  -3.180   1.379
  404    HA   LEU 108           HA       LEU 108  16.383  -5.229   0.822
  405    HB2  LEU 108           HB2      LEU 108  16.306  -2.865   2.656
  406    HB3  LEU 108           HB1      LEU 108  17.617  -4.030   2.708
  407    HG   LEU 108           HG       LEU 108  18.657  -3.132   0.941
  408   HD11  LEU 108          HD11      LEU 108  17.071  -4.048  -0.648
  409   HD12  LEU 108          HD12      LEU 108  17.563  -2.423  -1.128
  410   HD13  LEU 108          HD13      LEU 108  15.984  -2.684  -0.379
  411   HD21  LEU 108          HD21      LEU 108  16.635  -0.945   1.398
  412   HD22  LEU 108          HD22      LEU 108  18.170  -0.764   0.542
  413   HD23  LEU 108          HD23      LEU 108  18.161  -1.161   2.261
  414    H    VAL 109           HN       VAL 109  14.001  -4.550   3.274
  415    HA   VAL 109           HA       VAL 109  15.087  -6.290   5.197
  416    HB   VAL 109           HB       VAL 109  12.957  -6.212   6.279
  417   HG11  VAL 109          HG11      VAL 109  13.353  -3.597   4.857
  418   HG12  VAL 109          HG12      VAL 109  14.242  -4.118   6.293
  419   HG13  VAL 109          HG13      VAL 109  12.502  -3.837   6.383
  420   HG21  VAL 109          HG21      VAL 109  11.890  -5.216   3.663
  421   HG22  VAL 109          HG22      VAL 109  10.960  -5.318   5.163
  422   HG23  VAL 109          HG23      VAL 109  11.567  -6.788   4.396
  423    H    HIS 110           HN       HIS 110  13.410  -6.752   2.219
  424    HA   HIS 110           HA       HIS 110  12.587  -9.467   2.837
  425    HB2  HIS 110           HB2      HIS 110  12.502  -7.775   0.371
  426    HB3  HIS 110           HB1      HIS 110  12.100  -9.470   0.313
  427    HD1  HIS 110           HD1      HIS 110   9.759 -10.135   1.176
  428    HD2  HIS 110           HD2      HIS 110  10.785  -6.164   1.730
  429    HE1  HIS 110           HE1      HIS 110   7.604  -8.907   1.706
  430    H    SER 111           HN       SER 111  15.562  -8.191   2.195
  431    HA   SER 111           HA       SER 111  16.792 -10.698   1.784
  432    HB2  SER 111           HB2      SER 111  15.745 -10.091  -0.546
  433    HB3  SER 111           HB1      SER 111  17.093  -8.961  -0.657
  434    HG   SER 111           HG       SER 111  17.210 -11.783  -0.342
  435    H    GLY 112           HN       GLY 112  17.188  -8.801   3.609
  436    HA2  GLY 112           HA2      GLY 112  19.589  -7.314   2.773
  437    HA3  GLY 112           HA1      GLY 112  18.364  -6.665   3.865
  Start of MODEL   20
    1    H    LYS  58           HT1      LYS  58 -18.198  -4.802  -5.605
    2    HA   LYS  58           HA       LYS  58 -18.517  -7.448  -4.321
    3    HB2  LYS  58           HB2      LYS  58 -16.434  -6.373  -6.227
    4    HB3  LYS  58           HB1      LYS  58 -16.202  -7.821  -5.264
    5    HG2  LYS  58           HG2      LYS  58 -18.068  -8.896  -6.369
    6    HG3  LYS  58           HG1      LYS  58 -18.388  -7.430  -7.299
    7    HD2  LYS  58           HD2      LYS  58 -16.265  -7.614  -8.417
    8    HD3  LYS  58           HD1      LYS  58 -15.799  -8.972  -7.392
    9    HE2  LYS  58           HE2      LYS  58 -16.503  -9.736  -9.599
   10    HE3  LYS  58           HE1      LYS  58 -17.595 -10.320  -8.345
   11    HZ1  LYS  58           HZ1      LYS  58 -18.132  -7.916 -10.000
   12    HZ2  LYS  58           HZ2      LYS  58 -19.208  -8.711  -8.953
   13    HZ3  LYS  58           HZ3      LYS  58 -18.701  -9.468 -10.382
   14    HA   PRO  59           HA       PRO  59 -16.760  -5.218  -0.915
   15    HB2  PRO  59           HB2      PRO  59 -16.226  -7.885   0.206
   16    HB3  PRO  59           HB1      PRO  59 -17.230  -6.579   0.844
   17    HG2  PRO  59           HG2      PRO  59 -18.292  -8.828  -0.177
   18    HG3  PRO  59           HG1      PRO  59 -19.086  -7.251  -0.340
   19    HD2  PRO  59           HD2      PRO  59 -17.491  -8.786  -2.351
   20    HD3  PRO  59           HD1      PRO  59 -18.953  -7.810  -2.571
   21    H    TYR  60           HN       TYR  60 -14.901  -4.385  -1.225
   22    HA   TYR  60           HA       TYR  60 -12.488  -6.093  -1.252
   23    HB2  TYR  60           HB2      TYR  60 -12.904  -3.368  -2.517
   24    HB3  TYR  60           HB1      TYR  60 -11.362  -4.220  -2.447
