NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
22934 2js1 15350 cing 1-original 2 XPLOR/CNS distance NOE simple



assign ( resid    7 and name    HA )
       ( resid    7 and name  HG1# )
        4.09  2.29  0.00 peak    1 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name  HG1# )
       ( resid   40 and name    HB )
        6.00  4.20  0.00 peak    5 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name  HG2# )
       ( resid   40 and name    HB )
        6.00  4.20  0.00 peak    6 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HA )
       ( resid   40 and name    HB )
        6.00  4.20  0.00 peak    7 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HB )
       ( resid   41 and name    HN )
        6.00  4.20  0.00 peak   10 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HA )
       ( resid   52 and name  HG1# )
        3.45  1.65  0.00 peak   18 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   41 and name    HG )
        4.15  2.35  0.00 peak   21 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   14 and name  HD2# )
        4.20  2.40  0.00 peak   22 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   62 and name   HB# )
        6.00  4.20  0.00 peak   23 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   14 and name  HD1# )
        4.20  2.40  0.00 peak   24 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HB )
       ( resid    8 and name    HA )
        4.84  3.04  0.00 peak   25 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name    HA )
       ( resid   11 and name    HB )
        3.59  1.79  0.00 peak   26 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name    HA )
       ( resid   11 and name  HG2# )
        4.48  2.68  0.00 peak   28 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name    HA )
       ( resid   11 and name  HD1# )
        4.62  2.82  0.00 peak   28 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   30 and name    HN )
!       ( resid   66 and name    HA )
!        6.00  4.20  0.00 peak   34 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   66 and name  HG2# )
        3.43  1.63  0.00 peak   36 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   66 and name    HA )
!       ( resid   67 and name   HG1 )
!        6.00  4.20  0.00 peak   38 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HA )
       ( resid   37 and name  HG1# )
        3.53  1.73  0.00 peak   40 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HA )
       ( resid   41 and name    HG )
        6.00  4.20  0.00 peak   42 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HA )
       ( resid   37 and name  HG2# )
        3.53  1.73  0.00 peak   43 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HA )
       ( resid   51 and name  HG2# )
        3.27  1.47  0.00 peak   52 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HA )
       ( resid   51 and name  HG1# )
        3.27  1.47  0.00 peak   53 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   56 and name  HG2# )
        4.05  2.25  0.00 peak   56 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   47 and name    HA )
        5.53  3.73  0.00 peak   70 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   46 and name    HG )
!       ( resid   47 and name    HA )
!        6.00  4.20  0.00 peak   80 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HA )
       ( resid   47 and name  HG2# )
        3.59  1.79  0.00 peak   84 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HA )
       ( resid   27 and name  HD1# )
        3.32  1.52  0.00 peak   89 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HA )
       ( resid   19 and name    HN )
        6.00  4.20  0.00 peak  102 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HA )
       ( resid   20 and name    HN )
        6.00  4.20  0.00 peak  102 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HA )
       ( resid   25 and name    HN )
        6.00  4.20  0.00 peak  105 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name    HA )
       ( resid   18 and name  HG1# )
        3.48  1.68  0.00 peak  110 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   26 and name    HA )
        6.00  4.20  0.00 peak  116 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name    HA )
       ( resid   67 and name    HN )
        6.00  4.20  0.00 peak  116 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HG2# )
       ( resid   26 and name    HA )
        3.55  1.75  0.00 peak  118 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   26 and name    HA )
        4.87  3.07  0.00 peak  119 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name    HA )
       ( resid   29 and name   HB# )
        3.65  1.85  0.00 peak  123 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name   HB# )
       ( resid   30 and name    HA )
        6.00  4.20  0.00 peak  124 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HA )
       ( resid   66 and name  HG2# )
        5.20  3.40  0.00 peak  126 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HN )
       ( resid   61 and name    HA )
        5.50  3.70  0.00 peak  141 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   18 and name  HG1# )
        6.00  4.20  0.00 peak  151 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HB )
       ( resid   67 and name    HA )
        6.00  4.20  0.00 peak  151 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HD1# )
       ( resid   67 and name    HA )
        4.10  2.30  0.00 peak  152 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   67 and name   HG1 )
        3.44  1.64  0.00 peak  156 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HG2# )
       ( resid   14 and name    HA )
        6.00  4.20  0.00 peak  161 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   18 and name  HD1# )
        6.00  4.20  0.00 peak  175 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HB )
       ( resid   19 and name    HA )
        4.76  2.96  0.00 peak  189 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HA )
       ( resid   56 and name  HD1# )
        4.44  2.64  0.00 peak  213 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HA )
       ( resid   73 and name    HN )
        3.57  1.77  0.00 peak  219 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HA )
       ( resid   61 and name    HN )
        4.14  2.34  0.00 peak  245 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name    HA )
       ( resid   67 and name    HN )
        3.84  2.04  0.00 peak  251 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HA )
       ( resid   50 and name   HB# )
        6.00  4.20  0.00 peak  259 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   46 and name    HA )
!       ( resid   46 and name    HG )
!        2.58  0.78  0.00 peak  263 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HA )
       ( resid   48 and name    HN )
        3.66  1.86  0.00 peak  267 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   46 and name    HA )
        2.93  1.13  0.00 peak  268 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HA )
       ( resid   52 and name    HN )
        5.69  3.89  0.00 peak  269 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   40 and name  HG2# )
!       ( resid   43 and name    HA )
!        6.00  4.20  0.00 peak  272 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   40 and name    HN )
!       ( resid   43 and name    HA )
!        6.00  4.20  0.00 peak  276 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   74 and name   HG1 )
        4.11  2.31  0.00 peak  278 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   74 and name   HG2 )
        4.11  2.31  0.00 peak  278 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name    HA )
       ( resid    4 and name    HA )
        4.61  2.81  0.00 peak  279 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid    3 and name    HA )
!       ( resid    4 and name    HG )
!        6.00  4.20  0.00 peak  283 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HA )
       ( resid   73 and name    HG )
        3.51  1.71  0.00 peak  298 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HA )
       ( resid   25 and name   HB1 )
        6.00  4.20  0.00 peak  314 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB2 )
       ( resid   30 and name    HN )
        5.83  4.03  0.00 peak  347 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name   HB2 )
       ( resid   46 and name  HD2# )
        3.28  1.48  0.00 peak  349 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name   HD1 )
       ( resid   54 and name   HE# )
        2.36  0.56  0.00 peak  352 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name   HD2 )
       ( resid   54 and name   HE# )
        2.36  0.56  0.00 peak  360 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HB1 )
       ( resid   73 and name  HD1# )
        3.73  1.93  0.00 peak  376 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HB1 )
       ( resid   73 and name  HD2# )
        3.73  1.93  0.00 peak  376 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HB2 )
       ( resid   73 and name  HD1# )
        3.73  1.93  0.00 peak  380 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HB2 )
       ( resid   73 and name  HD2# )
        3.73  1.93  0.00 peak  380 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name  HD1# )
       ( resid   56 and name    HB )
        5.17  3.37  0.00 peak  408 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name  HG2# )
       ( resid   61 and name   HG2 )
        6.00  4.20  0.00 peak  415 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   17 and name    HN )
!       ( resid   24 and name   HG1 )
!        6.00  4.20  0.00 peak  420 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HN )
       ( resid   24 and name   HG2 )
        6.00  4.20  0.00 peak  450 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name   HG1 )
       ( resid   17 and name    HN )
        6.00  4.20  0.00 peak  487 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name   HG1 )
       ( resid   21 and name    HN )
        5.17  3.37  0.00 peak  493 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name   HG2 )
       ( resid   17 and name    HN )
        6.00  4.20  0.00 peak  506 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name    HN )
       ( resid   26 and name   HB2 )
        4.06  2.26  0.00 peak  516 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HN )
       ( resid   72 and name   HB1 )
        4.02  2.22  0.00 peak  518 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name    HB )
        4.17  2.37  0.00 peak  535 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name    HN )
       ( resid   66 and name    HB )
        6.00  4.20  0.00 peak  537 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HD1# )
       ( resid   67 and name   HB1 )
        6.00  4.20  0.00 peak  544 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name   HB1 )
       ( resid   25 and name    HN )
        6.00  4.20  0.00 peak  547 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HN )
       ( resid   51 and name    HB )
        6.00  4.20  0.00 peak  547 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HN )
       ( resid   24 and name   HB1 )
        6.00  4.20  0.00 peak  552 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   17 and name    HN )
!       ( resid   24 and name   HB2 )
!        5.09  3.29  0.00 peak  554 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HB )
       ( resid   53 and name    HN )
        4.56  2.76  0.00 peak  555 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name   HB2 )
       ( resid   71 and name    HN )
        4.13  2.33  0.00 peak  584 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   68 and name   HB1 )
        6.00  4.20  0.00 peak  586 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name   HB2 )
       ( resid   23 and name    HN )
        4.16  2.36  0.00 peak  629 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   37 and name    HB )
!       ( resid   41 and name    HG )
!        6.00  4.20  0.00 peak  672 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HG )
       ( resid   48 and name    HN )