   25    HD1  TYR  60           HD2      TYR  60 -11.963  -6.902  -3.200
   26    HD2  TYR  60           HD1      TYR  60 -13.626  -3.290  -4.697
   27    HE1  TYR  60           HE2      TYR  60 -12.515  -8.034  -5.300
   28    HE2  TYR  60           HE1      TYR  60 -14.182  -4.416  -6.802
   29    HH   TYR  60           HH       TYR  60 -14.036  -7.816  -7.172
   30    H    GLY  61           HN       GLY  61 -11.681  -5.984   0.805
   31    HA2  GLY  61           HA2      GLY  61 -12.125  -3.439   2.194
   32    HA3  GLY  61           HA1      GLY  61 -12.326  -4.999   2.975
   33    H    CYS  62           HN       CYS  62 -10.795  -2.818   3.758
   34    HA   CYS  62           HA       CYS  62  -8.008  -3.388   3.483
   35    HB2  CYS  62           HB2      CYS  62  -8.863  -1.144   3.979
   36    HB3  CYS  62           HB1      CYS  62  -9.546  -1.721   5.487
   37    H    GLU  63           HN       GLU  63  -6.706  -4.537   4.840
   38    HA   GLU  63           HA       GLU  63  -8.024  -6.330   6.727
   39    HB2  GLU  63           HB2      GLU  63  -6.401  -7.248   5.118
   40    HB3  GLU  63           HB1      GLU  63  -5.155  -6.191   5.763
   41    HG2  GLU  63           HG2      GLU  63  -5.540  -7.346   7.989
   42    HG3  GLU  63           HG1      GLU  63  -6.465  -8.542   7.081
   43    H    GLU  64           HN       GLU  64  -6.159  -3.451   6.662
   44    HA   GLU  64           HA       GLU  64  -4.941  -3.859   9.237
   45    HB2  GLU  64           HB2      GLU  64  -3.402  -2.626   8.233
   46    HB3  GLU  64           HB1      GLU  64  -4.480  -2.258   6.909
   47    HG2  GLU  64           HG2      GLU  64  -5.148  -0.684   9.201
   48    HG3  GLU  64           HG1      GLU  64  -3.441  -0.497   8.794
   49    H    CYS  65           HN       CYS  65  -7.535  -1.879   7.865
   50    HA   CYS  65           HA       CYS  65  -8.136  -1.012  10.613
   51    HB2  CYS  65           HB2      CYS  65  -9.244   0.955   9.616
   52    HB3  CYS  65           HB1      CYS  65  -7.531   0.884   9.206
   53    H    GLY  66           HN       GLY  66  -9.207  -2.456   7.693
   54    HA2  GLY  66           HA2      GLY  66 -10.661  -4.228   7.651
   55    HA3  GLY  66           HA1      GLY  66 -11.279  -3.733   9.224
   56    H    LYS  67           HN       LYS  67 -11.071  -1.356   6.715
   57    HA   LYS  67           HA       LYS  67 -13.982  -1.243   6.625
   58    HB2  LYS  67           HB2      LYS  67 -11.982   0.607   5.314
   59    HB3  LYS  67           HB1      LYS  67 -13.709   0.882   5.489
   60    HG2  LYS  67           HG2      LYS  67 -13.344   0.814   7.985
   61    HG3  LYS  67           HG1      LYS  67 -11.613   0.862   7.638
   62    HD2  LYS  67           HD2      LYS  67 -12.400   3.100   8.069
   63    HD3  LYS  67           HD1      LYS  67 -11.965   2.955   6.364
   64    HE2  LYS  67           HE2      LYS  67 -14.060   4.175   6.618
   65    HE3  LYS  67           HE1      LYS  67 -14.328   2.641   5.791
   66    HZ1  LYS  67           HZ1      LYS  67 -14.822   3.141   8.677
   67    HZ2  LYS  67           HZ2      LYS  67 -15.121   1.691   7.858
   68    HZ3  LYS  67           HZ3      LYS  67 -16.018   3.082   7.475
   69    H    SER  68           HN       SER  68 -15.115  -2.189   5.052
   70    HA   SER  68           HA       SER  68 -13.730  -3.114   2.673
   71    HB2  SER  68           HB2      SER  68 -16.546  -3.698   2.666
   72    HB3  SER  68           HB1      SER  68 -15.176  -4.811   2.733
   73    HG   SER  68           HG       SER  68 -16.146  -5.164   4.628
   74    H    TYR  69           HN       TYR  69 -13.984  -2.334   0.683
   75    HA   TYR  69           HA       TYR  69 -15.971  -0.192   0.287
   76    HB2  TYR  69           HB2      TYR  69 -13.163  -0.488  -0.737
   77    HB3  TYR  69           HB1      TYR  69 -14.332   0.504  -1.602
   78    HD1  TYR  69           HD2      TYR  69 -12.495   0.092   1.547
   79    HD2  TYR  69           HD1      TYR  69 -15.004   2.638  -0.745
   80    HE1  TYR  69           HE2      TYR  69 -12.009   1.928   3.085
   81    HE2  TYR  69           HE1      TYR  69 -14.514   4.497   0.781
   82    HH   TYR  69           HH       TYR  69 -13.747   4.657   3.328
   83    H    ARG  70           HN       ARG  70 -16.657   0.072  -2.001