        6.00  4.20  0.00 peak  674 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   46 and name    HG )
        5.36  3.56  0.00 peak  677 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HG )
       ( resid   74 and name    HN )
        4.46  2.66  0.00 peak  681 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HN )
       ( resid   73 and name    HG )
        4.49  2.69  0.00 peak  682 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   40 and name    HN )
!       ( resid   41 and name    HG )
!        6.00  4.20  0.00 peak  692 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   39 and name    HN )
!       ( resid   41 and name    HG )
!        6.00  4.20  0.00 peak  695 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   59 and name  HD2# )
!       ( resid   63 and name    HA )
!        6.00  4.20  0.00 peak  713 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HD1# )
       ( resid   62 and name    HN )
        6.00  4.20  0.00 peak  736 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HG )
       ( resid   60 and name    HN )
        6.00  4.20  0.00 peak  740 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   66 and name  HG2# )
        3.96  2.16  0.00 peak  751 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   46 and name  HD1# )
        4.91  3.11  0.00 peak  757 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HD1# )
       ( resid   67 and name   HG1 )
        4.93  3.13  0.00 peak  773 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name   HB1 )
       ( resid   46 and name  HD1# )
        3.28  1.48  0.00 peak  786 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name   HB2 )
       ( resid   46 and name  HD1# )
        3.28  1.48  0.00 peak  787 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   53 and name  HD1# )
        4.53  2.73  0.00 peak  792 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HA )
       ( resid   53 and name  HD1# )
        4.21  2.41  0.00 peak  795 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   53 and name  HD2# )
        4.53  2.73  0.00 peak  796 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name  HD2# )
       ( resid   56 and name    HB )
        5.17  3.37  0.00 peak  800 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HA )
       ( resid   53 and name  HD2# )
        4.21  2.41  0.00 peak  804 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name  HD2# )
       ( resid   10 and name   HE# )
        4.98  3.18  0.00 peak  809 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name  HD2# )
       ( resid   10 and name   HD# )
        6.00  4.20  0.00 peak  810 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name  HD2# )
       ( resid    9 and name   HE# )
        4.75  2.95  0.00 peak  811 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HA )
       ( resid    4 and name  HD2# )
        4.34  2.54  0.00 peak  812 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HN )
       ( resid    4 and name  HD2# )
        6.00  4.20  0.00 peak  817 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name  HD1# )
       ( resid   10 and name   HE# )
        4.98  3.18  0.00 peak  820 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name  HD1# )
       ( resid   10 and name   HD# )
        6.00  4.20  0.00 peak  821 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name  HD1# )
       ( resid    9 and name   HE# )
        4.75  2.95  0.00 peak  822 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name  HD1# )
       ( resid    9 and name   HD# )
        5.59  3.79  0.00 peak  823 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HA )
       ( resid    4 and name  HD1# )
        4.34  2.54  0.00 peak  824 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HN )
       ( resid    7 and name  HG2# )
        4.85  3.05  0.00 peak  829 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   47 and name  HG2# )
        6.00  4.20  0.00 peak  830 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name  HG2# )
       ( resid   52 and name    HN )
        4.99  3.19  0.00 peak  831 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   46 and name  HD2# )
        4.91  3.11  0.00 peak  841 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name  HG2# )
       ( resid   48 and name    HN )
        3.95  2.15  0.00 peak  862 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name  HG2# )
       ( resid   51 and name    HN )
        6.00  4.20  0.00 peak  864 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HA )
       ( resid    7 and name  HG2# )
        4.09  2.29  0.00 peak  865 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   47 and name  HG2# )
!       ( resid   51 and name    HB )
!        3.06  1.26  0.00 peak  867 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   52 and name  HG2# )
        5.13  3.33  0.00 peak  875 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HA )
       ( resid   52 and name  HG2# )
        3.45  1.65  0.00 peak  880 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name   HB1 )
       ( resid   46 and name  HD2# )
        3.28  1.48  0.00 peak  884 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HZ )
       ( resid   37 and name  HG1# )
        4.31  2.51  0.00 peak  888 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HE# )
       ( resid   37 and name  HG1# )
        4.11  2.31  0.00 peak  889 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HE# )
       ( resid   37 and name  HG2# )
        4.11  2.31  0.00 peak  904 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HN )
       ( resid   51 and name  HG2# )
        5.55  3.75  0.00 peak  918 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HN )
       ( resid   51 and name  HG2# )
        4.92  3.12  0.00 peak  920 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HA )
       ( resid   66 and name  HG1# )
        5.20  3.40  0.00 peak  929 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   66 and name  HG1# )
        3.88  2.08  0.00 peak  932 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   66 and name    HA )
!       ( resid   66 and name  HG1# )
!        3.43  1.63  0.00 peak  933 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   52 and name  HG1# )
        5.13  3.33  0.00 peak  942 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HN )
       ( resid   62 and name   HB# )
        4.09  2.29  0.00 peak  956 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HA )
       ( resid   62 and name   HB# )
        6.00  4.20  0.00 peak  957 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HD1# )
       ( resid   62 and name   HB# )
        3.91  2.11  0.00 peak  959 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HA )
       ( resid   40 and name  HG2# )
        3.55  1.75  0.00 peak  965 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HA )
       ( resid   40 and name  HG2# )
        5.52  3.72  0.00 peak  967 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name  HG1# )
       ( resid   61 and name   HG1 )
        6.00  4.20  0.00 peak  974 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name  HG1# )
       ( resid   61 and name   HG2 )
        6.00  4.20  0.00 peak  977 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   59 and name  HD1# )
        5.39  3.59  0.00 peak  990 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   59 and name  HD1# )
!       ( resid   63 and name    HA )
!        6.00  4.20  0.00 peak  991 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name  HG2# )
       ( resid   43 and name    HN )
        5.19  3.39  0.00 peak 1017 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HN )
       ( resid   42 and name  HG2# )
        4.09  2.29  0.00 peak 1021 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name   HB# )
       ( resid   51 and name    HN )
        4.61  2.81  0.00 peak 1032 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HE2 )
       ( resid   50 and name   HB# )
        5.27  3.47  0.00 peak 1034 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HE1 )
       ( resid   50 and name   HB# )
        5.27  3.47  0.00 peak 1035 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name   HB# )
       ( resid   51 and name    HB )
        6.00  4.20  0.00 peak 1036 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name    HN )
       ( resid   50 and name   HB# )
        3.44  1.64  0.00 peak 1038 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name   HB# )
       ( resid   53 and name    HN )
        5.44  3.64  0.00 peak 1040 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   39 and name    HN )
!       ( resid   56 and name  HG2# )
!        6.00  4.20  0.00 peak 1045 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   53 and name    HN )
!       ( resid   56 and name  HG2# )
!        6.00  4.20  0.00 peak 1045 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HN )
       ( resid   56 and name  HG2# )
        6.00  4.20  0.00 peak 1046 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name  HG2# )
       ( resid   57 and name    HN )
        6.00  4.20  0.00 peak 1050 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name  HG2# )
       ( resid   60 and name    HN )
        6.00  4.20  0.00 peak 1050 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HA )
       ( resid   56 and name  HG2# )
        6.00  4.20  0.00 peak 1051 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name  HG2# )
       ( resid   57 and name    HA )
        6.00  4.20  0.00 peak 1051 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   42 and name    HB )
!       ( resid   56 and name  HG2# )
!        6.00  4.20  0.00 peak 1053 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   56 and name  HG2# )
        6.00  4.20  0.00 peak 1055 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   29 and name   HB# )
        3.80  2.00  0.00 peak 1056 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name   HB1 )
       ( resid   29 and name   HB# )
        5.10  3.30  0.00 peak 1060 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HN )
       ( resid   29 and name   HB# )
        3.86  2.06  0.00 peak 1064 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   29 and name   HB# )
        4.23  2.43  0.00 peak 1067 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HG2# )
       ( resid   29 and name   HB# )
        5.40  3.60  0.00 peak 1073 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HG2# )
       ( resid   28 and name    HN )
        6.00  4.20  0.00 peak 1078 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name    HN )
       ( resid   27 and name  HG2# )
        6.00  4.20  0.00 peak 1084 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HG2# )
       ( resid   18 and name  HG1# )
        3.35  1.55  0.00 peak 1087 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name    HN )
       ( resid   18 and name  HG2# )
        5.06  3.26  0.00 peak 1088 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   18 and name  HG2# )
        4.43  2.63  0.00 peak 1089 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HG2# )
       ( resid   19 and name    HN )
        4.72  2.92  0.00 peak 1090 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name    HA )
       ( resid   18 and name  HG2# )
        5.28  3.48  0.00 peak 1091 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HA )
       ( resid   18 and name  HG2# )
        3.81  2.01  0.00 peak 1092 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HG2# )
       ( resid   18 and name  HG1# )
        3.19  1.39  0.00 peak 1095 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HG2# )
       ( resid   29 and name   HB# )
        3.62  1.82  0.00 peak 1096 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HG2# )
       ( resid   14 and name    HN )
        6.00  4.20  0.00 peak 1114 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HG2# )
       ( resid   62 and name    HA )
        4.50  2.70  0.00 peak 1116 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   11 and name  HG2# )
        4.13  2.33  0.00 peak 1117 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HG2# )
       ( resid   62 and name   HB# )