   84    HA   ARG  70           HA       ARG  70 -17.487  -2.516  -2.993
   85    HB2  ARG  70           HB2      ARG  70 -18.168   0.253  -3.990
   86    HB3  ARG  70           HB1      ARG  70 -18.941  -1.241  -4.499
   87    HG2  ARG  70           HG2      ARG  70 -19.002  -0.071  -1.728
   88    HG3  ARG  70           HG1      ARG  70 -20.313  -0.037  -2.908
   89    HD2  ARG  70           HD2      ARG  70 -20.458  -2.455  -2.859
   90    HD3  ARG  70           HD1      ARG  70 -19.087  -2.537  -1.752
   91    HE   ARG  70           HE       ARG  70 -20.713  -1.044  -0.323
   92   HH11  ARG  70          HH11      ARG  70 -21.432  -3.930  -2.178
   93   HH12  ARG  70          HH12      ARG  70 -22.796  -4.360  -1.195
   94   HH21  ARG  70          HH21      ARG  70 -22.495  -1.605   0.960
   95   HH22  ARG  70          HH22      ARG  70 -23.410  -3.041   0.583
   96    H    LEU  71           HN       LEU  71 -15.509   0.198  -4.149
   97    HA   LEU  71           HA       LEU  71 -14.895  -1.374  -6.547
   98    HB2  LEU  71           HB2      LEU  71 -14.401   1.552  -5.976
   99    HB3  LEU  71           HB1      LEU  71 -13.961   0.723  -7.461
  100    HG   LEU  71           HG       LEU  71 -15.880   1.561  -8.224
  101   HD11  LEU  71          HD11      LEU  71 -17.182  -0.522  -6.512
  102   HD12  LEU  71          HD12      LEU  71 -16.355  -0.850  -8.038
  103   HD13  LEU  71          HD13      LEU  71 -17.802   0.161  -8.018
  104   HD21  LEU  71          HD21      LEU  71 -17.100   1.668  -5.493
  105   HD22  LEU  71          HD22      LEU  71 -17.646   2.498  -6.952
  106   HD23  LEU  71          HD23      LEU  71 -16.120   2.958  -6.190
  107    H    ILE  72           HN       ILE  72 -12.719  -1.587  -7.243
  108    HA   ILE  72           HA       ILE  72 -10.813  -2.023  -5.202
  109    HB   ILE  72           HB       ILE  72 -10.551  -1.828  -8.197
  110   HG12  ILE  72          HG12      ILE  72 -11.670  -3.790  -7.144
  111   HG13  ILE  72          HG11      ILE  72 -10.232  -4.216  -8.063
  112   HG21  ILE  72          HG21      ILE  72  -8.451  -1.026  -7.266
  113   HG22  ILE  72          HG22      ILE  72  -8.246  -2.625  -7.982
  114   HG23  ILE  72          HG23      ILE  72  -8.356  -2.451  -6.232
  115   HD11  ILE  72          HD11      ILE  72 -10.362  -5.442  -5.962
  116   HD12  ILE  72          HD12      ILE  72 -10.390  -3.919  -5.069
  117   HD13  ILE  72          HD13      ILE  72  -8.956  -4.375  -5.994
  118    H    SER  73           HN       SER  73 -11.310   0.623  -7.498
  119    HA   SER  73           HA       SER  73  -9.075   2.146  -6.722
  120    HB2  SER  73           HB2      SER  73 -10.398   4.045  -7.783
  121    HB3  SER  73           HB1      SER  73 -10.108   2.643  -8.814
  122    HG   SER  73           HG       SER  73 -12.226   2.922  -9.058
  123    H    LEU  74           HN       LEU  74 -12.373   2.013  -5.555
  124    HA   LEU  74           HA       LEU  74 -12.413   4.080  -3.756
  125    HB2  LEU  74           HB2      LEU  74 -13.823   1.605  -4.230
  126    HB3  LEU  74           HB1      LEU  74 -13.663   1.904  -2.502
  127    HG   LEU  74           HG       LEU  74 -14.937   3.732  -4.526
  128   HD11  LEU  74          HD11      LEU  74 -16.968   3.309  -3.234
  129   HD12  LEU  74          HD12      LEU  74 -16.077   2.213  -2.176
  130   HD13  LEU  74          HD13      LEU  74 -16.311   1.802  -3.876
  131   HD21  LEU  74          HD21      LEU  74 -13.726   5.022  -2.972
  132   HD22  LEU  74          HD22      LEU  74 -14.272   4.026  -1.626
  133   HD23  LEU  74          HD23      LEU  74 -15.417   5.079  -2.474
  134    H    LEU  75           HN       LEU  75 -11.481   0.773  -3.138
  135    HA   LEU  75           HA       LEU  75 -10.589   1.282  -0.491
  136    HB2  LEU  75           HB2      LEU  75 -11.361  -0.876  -0.952
  137    HB3  LEU  75           HB1      LEU  75 -10.425  -0.983  -2.441
  138    HG   LEU  75           HG       LEU  75  -8.368  -0.929  -0.902
  139   HD11  LEU  75          HD11      LEU  75 -10.491  -1.760   1.065
  140   HD12  LEU  75          HD12      LEU  75  -9.525  -0.283   1.136
  141   HD13  LEU  75          HD13      LEU  75  -8.747  -1.857   1.322
  142   HD21  LEU  75          HD21      LEU  75  -8.992  -2.789  -2.227
  143   HD22  LEU  75          HD22      LEU  75 -10.291  -3.217  -1.107
  144   HD23  LEU  75          HD23      LEU  75  -8.602  -3.382  -0.605
  145    H    ASN  76           HN       ASN  76  -9.281   1.402  -3.637
  146    HA   ASN  76           HA       ASN  76  -6.512   1.212  -3.017
  147    HB2  ASN  76           HB2      ASN  76  -7.957   1.235  -5.327
  148    HB3  ASN  76           HB1      ASN  76  -7.306   2.876  -5.331
  149   HD21  ASN  76          HD21      ASN  76  -6.586  -0.514  -5.431
  150   HD22  ASN  76          HD22      ASN  76  -4.948  -0.362  -5.980
  151    H    LEU  77           HN       LEU  77  -8.835   3.828  -3.374
  152    HA   LEU  77           HA       LEU  77  -6.882   5.846  -2.822
  153    HB2  LEU  77           HB2      LEU  77  -9.759   5.703  -3.482
  154    HB3  LEU  77           HB1      LEU  77  -9.228   7.111  -2.592
  155    HG   LEU  77           HG       LEU  77  -9.326   7.341  -5.105
  156   HD11  LEU  77          HD11      LEU  77  -7.240   8.610  -5.184
  157   HD12  LEU  77          HD12      LEU  77  -6.702   7.794  -3.712
  158   HD13  LEU  77          HD13      LEU  77  -8.104   8.862  -3.667
  159   HD21  LEU  77          HD21      LEU  77  -7.448   6.463  -6.385
  160   HD22  LEU  77          HD22      LEU  77  -8.404   5.153  -5.688
  161   HD23  LEU  77          HD23      LEU  77  -6.863   5.606  -4.958
  162    H    HIS  78           HN       HIS  78  -9.043   3.852  -1.050
  163    HA   HIS  78           HA       HIS  78  -8.956   5.246   1.417
  164    HB2  HIS  78           HB2      HIS  78 -10.563   3.514   1.236
  165    HB3  HIS  78           HB1      HIS  78  -9.368   2.351   0.663
  166    HD1  HIS  78           HD1      HIS  78 -10.436   4.121   3.839
  167    HD2  HIS  78           HD2      HIS  78  -8.137   0.884   2.603
  168    HE1  HIS  78           HE1      HIS  78  -9.823   2.849   5.930
  169    H    LYS  79           HN       LYS  79  -6.921   2.798  -0.078
  170    HA   LYS  79           HA       LYS  79  -5.142   2.548   2.158
  171    HB2  LYS  79           HB2      LYS  79  -5.644   0.790   0.373
  172    HB3  LYS  79           HB1      LYS  79  -4.628   1.729  -0.713
  173    HG2  LYS  79           HG2      LYS  79  -2.718   1.388   0.748
  174    HG3  LYS  79           HG1      LYS  79  -3.732   0.499   1.887
  175    HD2  LYS  79           HD2      LYS  79  -3.150  -0.295  -0.968
  176    HD3  LYS  79           HD1      LYS  79  -2.448  -1.028   0.475
  177    HE2  LYS  79           HE2      LYS  79  -4.679  -1.748   1.192
  178    HE3  LYS  79           HE1      LYS  79  -5.382  -1.004  -0.243
  179    HZ1  LYS  79           HZ1      LYS  79  -5.091  -3.390  -0.513
  180    HZ2  LYS  79           HZ2      LYS  79  -3.424  -3.238  -0.252
  181    HZ3  LYS  79           HZ3      LYS  79  -4.135  -2.535  -1.620
  182    H    LYS  80           HN       LYS  80  -5.244   4.297  -0.865
  183    HA   LYS  80           HA       LYS  80  -2.734   5.573  -0.674
  184    HB2  LYS  80           HB2      LYS  80  -3.785   5.602  -2.785
  185    HB3  LYS  80           HB1      LYS  80  -5.301   6.190  -2.123
  186    HG2  LYS  80           HG2      LYS  80  -4.461   8.366  -1.882
  187    HG3  LYS  80           HG1      LYS  80  -2.798   7.849  -2.115
  188    HD2  LYS  80           HD2      LYS  80  -4.938   7.651  -4.234
  189    HD3  LYS  80           HD1      LYS  80  -3.839   9.025  -4.074
  190    HE2  LYS  80           HE2      LYS  80  -1.940   7.487  -4.289
  191    HE3  LYS  80           HE1      LYS  80  -3.068   6.159  -4.543
  192    HZ1  LYS  80           HZ1      LYS  80  -2.099   7.131  -6.612
  193    HZ2  LYS  80           HZ2      LYS  80  -2.954   8.558  -6.290
  194    HZ3  LYS  80           HZ3      LYS  80  -3.795   7.114  -6.578
  195    H    ARG  81           HN       ARG  81  -5.939   6.346   0.569
  196    HA   ARG  81           HA       ARG  81  -5.481   8.963   1.431
  197    HB2  ARG  81           HB2      ARG  81  -7.693   7.975   1.320
  198    HB3  ARG  81           HB1      ARG  81  -7.280   6.835   2.588
  199    HG2  ARG  81           HG2      ARG  81  -7.220   8.547   4.225
  200    HG3  ARG  81           HG1      ARG  81  -7.307   9.812   2.996
  201    HD2  ARG  81           HD2      ARG  81  -9.531   9.118   2.383