        3.41  1.61  0.00 peak 1120 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   62 and name    HA )
        4.49  2.69  0.00 peak 1125 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   11 and name  HD1# )
        6.00  4.20  0.00 peak 1126 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HB )
       ( resid   11 and name  HD1# )
        2.98  1.18  0.00 peak 1130 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   62 and name   HB# )
        3.56  1.76  0.00 peak 1132 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   18 and name  HD1# )
        4.99  3.19  0.00 peak 1135 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   19 and name    HA )
        6.00  4.20  0.00 peak 1136 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   29 and name   HB# )
        4.55  2.75  0.00 peak 1137 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name    HA )
       ( resid   18 and name  HD1# )
        3.94  2.14  0.00 peak 1139 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HA )
       ( resid   18 and name  HD1# )
        4.49  2.69  0.00 peak 1140 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HN )
       ( resid   56 and name  HD1# )
        5.19  3.39  0.00 peak 1146 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   56 and name  HD1# )
        6.00  4.20  0.00 peak 1148 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HB )
       ( resid   56 and name  HD1# )
        5.86  4.06  0.00 peak 1149 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HB )
       ( resid   56 and name  HD1# )
        3.48  1.68  0.00 peak 1150 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HD1# )
       ( resid   67 and name    HN )
        6.00  4.20  0.00 peak 1153 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HD1# )
       ( resid   71 and name    HN )
        4.98  3.18  0.00 peak 1154 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HN )
       ( resid   27 and name  HD1# )
        5.00  3.20  0.00 peak 1155 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HD1# )
       ( resid   63 and name   HE# )
        6.00  4.20  0.00 peak 1156 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HB )
       ( resid   27 and name  HD1# )
        3.28  1.48  0.00 peak 1161 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HA )
       ( resid   24 and name   HB2 )
        6.00  4.20  0.00 peak 1179 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name  HG2# )
       ( resid   61 and name   HG1 )
        6.00  4.20  0.00 peak 1192 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HN )
       ( resid   41 and name    HG )
        6.00  4.20  0.00 peak 1211 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HD2# )
       ( resid   62 and name   HB# )
        3.91  2.11  0.00 peak 1213 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HD# )
       ( resid   59 and name  HD2# )
        6.00  4.20  0.00 peak 1215 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name  HG2# )
       ( resid   51 and name  HG2# )
        2.79  0.99  0.00 peak 1218 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name  HG2# )
       ( resid   51 and name  HG1# )
        2.79  0.99  0.00 peak 1219 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HG1# )
       ( resid   29 and name   HB# )
        5.35  3.55  0.00 peak 1227 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name   HB# )
       ( resid   66 and name    HB )
        5.61  3.81  0.00 peak 1227 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HA )
       ( resid   20 and name   HE# )
        4.71  2.91  0.00 peak 1231 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HN )
       ( resid   20 and name   HE# )
        5.85  4.05  0.00 peak 1233 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HN )
       ( resid   20 and name   HE# )
        6.00  4.20  0.00 peak 1234 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   56 and name  HD1# )
!       ( resid   60 and name    HN )
!        6.00  4.20  0.00 peak 1243 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name    HA )
       ( resid    4 and name    HN )
        3.44  1.64  0.00 peak   45 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HN )
       ( resid    4 and name    HG )
        4.88  3.08  0.00 peak   48 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HN )
       ( resid    4 and name  HD1# )
        6.00  4.20  0.00 peak   51 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HN )
       ( resid   51 and name    HN )
        6.00  4.20  0.00 peak   59 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HN )
       ( resid   48 and name    HN )
        5.37  3.57  0.00 peak   66 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HA )
       ( resid   48 and name    HN )
        3.28  1.48  0.00 peak   67 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HB )
       ( resid   48 and name    HN )
        6.00  4.20  0.00 peak   72 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HN )
       ( resid   51 and name  HG1# )
        5.55  3.75  0.00 peak   73 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB1 )
       ( resid   26 and name    HN )
        4.39  2.59  0.00 peak   80 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name    HN )
       ( resid   26 and name   HB1 )
        4.06  2.26  0.00 peak   82 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name    HN )
       ( resid   26 and name   HG1 )
        5.14  3.34  0.00 peak   83 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name    HN )
       ( resid   26 and name   HG2 )
        5.14  3.34  0.00 peak   83 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HN )
       ( resid   46 and name    HG )
        6.00  4.20  0.00 peak   86 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   45 and name    HN )
!       ( resid   47 and name    HN )
!        4.83  3.03  0.00 peak   89 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   15 and name    HA )
        5.96  4.16  0.00 peak   96 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name    HN )
       ( resid   14 and name    HN )
        5.65  3.85  0.00 peak  101 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   16 and name    HN )
        5.85  4.05  0.00 peak  101 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   14 and name    HG )
        3.83  2.03  0.00 peak  107 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   14 and name  HD2# )
        3.96  2.16  0.00 peak  108 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   14 and name  HD1# )
        3.96  2.16  0.00 peak  109 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   33 and name   HE# )
        6.00  4.20  0.00 peak  110 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name    HA )
       ( resid   29 and name    HN )
        4.98  3.18  0.00 peak  112 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   29 and name    HN )
!       ( resid   30 and name   HE# )
!        6.00  4.20  0.00 peak  113 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HN )
       ( resid   29 and name    HN )
        4.15  2.35  0.00 peak  115 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB2 )
       ( resid   29 and name    HN )
        4.46  2.66  0.00 peak  119 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HN )
       ( resid   31 and name    HN )
        6.00  4.20  0.00 peak  122 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HN )
       ( resid   29 and name    HN )
        5.65  3.85  0.00 peak  123 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HB )
       ( resid   29 and name    HN )
        6.00  4.20  0.00 peak  125 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HG2# )
       ( resid   29 and name    HN )
        6.00  4.20  0.00 peak  126 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   59 and name  HD1# )
        4.98  3.18  0.00 peak  133 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   59 and name  HD2# )
        4.98  3.18  0.00 peak  134 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name  HD1# )
       ( resid   59 and name    HN )
        6.00  4.20  0.00 peak  139 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HB )
       ( resid   59 and name    HN )
        6.00  4.20  0.00 peak  140 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HA )
       ( resid   72 and name    HN )
        3.07  1.27  0.00 peak  144 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HN )
       ( resid   74 and name   HG1 )
        6.00  4.20  0.00 peak  147 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HN )
       ( resid   74 and name   HG2 )
        6.00  4.20  0.00 peak  147 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HN )
       ( resid   72 and name   HB2 )
        4.02  2.22  0.00 peak  149 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   62 and name    HA )
        5.83  4.03  0.00 peak  154 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   62 and name   HB# )
        4.38  2.58  0.00 peak  157 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   11 and name  HD1# )
        4.03  2.23  0.00 peak  158 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   13 and name    HN )
        6.00  4.20  0.00 peak  161 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   11 and name    HB )
        3.37  1.57  0.00 peak  162 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   28 and name    HN )
        6.00  4.20  0.00 peak  170 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   41 and name    HN )
        6.00  4.20  0.00 peak  173 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   25 and name    HN )
!       ( resid   25 and name   HB1 )
!        3.39  1.59  0.00 peak  175 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name   HB2 )
       ( resid   25 and name    HN )
        3.75  1.95  0.00 peak  176 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   72 and name    HN )
!       ( resid   73 and name    HN )
!        3.54  1.74  0.00 peak  178 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   32 and name    HN )
       ( resid   33 and name    HN )
        3.91  2.11  0.00 peak  186 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name    HN )
       ( resid   33 and name   HD# )
        4.91  3.11  0.00 peak  187 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name    HN )
       ( resid   33 and name   HB1 )
        3.88  2.08  0.00 peak  188 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HA )
       ( resid   33 and name    HN )
        4.44  2.64  0.00 peak  189 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name    HN )
       ( resid   33 and name   HB2 )
        3.88  2.08  0.00 peak  190 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HN )
       ( resid   50 and name    HA )
        5.70  3.90  0.00 peak  194 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HN )
       ( resid   49 and name    HN )
        4.56  2.76  0.00 peak  196 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HA )
       ( resid   49 and name    HN )
        3.11  1.31  0.00 peak  198 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HN )
       ( resid   49 and name   HB1 )
        4.14  2.34  0.00 peak  200 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HN )
       ( resid   49 and name   HB2 )
        4.14  2.34  0.00 peak  201 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   11 and name  HG2# )
        4.12  2.32  0.00 peak  205 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    2 and name   HB1 )
       ( resid    3 and name    HN )
        5.08  3.28  0.00 peak  206 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name    HN )
       ( resid    4 and name    HN )
        6.00  4.20  0.00 peak  207 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    2 and name   HB2 )
       ( resid    3 and name    HN )
        5.08  3.28  0.00 peak  209 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   41 and name    HN )
        3.76  1.96  0.00 peak  212 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   14 and name    HA )
!       ( resid   25 and name    HN )
!        6.00  4.20  0.00 peak  216 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name  HG2# )
       ( resid   41 and name    HN )