  202    HD3  ARG  81           HD1      ARG  81  -9.448   7.753   3.495
  203    HE   ARG  81           HE       ARG  81  -9.137   9.697   5.224
  204   HH11  ARG  81          HH11      ARG  81 -11.230   9.695   2.408
  205   HH12  ARG  81          HH12      ARG  81 -12.476  10.643   3.169
  206   HH21  ARG  81          HH21      ARG  81 -10.761  10.971   6.215
  207   HH22  ARG  81          HH22      ARG  81 -12.208  11.369   5.336
  208    H    HIS  82           HN       HIS  82  -4.942   5.896   3.129
  209    HA   HIS  82           HA       HIS  82  -4.376   6.896   5.657
  210    HB2  HIS  82           HB2      HIS  82  -3.472   4.417   4.231
  211    HB3  HIS  82           HB1      HIS  82  -2.923   4.773   5.852
  212    HD1  HIS  82           HD1      HIS  82  -5.133   5.221   7.568
  213    HD2  HIS  82           HD2      HIS  82  -5.625   2.919   4.146
  214    HE1  HIS  82           HE1      HIS  82  -7.122   3.739   7.980
  215    H    SER  83           HN       SER  83  -2.103   6.253   2.991
  216    HA   SER  83           HA       SER  83   0.030   7.457   4.601
  217    HB2  SER  83           HB2      SER  83   0.394   5.177   3.646
  218    HB3  SER  83           HB1      SER  83   0.270   5.877   2.034
  219    HG   SER  83           HG       SER  83   2.093   7.147   2.504
  220    H    GLY  84           HN       GLY  84  -2.060   9.016   3.226
  221    HA2  GLY  84           HA2      GLY  84  -2.017  11.119   2.238
  222    HA3  GLY  84           HA1      GLY  84  -0.294  10.914   1.941
  223    H    GLU  85           HN       GLU  85   0.082   8.948   0.361
  224    HA   GLU  85           HA       GLU  85  -1.974   8.431  -1.519
  225    HB2  GLU  85           HB2      GLU  85  -1.069   9.408  -3.488
  226    HB3  GLU  85           HB1      GLU  85  -1.238  10.681  -2.297
  227    HG2  GLU  85           HG2      GLU  85   1.216  10.362  -1.814
  228    HG3  GLU  85           HG1      GLU  85   1.242   9.342  -3.249
  229    H    ALA  86           HN       ALA  86  -1.577   6.670  -2.701
  230    HA   ALA  86           HA       ALA  86   0.628   5.035  -1.904
  231    HB1  ALA  86           HB1      ALA  86  -1.554   4.028  -2.190
  232    HB2  ALA  86           HB2      ALA  86  -0.416   3.336  -3.348
  233    HB3  ALA  86           HB3      ALA  86  -1.591   4.537  -3.879
  234    H    ARG  87           HN       ARG  87   2.484   5.834  -2.669
  235    HA   ARG  87           HA       ARG  87   2.754   6.553  -5.434
  236    HB2  ARG  87           HB2      ARG  87   4.817   6.385  -3.256
  237    HB3  ARG  87           HB1      ARG  87   5.040   7.132  -4.833
  238    HG2  ARG  87           HG2      ARG  87   3.021   7.959  -2.788
  239    HG3  ARG  87           HG1      ARG  87   4.611   8.692  -3.014
  240    HD2  ARG  87           HD2      ARG  87   2.389   8.539  -5.032
  241    HD3  ARG  87           HD1      ARG  87   2.883   9.985  -4.148
  242    HE   ARG  87           HE       ARG  87   4.765   8.628  -5.974
  243   HH11  ARG  87          HH11      ARG  87   2.912  11.460  -5.068
  244   HH12  ARG  87          HH12      ARG  87   3.775  12.528  -6.137
  245   HH21  ARG  87          HH21      ARG  87   5.877  10.008  -7.403
  246   HH22  ARG  87          HH22      ARG  87   5.469  11.700  -7.469
  247    H    TYR  88           HN       TYR  88   5.182   4.827  -3.727
  248    HA   TYR  88           HA       TYR  88   5.459   2.927  -5.908
  249    HB2  TYR  88           HB2      TYR  88   7.105   3.372  -3.415
  250    HB3  TYR  88           HB1      TYR  88   7.518   2.278  -4.726
  251    HD1  TYR  88           HD1      TYR  88   6.760   5.857  -4.075
  252    HD2  TYR  88           HD2      TYR  88   8.869   3.027  -6.430
  253    HE1  TYR  88           HE1      TYR  88   7.914   7.687  -5.212
  254    HE2  TYR  88           HE2      TYR  88  10.041   4.847  -7.584
  255    HH   TYR  88           HH       TYR  88   9.711   7.217  -8.074
  256    H    ARG  89           HN       ARG  89   5.400   0.700  -5.660
  257    HA   ARG  89           HA       ARG  89   4.335  -0.310  -3.109
  258    HB2  ARG  89           HB2      ARG  89   4.043  -1.216  -5.919
  259    HB3  ARG  89           HB1      ARG  89   4.255  -2.470  -4.715
  260    HG2  ARG  89           HG2      ARG  89   2.309  -1.817  -3.568