        4.55  2.75  0.00 peak  219 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HN )
       ( resid   42 and name    HN )
        3.55  1.75  0.00 peak  222 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name   HE# )
       ( resid   37 and name    HN )
        6.00  4.20  0.00 peak  226 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name   HD# )
       ( resid   37 and name    HN )
        6.00  4.20  0.00 peak  226 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   37 and name    HB )
        3.77  1.97  0.00 peak  231 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   59 and name  HD2# )
        5.39  3.59  0.00 peak  235 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name    HN )
       ( resid   37 and name    HN )
        6.00  4.20  0.00 peak  236 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name   HB# )
       ( resid   33 and name    HN )
        6.00  4.20  0.00 peak  237 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   14 and name  HD2# )
!       ( resid   62 and name    HN )
!        6.00  4.20  0.00 peak  250 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HN )
       ( resid   25 and name    HN )
        4.41  2.61  0.00 peak  259 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name    HN )
       ( resid   24 and name    HN )
        3.39  1.59  0.00 peak  260 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HN )
       ( resid   24 and name   HB2 )
        3.59  1.79  0.00 peak  264 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HA )
       ( resid   24 and name    HN )
        6.00  4.20  0.00 peak  267 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   74 and name    HN )
!       ( resid   75 and name    HN )
!        3.61  1.81  0.00 peak  268 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HA )
       ( resid   74 and name    HN )
        3.22  1.42  0.00 peak  269 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HN )
       ( resid   11 and name    HN )
        4.31  2.51  0.00 peak  274 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name   HD# )
       ( resid   10 and name    HN )
        4.68  2.88  0.00 peak  275 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name    HN )
       ( resid   10 and name    HN )
        4.24  2.44  0.00 peak  278 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid    9 and name   HE# )
!       ( resid   10 and name    HN )
!        4.92  3.12  0.00 peak  279 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name    HN )
       ( resid   67 and name    HN )
        4.71  2.91  0.00 peak  282 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   68 and name    HN )
        3.61  1.81  0.00 peak  283 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   67 and name    HN )
!       ( resid   67 and name   HB1 )
!        2.88  1.08  0.00 peak  288 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   67 and name   HB2 )
        3.66  1.86  0.00 peak  289 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name    HA )
       ( resid   10 and name    HN )
        4.85  3.05  0.00 peak  292 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   60 and name    HN )
        3.82  2.02  0.00 peak  295 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name  HD1# )
       ( resid   60 and name    HN )
        6.00  4.20  0.00 peak  297 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   59 and name   HB2 )
!       ( resid   60 and name    HN )
!        3.28  1.48  0.00 peak  302 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   67 and name   HG1 )
        4.66  2.86  0.00 peak  303 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name  HG2# )
        3.70  1.90  0.00 peak  304 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name  HG1# )
        3.70  1.90  0.00 peak  305 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   53 and name    HA )
        6.00  4.20  0.00 peak  313 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name  HD2# )
       ( resid   60 and name    HN )
        6.00  4.20  0.00 peak  318 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   45 and name    HN )
!       ( resid   46 and name    HN )
!        3.61  1.81  0.00 peak  324 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   47 and name    HB )
        5.29  3.49  0.00 peak  326 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name    HN )
       ( resid   66 and name    HN )
        3.41  1.61  0.00 peak  334 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   25 and name    HN )
        6.00  4.20  0.00 peak  342 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   41 and name    HN )
        6.00  4.20  0.00 peak  342 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   38 and name    HN )
        3.55  1.75  0.00 peak  343 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   39 and name    HN )
        3.87  2.07  0.00 peak  343 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   40 and name    HN )
        5.93  4.13  0.00 peak  344 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name    HA )
       ( resid   18 and name    HN )
        4.44  2.64  0.00 peak  345 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name  HG2# )
       ( resid   38 and name    HN )
        4.63  2.83  0.00 peak  351 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name   HE# )
       ( resid   38 and name    HN )
        6.00  4.20  0.00 peak  352 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name   HD# )
       ( resid   38 and name    HN )
        6.00  4.20  0.00 peak  352 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HE# )
       ( resid   38 and name    HN )
        6.00  4.20  0.00 peak  353 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HB )
       ( resid   38 and name    HN )
        4.58  2.78  0.00 peak  354 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HA )
       ( resid   52 and name    HN )
        4.98  3.18  0.00 peak  356 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   52 and name    HB )
        3.70  1.90  0.00 peak  357 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HN )
       ( resid   70 and name    HN )
        3.33  1.53  0.00 peak  362 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   70 and name    HN )
        4.88  3.08  0.00 peak  363 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   70 and name    HN )
        4.29  2.49  0.00 peak  368 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HD1# )
       ( resid   70 and name    HN )
        5.25  3.45  0.00 peak  373 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   40 and name    HB )
        6.00  4.20  0.00 peak  374 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   29 and name   HB# )
        4.93  3.13  0.00 peak  378 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   18 and name  HG1# )
        3.55  1.75  0.00 peak  380 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name  HG1# )
       ( resid   38 and name    HN )
        4.63  2.83  0.00 peak  382 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HN )
       ( resid    7 and name    HB )
        4.07  2.27  0.00 peak  387 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HN )
       ( resid    7 and name  HG1# )
        4.85  3.05  0.00 peak  389 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HN )
       ( resid   10 and name    HN )
        6.00  4.20  0.00 peak  390 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name    HN )
       ( resid   36 and name    HN )
        6.00  4.20  0.00 peak  396 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name    HN )
       ( resid   34 and name    HN )
        3.85  2.05  0.00 peak  398 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name    HN )
       ( resid   35 and name    HN )
        4.15  2.35  0.00 peak  398 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   32 and name    HN )
       ( resid   34 and name    HN )
        6.00  4.20  0.00 peak  407 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HN )
       ( resid   57 and name    HN )
        4.26  2.46  0.00 peak  411 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HA )
       ( resid   57 and name    HN )
        4.49  2.69  0.00 peak  412 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name    HA )
       ( resid   57 and name    HN )
        4.84  3.04  0.00 peak  412 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name  HD1# )
       ( resid   57 and name    HN )
        4.52  2.72  0.00 peak  414 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name    HN )
       ( resid   51 and name    HA )
        6.00  4.20  0.00 peak  417 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HA )
       ( resid   34 and name    HN )
        3.89  2.09  0.00 peak  418 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   47 and name    HN )
        3.23  1.43  0.00 peak  420 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HA )
       ( resid   47 and name    HN )
        3.55  1.75  0.00 peak  421 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HN )
       ( resid   47 and name    HB )
        3.74  1.94  0.00 peak  423 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HN )
       ( resid   47 and name  HG2# )
        4.21  2.41  0.00 peak  425 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HN )
       ( resid   51 and name  HG1# )
        4.92  3.12  0.00 peak  426 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HN )
       ( resid   50 and name    HN )
        4.18  2.38  0.00 peak  427 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name    HN )
       ( resid   52 and name    HN )
        4.98  3.18  0.00 peak  428 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name    HN )
       ( resid   51 and name    HN )
        3.87  2.07  0.00 peak  429 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name  HG2# )
       ( resid   50 and name    HN )
        6.00  4.20  0.00 peak  442 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   75 and name    HN )
        3.37  1.57  0.00 peak  447 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   47 and name    HN )
!       ( resid   51 and name    HA )
!        6.00  4.20  0.00 peak  451 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name    HN )
       ( resid   45 and name    HN )
        4.68  2.88  0.00 peak  453 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name  HG2# )
       ( resid   44 and name    HN )
        6.00  4.20  0.00 peak  458 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HN )
       ( resid   44 and name    HN )
        5.16  3.36  0.00 peak  460 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HA )
       ( resid   44 and name    HN )
        5.42  3.62  0.00 peak  462 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HB )
       ( resid   44 and name    HN )
        5.64  3.84  0.00 peak  464 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   25 and name    HA )
!       ( resid   28 and name    HN )
!        4.64  2.84  0.00 peak  468 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB2 )
       ( resid   28 and name    HN )
        3.71  1.91  0.00 peak  469 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HN )
       ( resid   22 and name    HN )
        3.90  2.10  0.00 peak  471 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   20 and name    HN )
!       ( resid   21 and name    HN )
!        3.26  1.46  0.00 peak  472 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HN )
       ( resid   22 and name    HA )
        4.48  2.68  0.00 peak  476 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name   HG2 )
       ( resid   21 and name    HN )
        5.17  3.37  0.00 peak  483 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   54 and name    HN )
        3.79  1.99  0.00 peak  486 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HN )
       ( resid   55 and name    HN )
        4.11  2.31  0.00 peak  486 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   54 and name    HN )
        4.42  2.62  0.00 peak  487 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HN )
       ( resid   56 and name    HN )
        5.09  3.29  0.00 peak  487 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HA )
       ( resid   54 and name    HN )
        4.33  2.53  0.00 peak  488 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HN )
       ( resid   54 and name    HN )
        6.00  4.20  0.00 peak  491 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HE# )
       ( resid   63 and name    HN )
        6.00  4.20  0.00 peak  495 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HN )
       ( resid   63 and name    HN )
        3.73  1.93  0.00 peak  497 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name   HB# )
       ( resid   63 and name    HN )
        4.21  2.41  0.00 peak  502 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   63 and name    HN )
        5.65  3.85  0.00 peak  505 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HG )
       ( resid   63 and name    HN )
        6.00  4.20  0.00 peak  505 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HN )
       ( resid   66 and name    HB )
        6.00  4.20  0.00 peak  508 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HD# )
       ( resid   63 and name    HN )
        5.78  3.98  0.00 peak  509 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HA )
       ( resid   63 and name    HN )
        6.00  4.20  0.00 peak  510 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HN )
       ( resid   64 and name    HA )
        6.00  4.20  0.00 peak  510 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HN )
       ( resid   62 and name    HA )
        6.00  4.20  0.00 peak  514 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name    HN )
       ( resid   24 and name    HN )
        4.71  2.91  0.00 peak  517 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HA )
       ( resid   22 and name    HN )
        3.42  1.62  0.00 peak  519 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HA )
       ( resid   22 and name    HN )
        6.00  4.20  0.00 peak  521 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HN )
       ( resid   57 and name    HN )
        5.82  4.02  0.00 peak  535 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   61 and name    HN )
        6.00  4.20  0.00 peak  540 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   61 and name    HN )
        5.89  4.09  0.00 peak  543 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid    6 and name    HN )
!       ( resid    9 and name    HN )
!        4.07  2.27  0.00 peak  545 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name    HN )
       ( resid    9 and name   HD# )
        5.30  3.50  0.00 peak  546 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HA )
       ( resid    9 and name    HN )
        3.73  1.93  0.00 peak  550 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HB )
       ( resid    9 and name    HN )
        4.79  2.99  0.00 peak  554 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid    4 and name    HA )
!       ( resid    9 and name    HN )
!        6.00  4.20  0.00 peak  558 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   33 and name   HD# )
        6.00  4.20  0.00 peak  560 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name    HN )
       ( resid   27 and name    HN )
        3.81  2.01  0.00 peak  564 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HN )
       ( resid   28 and name    HN )
        3.96  2.16  0.00 peak  566 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   25 and name    HA )
!       ( resid   27 and name    HN )
!        4.86  3.06  0.00 peak  567 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HG1 )
       ( resid   27 and name    HN )
        5.13  3.33  0.00 peak  572 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HG2 )
       ( resid   27 and name    HN )
        5.13  3.33  0.00 peak  572 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HN )
       ( resid   27 and name  HG2# )
        3.91  2.11  0.00 peak  573 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name    HN )
       ( resid   16 and name    HN )
        3.39  1.59  0.00 peak  576 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HN )
       ( resid   30 and name    HN )
        3.64  1.84  0.00 peak  583 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HG2# )
       ( resid   30 and name    HN )
        5.68  3.88  0.00 peak  592 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HN )
       ( resid   30 and name    HN )
        5.61  3.81  0.00 peak  594 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name    HN )
       ( resid   58 and name    HN )
        5.64  3.84  0.00 peak  595 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HN )
       ( resid   59 and name    HN )
        3.73  1.93  0.00 peak  596 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   66 and name    HB )
        4.48  2.68  0.00 peak  600 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HN )
       ( resid   59 and name   HB2 )
        4.80  3.00  0.00 peak  601 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HG2# )
       ( resid   30 and name    HN )
        6.00  4.20  0.00 peak  605 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   27 and name  HD1# )
!       ( resid   30 and name    HN )
!        6.00  4.20  0.00 peak  605 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name  HD1# )
       ( resid   58 and name    HN )
        6.00  4.20  0.00 peak  606 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name    HA )
       ( resid   12 and name    HN )
        4.13  2.33  0.00 peak  610 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HB )
       ( resid   12 and name    HN )
        3.02  1.22  0.00 peak  612 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HN )
       ( resid   43 and name    HN )
        5.54  3.74  0.00 peak  616 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HN )
       ( resid   43 and name    HN )
        3.93  2.13  0.00 peak  617 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name    HN )
       ( resid   44 and name    HN )
        3.37  1.57  0.00 peak  619 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HA )
       ( resid   43 and name    HN )
        4.56  2.76  0.00 peak  621 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HB )
       ( resid   43 and name    HN )
        4.21  2.41  0.00 peak  624 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name  HG2# )
       ( resid   43 and name    HN )
        6.00  4.20  0.00 peak  626 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name  HG1# )
       ( resid   43 and name    HN )
        5.19  3.39  0.00 peak  627 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   31 and name    HN )
       ( resid   33 and name    HN )
        6.00  4.20  0.00 peak  629 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   31 and name    HN )
!       ( resid   34 and name   HD# )
!        5.68  3.88  0.00 peak  631 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name   HE# )
       ( resid   31 and name    HN )
        5.73  3.93  0.00 peak  636 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name   HB# )
       ( resid   31 and name    HN )
        6.00  4.20  0.00 peak  637 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   31 and name    HN )
        4.01  2.21  0.00 peak  638 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HG2# )
       ( resid   31 and name    HN )
        5.86  4.06  0.00 peak  643 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HN )
       ( resid   12 and name    HN )
        5.63  3.83  0.00 peak  647 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name    HN )
       ( resid   57 and name    HN )
        6.00  4.20  0.00 peak  653 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name    HN )
       ( resid   56 and name    HN )
        3.65  1.85  0.00 peak  654 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HN )
       ( resid   36 and name    HN )
        4.08  2.28  0.00 peak  660 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   19 and name    HN )
        3.54  1.74  0.00 peak  664 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HA )
       ( resid   56 and name    HN )
        4.51  2.71  0.00 peak  675 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HA )
       ( resid   56 and name    HN )
        5.38  3.58  0.00 peak  677 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HN )
       ( resid   64 and name    HN )
        4.25  2.45  0.00 peak  682 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name    HN )
       ( resid   68 and name    HN )
        6.00  4.20  0.00 peak  683 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name   HE# )
       ( resid   64 and name    HN )
        4.38  2.58  0.00 peak  685 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   64 and name    HN )
        6.00  4.20  0.00 peak  690 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   12 and name    HN )
        4.10  2.30  0.00 peak  692 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HG2# )
       ( resid   12 and name    HN )
        3.79  1.99  0.00 peak  693 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HA )
       ( resid   55 and name    HN )
        4.36  2.56  0.00 peak  696 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HN )
       ( resid   33 and name   HE# )
        5.63  3.83  0.00 peak  702 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HN )
       ( resid   52 and name    HN )
        4.13  2.33  0.00 peak  707 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HA )
       ( resid   51 and name    HN )
        5.24  3.44  0.00 peak  708 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HN )
       ( resid   51 and name  HG2# )
        3.87  2.07  0.00 peak  713 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HN )
       ( resid   51 and name  HG1# )
        3.87  2.07  0.00 peak  714 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HN )
       ( resid   53 and name    HN )
        5.25  3.45  0.00 peak  716 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name    HN )
       ( resid   18 and name  HD1# )
        4.40  2.60  0.00 peak  720 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   15 and name    HN )
        4.24  2.44  0.00 peak  721 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   14 and name    HG )
!       ( resid   15 and name    HN )
!        3.33  1.53  0.00 peak  727 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   15 and name    HN )
        5.52  3.72  0.00 peak  729 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HN )
       ( resid   19 and name    HN )
        4.01  2.21  0.00 peak  732 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HG2# )
       ( resid   13 and name    HN )
        6.00  4.20  0.00 peak  733 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HN )
       ( resid   14 and name    HN )
        4.08  2.28  0.00 peak  736 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name    HN )
       ( resid   13 and name    HN )
        3.37  1.57  0.00 peak  737 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HN )
       ( resid   15 and name    HN )
        5.01  3.21  0.00 peak  747 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name   HB1 )
       ( resid   71 and name    HN )
        4.13  2.33  0.00 peak  760 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   32 and name    HN )
        4.48  2.68  0.00 peak  764 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   31 and name    HN )
       ( resid   32 and name    HN )
        4.39  2.59  0.00 peak  769 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HD1# )
       ( resid   68 and name    HN )
        6.00  4.20  0.00 peak  775 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   53 and name    HN )
        4.08  2.28  0.00 peak  777 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HA )
       ( resid   53 and name    HN )
        5.24  3.44  0.00 peak  780 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   56 and name    HB )
        6.00  4.20  0.00 peak  787 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name    HA )
       ( resid   68 and name    HN )
        4.04  2.24  0.00 peak  790 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   68 and name    HN )