  261    HG3  ARG  89           HG1      ARG  89   2.146  -0.361  -4.560
  262    HD2  ARG  89           HD2      ARG  89   1.938  -1.838  -6.545
  263    HD3  ARG  89           HD1      ARG  89   1.889  -3.203  -5.434
  264    HE   ARG  89           HE       ARG  89  -0.172  -2.262  -4.515
  265   HH11  ARG  89          HH11      ARG  89   0.907  -1.065  -7.621
  266   HH12  ARG  89          HH12      ARG  89  -0.689  -0.636  -8.164
  267   HH21  ARG  89          HH21      ARG  89  -2.278  -1.728  -5.226
  268   HH22  ARG  89          HH22      ARG  89  -2.514  -1.031  -6.801
  269    H    CYS  90           HN       CYS  90   5.347  -2.085  -2.243
  270    HA   CYS  90           HA       CYS  90   8.108  -2.553  -2.815
  271    HB2  CYS  90           HB2      CYS  90   6.708  -2.897  -0.633
  272    HB3  CYS  90           HB1      CYS  90   6.317  -4.442  -1.340
  273    H    GLU  91           HN       GLU  91   8.860  -3.888  -4.374
  274    HA   GLU  91           HA       GLU  91   7.155  -5.048  -6.266
  275    HB2  GLU  91           HB2      GLU  91   9.272  -6.112  -7.134
  276    HB3  GLU  91           HB1      GLU  91   9.279  -4.353  -7.013
  277    HG2  GLU  91           HG2      GLU  91  10.431  -4.568  -4.872
  278    HG3  GLU  91           HG1      GLU  91  10.506  -6.306  -5.100
  279    H    ASP  92           HN       ASP  92   7.598  -6.124  -3.252
  280    HA   ASP  92           HA       ASP  92   7.402  -8.949  -4.038
  281    HB2  ASP  92           HB2      ASP  92   8.292  -9.384  -1.677
  282    HB3  ASP  92           HB1      ASP  92   9.434  -8.774  -2.871
  283    H    CYS  93           HN       CYS  93   6.134  -6.417  -1.869
  284    HA   CYS  93           HA       CYS  93   4.098  -8.350  -1.102
  285    HB2  CYS  93           HB2      CYS  93   4.340  -7.852   1.184
  286    HB3  CYS  93           HB1      CYS  93   5.973  -8.090   0.584
  287    H    GLY  94           HN       GLY  94   4.681  -5.519  -2.570
  288    HA2  GLY  94           HA2      GLY  94   3.411  -3.836  -3.292
  289    HA3  GLY  94           HA1      GLY  94   2.019  -4.825  -2.883
  290    H    LYS  95           HN       LYS  95   4.375  -3.636  -0.565
  291    HA   LYS  95           HA       LYS  95   2.395  -2.068   0.776
  292    HB2  LYS  95           HB2      LYS  95   5.316  -2.591   1.246
  293    HB3  LYS  95           HB1      LYS  95   4.432  -1.368   2.171
  294    HG2  LYS  95           HG2      LYS  95   2.774  -3.111   2.710
  295    HG3  LYS  95           HG1      LYS  95   3.848  -4.306   1.993
  296    HD2  LYS  95           HD2      LYS  95   5.551  -3.762   3.629
  297    HD3  LYS  95           HD1      LYS  95   4.519  -2.500   4.320
  298    HE2  LYS  95           HE2      LYS  95   2.812  -4.237   4.788
  299    HE3  LYS  95           HE1      LYS  95   3.955  -5.460   4.240
  300    HZ1  LYS  95           HZ1      LYS  95   4.315  -3.637   6.562
  301    HZ2  LYS  95           HZ2      LYS  95   5.470  -4.751   6.019
  302    HZ3  LYS  95           HZ3      LYS  95   3.992  -5.301   6.630
  303    H    LEU  96           HN       LEU  96   2.150   0.109   0.699
  304    HA   LEU  96           HA       LEU  96   3.395   1.354  -1.617
  305    HB2  LEU  96           HB2      LEU  96   0.957   1.999  -0.011
  306    HB3  LEU  96           HB1      LEU  96   1.599   3.126  -1.193
  307    HG   LEU  96           HG       LEU  96  -0.220   1.935  -2.191
  308   HD11  LEU  96          HD11      LEU  96   1.711   2.344  -3.630
  309   HD12  LEU  96          HD12      LEU  96   0.858   0.865  -4.087
  310   HD13  LEU  96          HD13      LEU  96   2.373   0.767  -3.180
  311   HD21  LEU  96          HD21      LEU  96   1.211  -0.588  -1.420
  312   HD22  LEU  96          HD22      LEU  96  -0.259  -0.492  -2.394
  313   HD23  LEU  96          HD23      LEU  96  -0.284   0.017  -0.703
  314    H    PHE  97           HN       PHE  97   5.016   2.647  -1.391
  315    HA   PHE  97           HA       PHE  97   5.217   4.240   1.089
  316    HB2  PHE  97           HB2      PHE  97   7.529   3.231  -0.586
  317    HB3  PHE  97           HB1      PHE  97   7.658   4.215   0.868
  318    HD1  PHE  97           HD2      PHE  97   6.609   0.885  -0.385
  319    HD2  PHE  97           HD1      PHE  97   7.528   3.274   3.021
  320    HE1  PHE  97           HE2      PHE  97   6.496  -1.129   1.050
  321    HE2  PHE  97           HE1      PHE  97   7.439   1.273   4.451
  322    HZ   PHE  97           HZ       PHE  97   6.921  -0.925   3.466
  323    H    THR  98           HN       THR  98   5.618   6.329   0.946
  324    HA   THR  98           HA       THR  98   5.036   7.589  -1.580
  325    HB   THR  98           HB       THR  98   4.942   9.648  -0.237
  326    HG1  THR  98           HG1      THR  98   6.130   9.682   1.535
  327   HG21  THR  98          HG21      THR  98   3.158   8.877   1.344
  328   HG22  THR  98          HG22      THR  98   3.615   7.213   0.951
  329   HG23  THR  98          HG23      THR  98   2.969   8.275  -0.303
  330    H    THR  99           HN       THR  99   7.738   6.586   0.068
  331    HA   THR  99           HA       THR  99   9.471   8.348  -1.510
  332    HB   THR  99           HB       THR  99   9.835   7.341   1.319
  333    HG1  THR  99           HG1      THR  99  10.065  10.042   0.544
  334   HG21  THR  99          HG21      THR  99  11.883   7.237  -0.119
  335   HG22  THR  99          HG22      THR  99  12.014   8.237   1.328
  336   HG23  THR  99          HG23      THR  99  11.790   8.991  -0.254
  337    H    SER 100           HN       SER 100  10.867   7.254  -2.775
  338    HA   SER 100           HA       SER 100  10.607   4.459  -3.070
  339    HB2  SER 100           HB2      SER 100  12.451   4.786  -4.778
  340    HB3  SER 100           HB1      SER 100  11.002   5.770  -5.024
  341    HG   SER 100           HG       SER 100  13.333   6.722  -5.022
  342    H    GLY 101           HN       GLY 101  12.888   6.523  -1.403
  343    HA2  GLY 101           HA2      GLY 101  14.803   4.423  -0.969
  344    HA3  GLY 101           HA1      GLY 101  14.794   5.983  -0.185
  345    H    ASN 102           HN       ASN 102  12.121   5.807   0.910
  346    HA   ASN 102           HA       ASN 102  12.495   4.241   3.233
  347    HB2  ASN 102           HB2      ASN 102   9.997   5.360   1.953
  348    HB3  ASN 102           HB1      ASN 102   9.952   4.419   3.434
  349   HD21  ASN 102          HD21      ASN 102   9.072   7.101   3.114
  350   HD22  ASN 102          HD22      ASN 102  10.049   8.092   4.154
  351    H    LEU 103           HN       LEU 103  10.892   3.830   0.181
  352    HA   LEU 103           HA       LEU 103   9.714   1.361   0.617
  353    HB2  LEU 103           HB2      LEU 103   9.062   2.579  -1.260
  354    HB3  LEU 103           HB1      LEU 103  10.724   2.871  -1.754
  355    HG   LEU 103           HG       LEU 103  10.874   0.417  -2.301
  356   HD11  LEU 103          HD11      LEU 103   8.804  -0.093  -0.887
  357   HD12  LEU 103          HD12      LEU 103   8.950  -0.889  -2.457
  358   HD13  LEU 103          HD13      LEU 103   7.872   0.513  -2.277
  359   HD21  LEU 103          HD21      LEU 103  10.686   2.067  -3.991
  360   HD22  LEU 103          HD22      LEU 103   8.966   2.262  -3.673
  361   HD23  LEU 103          HD23      LEU 103   9.562   0.763  -4.399
  362    H    LYS 104           HN       LYS 104  12.695   2.175  -1.060
  363    HA   LYS 104           HA       LYS 104  13.916  -0.180  -1.499
  364    HB2  LYS 104           HB2      LYS 104  14.790   1.825  -2.313
  365    HB3  LYS 104           HB1      LYS 104  14.947   2.509  -0.704
  366    HG2  LYS 104           HG2      LYS 104  16.843   1.278  -0.231
  367    HG3  LYS 104           HG1      LYS 104  16.523   0.104  -1.524
  368    HD2  LYS 104           HD2      LYS 104  17.243   3.007  -1.911
  369    HD3  LYS 104           HD1      LYS 104  18.365   1.653  -2.076
  370    HE2  LYS 104           HE2      LYS 104  15.891   2.148  -3.735
  371    HE3  LYS 104           HE1      LYS 104  17.556   2.405  -4.256
  372    HZ1  LYS 104           HZ1      LYS 104  16.685   0.318  -5.085
  373    HZ2  LYS 104           HZ2      LYS 104  16.350  -0.209  -3.515
  374    HZ3  LYS 104           HZ3      LYS 104  17.955   0.030  -4.001
  375    H    ARG 105           HN       ARG 105  14.177   1.687   1.541
  376    HA   ARG 105           HA       ARG 105  15.792  -0.073   2.949
  377    HB2  ARG 105           HB2      ARG 105  13.509   1.655   3.917
  378    HB3  ARG 105           HB1      ARG 105  14.625   0.824   4.992