!       ( resid   68 and name   HB1 )
!        3.02  1.22  0.00 peak  794 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   67 and name   HB1 )
!       ( resid   68 and name    HN )
!        3.24  1.44  0.00 peak  795 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name   HB2 )
       ( resid   68 and name    HN )
        4.15  2.35  0.00 peak  796 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name   HG1 )
       ( resid   68 and name    HN )
        4.52  2.72  0.00 peak  797 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   68 and name    HN )
        6.00  4.20  0.00 peak  798 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   70 and name   HG1 )
        6.00  4.20  0.00 peak  800 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   70 and name   HG2 )
        6.00  4.20  0.00 peak  801 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HN )
       ( resid   20 and name    HN )
        6.00  4.20  0.00 peak  803 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   20 and name    HN )
        5.93  4.13  0.00 peak  806 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   20 and name    HN )
       ( resid   21 and name    HA )
        6.00  4.20  0.00 peak  811 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HN )
       ( resid    7 and name    HN )
        6.00  4.20  0.00 peak  840 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   23 and name    HN )
!       ( resid   25 and name    HN )
!        4.56  2.76  0.00 peak  845 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HA )
       ( resid   23 and name    HN )
        4.54  2.74  0.00 peak  847 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name    HA )
       ( resid   23 and name    HN )
        3.55  1.75  0.00 peak  849 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name   HB1 )
       ( resid   23 and name    HN )
        4.16  2.36  0.00 peak  852 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name    HN )
       ( resid   24 and name   HB2 )
        4.22  2.42  0.00 peak  853 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name    HN )
       ( resid   24 and name    HA )
        5.60  3.80  0.00 peak  854 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HA )
       ( resid    6 and name    HN )
        6.00  4.20  0.00 peak  857 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HN )
       ( resid    6 and name    HN )
        6.00  4.20  0.00 peak  859 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   42 and name    HN )
        5.53  3.73  0.00 peak  875 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   40 and name  HG2# )
        3.99  2.19  0.00 peak  877 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HN )
       ( resid   38 and name    HN )
        5.92  4.12  0.00 peak  894 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HN )
       ( resid   37 and name    HN )
        3.70  1.90  0.00 peak  895 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   40 and name    HN )
        3.98  2.18  0.00 peak  895 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   40 and name    HB )
        6.00  4.20  0.00 peak  986 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   41 and name    HN )
        6.00  4.20  0.00 peak  988 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   42 and name    HB )
        5.60  3.80  0.00 peak  994 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name  HG2# )
       ( resid   42 and name    HN )
        6.00  4.20  0.00 peak 1008 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HN )
       ( resid   42 and name  HG1# )
        4.09  2.29  0.00 peak 1018 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   69 and name    HN )
        2.93  1.13  0.00 peak 1023 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name   HB1 )
       ( resid   69 and name    HN )
        3.52  1.72  0.00 peak 1026 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name   HG1 )
       ( resid   69 and name    HN )
        6.00  4.20  0.00 peak 1027 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   69 and name    HN )
        6.00  4.20  0.00 peak 1028 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HD1# )
       ( resid   69 and name    HN )
        6.00  4.20  0.00 peak 1028 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   69 and name    HN )
        5.15  3.35  0.00 peak 1029 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HN )
       ( resid   70 and name    HA )
        5.04  3.24  0.00 peak 1032 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name    HA )
       ( resid   11 and name    HN )
        4.27  2.47  0.00 peak 1037 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name   HD# )
       ( resid   64 and name    HN )
        4.23  2.43  0.00 peak   37 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HN )
       ( resid   63 and name   HD# )
        4.56  2.76  0.00 peak   45 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HZ )
       ( resid   37 and name  HG2# )
        4.31  2.51  0.00 peak   54 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name    HN )
       ( resid   34 and name   HD# )
        4.87  3.07  0.00 peak   59 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HD# )
       ( resid   63 and name    HA )
        4.43  2.63  0.00 peak   61 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name    HA )
       ( resid   34 and name   HD# )
        4.44  2.64  0.00 peak   62 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HD# )
       ( resid   59 and name  HD1# )
        6.00  4.20  0.00 peak   64 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name   HD# )
       ( resid   10 and name   HE# )
        4.69  2.89  0.00 peak   68 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HA )
       ( resid    9 and name   HD# )
        5.06  3.26  0.00 peak   72 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name  HD2# )
       ( resid    9 and name   HD# )
        5.59  3.79  0.00 peak   73 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HN )
       ( resid    9 and name   HD# )
        5.00  3.20  0.00 peak   74 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name   HD# )
       ( resid   10 and name    HZ )
        6.00  4.20  0.00 peak   75 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name   HD# )
       ( resid   34 and name    HN )
        4.36  2.56  0.00 peak   77 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HG )
       ( resid   33 and name   HD# )
        6.00  4.20  0.00 peak   82 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name   HD# )
       ( resid   62 and name   HB# )
        6.00  4.20  0.00 peak   82 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HE# )
       ( resid   10 and name   HD# )
        3.15  1.35  0.00 peak   93 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   10 and name   HD# )
!      ( resid   59 and name    HA )
!       3.44  1.64  0.00 peak   95 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name   HE# )
       ( resid   10 and name   HD# )
        5.15  3.35  0.00 peak   97 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HD# )
       ( resid   33 and name   HE# )
        5.32  3.52  0.00 peak   97 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HD# )
       ( resid   37 and name    HB )
        6.00  4.20  0.00 peak   98 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HD# )
       ( resid   59 and name   HB2 )
        6.00  4.20  0.00 peak   98 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HN )
       ( resid    9 and name   HE# )
        5.26  3.46  0.00 peak  168 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name   HE# )
       ( resid   10 and name   HE# )
        4.70  2.90  0.00 peak  169 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HA )
       ( resid    9 and name   HE# )
        4.82  3.02  0.00 peak  173 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid    9 and name   HE# )
!       ( resid   10 and name    HZ )
!        4.37  2.57  0.00 peak  174 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name   HE# )
       ( resid   59 and name    HG )
        4.78  2.98  0.00 peak  180 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HG )
       ( resid   33 and name   HE# )
        4.77  2.97  0.00 peak  183 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name   HE# )
       ( resid   34 and name    HN )
        5.84  4.04  0.00 peak  188 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HN )
       ( resid   63 and name   HE# )
        6.00  4.20  0.00 peak  202 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name   HE# )
       ( resid   63 and name   HD# )
        2.93  1.13  0.00 peak  204 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name   HE# )
       ( resid   67 and name   HG1 )
        3.95  2.15  0.00 peak  210 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HE# )
       ( resid   60 and name    HN )
        5.40  3.60  0.00 peak  214 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HE# )
       ( resid   34 and name   HD# )
        3.07  1.27  0.00 peak  215 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name    HA )
       ( resid   34 and name   HE# )
        5.41  3.61  0.00 peak  217 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    2 and name   HB# )
       ( resid    3 and name    HN )
        4.45  2.65  0.00 peak  206 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name    HA )
       ( resid    4 and name   HB# )
        4.47  2.67  0.00 peak  282 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name   HG# )
       ( resid    4 and name    HN )
        5.84  3.98  0.00 peak  429 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name   HG# )
       ( resid    4 and name   HD# )
        5.79  3.99  0.00 peak  825 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HN )
       ( resid    4 and name   HB# )
        3.57  1.77  0.00 peak   47 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HN )
       ( resid    4 and name   HD# )
        4.50  2.70  0.00 peak   51 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HA )
       ( resid    4 and name   HD# )
        3.68  1.88  0.00 peak  824 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name   HB# )
       ( resid    4 and name   HD# )
        2.80  1.00  0.00 peak 1185 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name   HD# )
       ( resid    9 and name   HE# )
        4.06  2.26  0.00 peak  822 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name   HD# )
       ( resid    9 and name   HD# )
        4.37  2.57  0.00 peak   73 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name   HD# )
       ( resid   10 and name   HE# )
        4.15  2.35  0.00 peak  820 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid    6 and name    HN )
!       ( resid    9 and name   HB# )
!        3.65  1.85  0.00 peak  861 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HN )
       ( resid    7 and name   HG# )
        4.20  2.40  0.00 peak  829 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name   HG# )
       ( resid   10 and name    HN )
        5.69  3.89  0.00 peak 1005 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name   HG# )
       ( resid   61 and name    HN )
        5.92  4.12  0.00 peak 1006 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name   HG# )
       ( resid   61 and name   HG# )
        3.63  1.83  0.00 peak  977 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name   HG# )
       ( resid   62 and name    HN )
        5.92  4.12  0.00 peak 1006 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HB# )
       ( resid    9 and name    HN )
        4.11  2.31  0.00 peak  555 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HB# )
       ( resid   11 and name    HN )
        5.50  3.70  0.00 peak  163 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HB# )
       ( resid   11 and name  HG2# )
        5.14  3.34  0.00 peak 1113 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HB# )
       ( resid   37 and name   HG# )
        5.18  3.38  0.00 peak  860 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HB# )
       ( resid   59 and name   HD# )