  379    HG2  ARG 105           HG2      ARG 105  15.504   2.798   2.905
  380    HG3  ARG 105           HG1      ARG 105  15.119   3.243   4.571
  381    HD2  ARG 105           HD2      ARG 105  17.228   1.264   3.705
  382    HD3  ARG 105           HD1      ARG 105  17.526   2.911   4.266
  383    HE   ARG 105           HE       ARG 105  16.278   2.006   6.373
  384   HH11  ARG 105          HH11      ARG 105  18.642   0.322   4.406
  385   HH12  ARG 105          HH12      ARG 105  19.151  -0.730   5.694
  386   HH21  ARG 105          HH21      ARG 105  16.944   0.631   8.063
  387   HH22  ARG 105          HH22      ARG 105  18.182  -0.558   7.770
  388    H    HIS 106           HN       HIS 106  12.273  -0.080   2.579
  389    HA   HIS 106           HA       HIS 106  11.848  -2.410   4.174
  390    HB2  HIS 106           HB2      HIS 106  10.059  -0.780   3.889
  391    HB3  HIS 106           HB1      HIS 106  10.074  -1.031   2.145
  392    HD1  HIS 106           HD1      HIS 106   9.097  -2.834   5.353
  393    HD2  HIS 106           HD2      HIS 106   8.651  -3.104   1.232
  394    HE1  HIS 106           HE1      HIS 106   7.407  -4.671   4.942
  395    H    GLN 107           HN       GLN 107  12.981  -2.003   1.004
  396    HA   GLN 107           HA       GLN 107  11.841  -4.445  -0.043
  397    HB2  GLN 107           HB2      GLN 107  14.002  -2.778  -1.350
  398    HB3  GLN 107           HB1      GLN 107  12.908  -3.902  -2.131
  399    HG2  GLN 107           HG2      GLN 107  11.248  -2.006  -1.041
  400    HG3  GLN 107           HG1      GLN 107  12.638  -1.094  -1.548
  401   HE21  GLN 107          HE21      GLN 107  10.041  -3.114  -2.633
  402   HE22  GLN 107          HE22      GLN 107  10.178  -2.689  -4.319
  403    H    LEU 108           HN       LEU 108  14.576  -3.135   1.445
  404    HA   LEU 108           HA       LEU 108  16.441  -5.163   0.768
  405    HB2  LEU 108           HB2      LEU 108  16.411  -2.930   2.753
  406    HB3  LEU 108           HB1      LEU 108  17.681  -4.141   2.780
  407    HG   LEU 108           HG       LEU 108  18.769  -3.222   1.057
  408   HD11  LEU 108          HD11      LEU 108  17.716  -2.398  -0.974
  409   HD12  LEU 108          HD12      LEU 108  16.120  -2.560  -0.220
  410   HD13  LEU 108          HD13      LEU 108  17.108  -3.995  -0.530
  411   HD21  LEU 108          HD21      LEU 108  16.853  -0.971   1.634
  412   HD22  LEU 108          HD22      LEU 108  18.402  -0.816   0.799
  413   HD23  LEU 108          HD23      LEU 108  18.356  -1.314   2.492
  414    H    VAL 109           HN       VAL 109  14.251  -4.492   3.398
  415    HA   VAL 109           HA       VAL 109  15.383  -6.278   5.224
  416    HB   VAL 109           HB       VAL 109  13.393  -6.028   6.500
  417   HG11  VAL 109          HG11      VAL 109  13.020  -3.632   6.498
  418   HG12  VAL 109          HG12      VAL 109  13.737  -3.520   4.889
  419   HG13  VAL 109          HG13      VAL 109  14.734  -3.991   6.270
  420   HG21  VAL 109          HG21      VAL 109  11.325  -5.071   5.516
  421   HG22  VAL 109          HG22      VAL 109  11.762  -6.652   4.864
  422   HG23  VAL 109          HG23      VAL 109  12.096  -5.191   3.930
  423    H    HIS 110           HN       HIS 110  13.557  -6.753   2.377
  424    HA   HIS 110           HA       HIS 110  12.501  -9.337   3.123
  425    HB2  HIS 110           HB2      HIS 110  12.705  -7.807   0.572
  426    HB3  HIS 110           HB1      HIS 110  12.199  -9.480   0.556
  427    HD1  HIS 110           HD1      HIS 110   9.800  -9.970   1.355
  428    HD2  HIS 110           HD2      HIS 110  11.025  -6.043   1.803
  429    HE1  HIS 110           HE1      HIS 110   7.720  -8.635   1.875
  430    H    SER 111           HN       SER 111  15.631  -8.429   2.537
  431    HA   SER 111           HA       SER 111  16.429 -11.202   2.322
  432    HB2  SER 111           HB2      SER 111  17.419  -9.190   0.294
  433    HB3  SER 111           HB1      SER 111  17.959 -10.864   0.437
  434    HG   SER 111           HG       SER 111  15.300 -10.844   0.263
  435    H    GLY 112           HN       GLY 112  17.339  -7.891   2.455
  436    HA2  GLY 112           HA2      GLY 112  18.649  -6.716   3.888
  437    HA3  GLY 112           HA1      GLY 112  18.980  -8.217   4.764