        4.40  2.60  0.00 peak  993 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HB# )
       ( resid   62 and name    HN )
        5.81  4.01  0.00 peak  252 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HB# )
       ( resid   62 and name   HB# )
        4.94  3.14  0.00 peak  954 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HE# )
       ( resid   37 and name   HG# )
        3.51  1.71  0.00 peak  904 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HE# )
       ( resid   59 and name   HD# )
        3.82  2.02  0.00 peak   89 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HD# )
       ( resid   37 and name   HG# )
        3.82  2.02  0.00 peak   96 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HZ )
       ( resid   37 and name   HG# )
        3.15  1.35  0.00 peak  888 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   11 and name  HG1# )
        4.15  2.35  0.00 peak  158 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   61 and name   HG# )
        5.81  4.01  0.00 peak  163 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HB )
       ( resid   61 and name   HG# )
        5.81  4.01  0.00 peak  410 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HG2# )
       ( resid   12 and name   HG# )
        4.76  2.96  0.00 peak  453 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HG2# )
       ( resid   14 and name   HD# )
        3.52  1.72  0.00 peak 1238 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HG1# )
       ( resid   13 and name    HN )
        5.81  4.01  0.00 peak  985 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HG1# )
       ( resid   61 and name   HG# )
        4.17  2.37  0.00 peak  983 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HG1# )
       ( resid   62 and name    HN )
        3.89  2.09  0.00 peak  980 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HG1# )
       ( resid   62 and name    HA )
        3.48  1.68  0.00 peak  304 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   14 and name   HD# )
        4.10  2.30  0.00 peak 1239 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   61 and name   HB# )
        4.40  2.60  0.00 peak 1128 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   61 and name   HG# )
        4.07  2.27  0.00 peak 1129 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name    HN )
       ( resid   12 and name   HB# )
        3.32  1.52  0.00 peak  649 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name    HN )
       ( resid   12 and name   HG# )
        3.70  1.90  0.00 peak  454 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name    HN )
       ( resid   13 and name   HB# )
        5.03  3.23  0.00 peak  613 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name    HN )
       ( resid   14 and name   HD# )
        4.62  2.82  0.00 peak  646 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name    HA )
       ( resid   12 and name   HG# )
        3.35  1.55  0.00 peak  170 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name   HG# )
       ( resid   13 and name    HN )
        5.81  4.01  0.00 peak  432 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HN )
       ( resid   14 and name   HD# )
        5.38  3.58  0.00 peak  746 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name   HB# )
       ( resid   15 and name    HN )
        5.81  4.01  0.00 peak  725 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name   HB# )
       ( resid   33 and name   HE# )
        4.45  2.65  0.00 peak  182 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   14 and name   HB# )
        3.54  1.74  0.00 peak  105 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   14 and name   HD# )
        3.38  1.58  0.00 peak  108 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   33 and name   HB# )
        5.81  4.01  0.00 peak   98 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   33 and name   HB# )
        5.69  3.89  0.00 peak  149 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HB# )
       ( resid   18 and name  HG2# )
        3.94  2.14  0.00 peak 1094 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HB# )
       ( resid   18 and name  HD1# )
        4.85  3.05  0.00 peak 1142 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   15 and name    HN )
        3.80  2.00  0.00 peak  730 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   17 and name    HN )
        5.92  4.12  0.00 peak  752 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   29 and name    HN )
        5.92  4.12  0.00 peak  736 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   29 and name   HB# )
        5.92  4.12  0.00 peak  733 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   30 and name    HN )
        5.92  4.12  0.00 peak  603 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   30 and name    HA )
        4.69  2.89  0.00 peak  126 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   33 and name    HN )
        5.92  4.12  0.00 peak  192 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   33 and name   HB# )
        5.07  3.27  0.00 peak 1212 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   33 and name   HE# )
        3.89  2.09  0.00 peak  686 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   33 and name   HD# )
        3.78  1.98  0.00 peak   83 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   34 and name    HN )
        5.87  4.07  0.00 peak  403 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   59 and name   HD# )
        4.52  2.72  0.00 peak  996 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   61 and name   HG# )
        5.73  3.93  0.00 peak 1192 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   14 and name   HD# )
!       ( resid   62 and name    HN )
!        5.22  3.42  0.00 peak  250 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   62 and name    HA )
        3.88  2.08  0.00 peak  300 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   62 and name   HB# )
        2.93  1.13  0.00 peak  959 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   63 and name    HN )
        5.44  3.64  0.00 peak  504 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   63 and name    HA )
        4.16  2.36  0.00 peak  737 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   66 and name    HN )
        5.92  4.12  0.00 peak  740 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name   HD# )
       ( resid   66 and name    HB )
        3.94  2.14  0.00 peak  538 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name    HN )
       ( resid   15 and name   HB# )
        3.39  1.59  0.00 peak  727 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name   HB# )
       ( resid   16 and name    HN )
        3.15  1.35  0.00 peak  652 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HA )
       ( resid   16 and name   HG# )
        3.17  1.37  0.00 peak  164 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name   HG# )
       ( resid   17 and name    HA )
        4.44  2.64  0.00 peak  498 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name   HG# )
       ( resid   18 and name    HN )
        5.81  4.01  0.00 peak  505 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name   HG# )
       ( resid   20 and name    HN )
        4.50  2.70  0.00 peak  809 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name   HG# )
       ( resid   21 and name    HN )
        4.45  2.65  0.00 peak  483 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name   HG# )
       ( resid   22 and name    HN )
        4.06  2.26  0.00 peak  523 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   16 and name   HG# )
!       ( resid   22 and name   HB# )
!        2.66  0.86  0.00 peak 1198 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HA )
       ( resid   20 and name   HG# )
        5.81  4.01  0.00 peak  103 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HB# )
       ( resid   18 and name  HG2# )
        4.06  2.26  0.00 peak 1093 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HB# )
       ( resid   19 and name    HN )
        4.75  2.95  0.00 peak  704 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HA )
       ( resid   26 and name   HB# )
        4.18  2.38  0.00 peak   51 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HA )
       ( resid   26 and name   HG# )
        4.77  2.97  0.00 peak  777 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HG2# )
       ( resid   24 and name   HG# )
        5.29  3.49  0.00 peak  452 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HG2# )
       ( resid   26 and name   HG# )
        3.37  1.57  0.00 peak 1229 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   26 and name   HG# )
        4.13  2.33  0.00 peak 1138 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   70 and name   HG# )
        4.94  3.14  0.00 peak 1142 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HN )
       ( resid   19 and name   HG# )
        4.65  2.85  0.00 peak  423 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HN )
       ( resid   26 and name   HG# )
        5.81  4.01  0.00 peak  674 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HA )
       ( resid   19 and name   HG# )
        3.55  1.75  0.00 peak  424 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   20 and name    HN )
!       ( resid   20 and name   HG# )
!        3.58  1.78  0.00 peak  805 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   20 and name    HN )
       ( resid   21 and name   HB# )
        5.81  4.01  0.00 peak  398 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   20 and name    HA )
       ( resid   20 and name   HG# )
        3.33  1.53  0.00 peak  243 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   20 and name   HB# )
       ( resid   21 and name    HN )
        3.28  1.48  0.00 peak  482 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   20 and name   HB# )
       ( resid   22 and name    HN )
        4.31  2.51  0.00 peak  525 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HN )
       ( resid   21 and name   HB# )
        3.28  1.48  0.00 peak  480 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HN )
       ( resid   22 and name   HB# )
        4.16  2.36  0.00 peak  481 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HA )
       ( resid   22 and name   HB# )
        5.81  4.01  0.00 peak 1179 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name   HB# )
       ( resid   24 and name    HN )
        5.81  4.01  0.00 peak  266 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name    HN )
       ( resid   22 and name   HB# )
        3.34  1.54  0.00 peak  524 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name    HN )
       ( resid   22 and name   HG# )
        4.88  3.08  0.00 peak  458 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name    HA )
       ( resid   22 and name   HG# )
        3.32  1.52  0.00 peak  206 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name   HB# )
       ( resid   23 and name    HN )
        3.59  1.79  0.00 peak  629 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name   HG# )
       ( resid   23 and name    HN )
        4.37  2.57  0.00 peak  461 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HN )
       ( resid   24 and name   HG# )
        4.41  2.61  0.00 peak  422 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HA )
       ( resid   24 and name   HG# )
        3.57  1.77  0.00 peak  308 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name   HG# )
       ( resid   29 and name    HN )
        4.36  2.56  0.00 peak  120 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name   HG# )
       ( resid   29 and name   HB# )
        3.65  1.85  0.00 peak 1068 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name   HG# )
       ( resid   32 and name    HN )
        5.05  3.25  0.00 peak  767 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name   HG# )
       ( resid   33 and name    HN )
        4.31  2.51  0.00 peak  191 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HA )
       ( resid   26 and name   HB# )
        5.30  3.50  0.00 peak  316 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name    HN )
       ( resid   26 and name   HB# )
        3.56  1.76  0.00 peak   82 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name    HN )
       ( resid   26 and name   HG# )
        4.42  2.62  0.00 peak   83 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name    HA )
       ( resid   26 and name   HG# )
        3.65  1.85  0.00 peak  117 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   26 and name   HB# )
!       ( resid   27 and name  HG2# )
!        4.26  2.46  0.00 peak 1070 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HB# )
       ( resid   27 and name  HG1# )
        5.61  3.81  0.00 peak  510 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HB# )
       ( resid   29 and name    HN )
        5.81  4.01  0.00 peak  129 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HG# )
       ( resid   27 and name    HN )
        4.41  2.61  0.00 peak  572 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HG# )
       ( resid   29 and name    HN )
        5.81  4.01  0.00 peak  128 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HN )
       ( resid   27 and name  HG1# )
        5.81  4.01  0.00 peak  660 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HA )
       ( resid   66 and name   HG# )
        5.34  3.54  0.00 peak  727 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HA )
       ( resid   67 and name   HD# )
        4.95  3.15  0.00 peak  614 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HG2# )
       ( resid   27 and name  HG1# )
        3.17  1.37  0.00 peak 1083 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HG2# )
       ( resid   67 and name   HD# )
        5.75  3.95  0.00 peak 1072 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HG1# )
       ( resid   71 and name    HN )
        5.81  4.01  0.00 peak  656 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HD1# )
       ( resid   67 and name   HD# )
        2.68  0.88  0.00 peak  616 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HD1# )
       ( resid   70 and name   HB# )
        5.40  3.60  0.00 peak 1160 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name  HD1# )
       ( resid   70 and name   HG# )
        5.81  4.01  0.00 peak 1160 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HN )
       ( resid   66 and name   HG# )
        4.13  2.33  0.00 peak  752 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name   HB# )
       ( resid   33 and name   HB# )
        4.28  2.48  0.00 peak 1059 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   33 and name   HB# )
        4.41  2.61  0.00 peak  586 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   67 and name   HD# )
        5.77  3.97  0.00 peak  588 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HA )
       ( resid   33 and name   HB# )
        5.81  4.01  0.00 peak  127 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HA )
       ( resid   66 and name   HG# )
        4.12  2.32  0.00 peak  929 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   31 and name    HN )
       ( resid   33 and name   HB# )
        5.03  3.23  0.00 peak  641 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   32 and name    HN )
       ( resid   33 and name   HB# )
        5.81  4.01  0.00 peak  771 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name    HN )
       ( resid   33 and name   HB# )
        3.30  1.50  0.00 peak  188 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name   HB# )
       ( resid   34 and name    HN )
        4.05  2.25  0.00 peak  397 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name   HB# )
       ( resid   35 and name    HN )
        5.72  3.92  0.00 peak  667 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name   HE# )
       ( resid   37 and name   HG# )
        3.92  2.12  0.00 peak  946 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name   HE# )
       ( resid   59 and name   HD# )
        3.35  1.55  0.00 peak  187 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name   HD# )
       ( resid   37 and name   HG# )
        4.43  2.63  0.00 peak  946 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name   HD# )
       ( resid   59 and name   HD# )
        4.17  2.37  0.00 peak   84 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name    HN )
       ( resid   38 and name   HG# )
        5.63  3.83  0.00 peak  406 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HB# )
       ( resid   38 and name   HG# )
        5.38  3.58  0.00 peak  761 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HE# )
       ( resid   37 and name   HG# )
        5.11  3.31  0.00 peak  852 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HE# )
       ( resid   38 and name   HG# )
        4.34  2.54  0.00 peak  764 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HE# )
       ( resid   60 and name   HB# )
        5.34  3.54  0.00 peak  219 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HE# )
       ( resid   63 and name   HB# )
        4.23  2.43  0.00 peak  216 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HD# )
       ( resid   38 and name   HG# )
        5.60  3.80  0.00 peak  769 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HD# )
       ( resid   59 and name   HD# )
        5.13  3.33  0.00 peak   64 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HD# )
       ( resid   63 and name   HB# )
        4.17  2.37  0.00 peak   66 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HN )
       ( resid   35 and name   HB# )
        3.14  1.34  0.00 peak  743 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HN )
       ( resid   37 and name   HG# )
        4.85  3.05  0.00 peak  888 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   37 and name   HG# )
        3.40  1.60  0.00 peak  902 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   38 and name   HG# )
        4.65  2.85  0.00 peak  233 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   59 and name   HD# )
        4.49  2.69  0.00 peak  990 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HA )
       ( resid   37 and name   HG# )
        2.77  0.97  0.00 peak   40 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HB )
       ( resid   38 and name   HG# )
        4.93  3.13  0.00 peak  766 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HB )
       ( resid   59 and name   HD# )
        4.41  2.61  0.00 peak  995 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name   HG# )
       ( resid   38 and name    HN )
        3.19  1.39  0.00 peak  382 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name   HG# )
       ( resid   38 and name    HA )
        3.47  1.67  0.00 peak   19 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name   HG# )
       ( resid   40 and name    HB )
        5.24  3.44  0.00 peak    6 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name   HG# )
       ( resid   40 and name  HG2# )
        4.87  3.07  0.00 peak  972 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name   HG# )
       ( resid   41 and name    HN )
        3.85  2.05  0.00 peak  220 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name   HG# )
       ( resid   41 and name   HB# )
        3.95  2.15  0.00 peak  893 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name   HG# )
       ( resid   41 and name   HD# )
        2.99  1.19  0.00 peak 1217 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name   HG# )
       ( resid   42 and name    HN )
        5.25  3.45  0.00 peak  857 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name   HG# )
       ( resid   56 and name    HA )
        5.51  3.71  0.00 peak   55 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name   HG# )
       ( resid   59 and name    HN )
        5.52  3.72  0.00 peak  132 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name   HG# )
       ( resid   59 and name   HD# )
        3.18  1.38  0.00 peak  895 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   38 and name   HG# )
        3.11  1.31  0.00 peak  350 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   39 and name   HB# )
        5.04  3.24  0.00 peak  346 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   41 and name   HD# )
        5.18  3.38  0.00 peak  351 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   41 and name   HD# )
        4.41  2.61  0.00 peak   21 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   42 and name   HG# )
        5.92  4.12  0.00 peak 1019 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name   HG# )
       ( resid   39 and name    HN )
        5.92  4.12  0.00 peak  768 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name   HG# )
       ( resid   59 and name   HB2 )
        5.57  3.77  0.00 peak  766 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name   HG# )
       ( resid   59 and name   HD# )
        3.42  1.62  0.00 peak  767 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   39 and name   HB# )
        3.32  1.52  0.00 peak  992 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   42 and name   HG# )
        5.92  4.12  0.00 peak  985 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HA )
       ( resid   42 and name   HG# )
        5.92  4.12  0.00 peak 1018 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name   HB# )
       ( resid   40 and name    HN )
        3.30  1.50  0.00 peak  886 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name   HB# )
       ( resid   40 and name  HG2# )
        5.81  4.01  0.00 peak  966 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name   HB# )
       ( resid   41 and name    HN )
        5.78  3.98  0.00 peak  215 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name   HB# )
       ( resid   42 and name    HN )
        5.81  4.01  0.00 peak 1007 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   41 and name   HB# )
        5.33  3.53  0.00 peak  881 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   41 and name   HD# )
        5.35  3.55  0.00 peak  888 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   42 and name   HG# )
        5.56  3.76  0.00 peak  981 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   43 and name   HB# )
        5.84  4.04  0.00 peak  633 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   40 and name    HN )
!       ( resid   43 and name   HG# )
!        5.81  4.01  0.00 peak  479 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HB )
       ( resid   41 and name   HD# )
        5.92  4.12  0.00 peak    6 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name  HG2# )
       ( resid   41 and name   HB# )
        4.60  2.80  0.00 peak  915 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name  HG2# )
       ( resid   41 and name   HD# )
        5.10  3.30  0.00 peak  972 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name  HG2# )
       ( resid   43 and name   HB# )
        5.81  4.01  0.00 peak  969 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name  HG2# )
       ( resid   43 and name   HG# )
        5.81  4.01  0.00 peak  968 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HN )
       ( resid   41 and name   HB# )
        3.06  1.26  0.00 peak  218 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HN )
       ( resid   41 and name   HD# )
        3.85  2.05  0.00 peak  221 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HA )
       ( resid   41 and name   HD# )
        3.95  2.15  0.00 peak  906 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HG )
       ( resid   59 and name   HD# )
        5.92  4.12  0.00 peak  694 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name   HD# )
       ( resid   42 and name    HN )
        4.31  2.51  0.00 peak 1019 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name   HD# )
       ( resid   52 and name    HA )
        5.92  4.12  0.00 peak  914 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name   HD# )
       ( resid   55 and name    HN )
        5.10  3.30  0.00 peak  659 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name   HD# )
       ( resid   55 and name    HA )
        4.81  3.01  0.00 peak  907 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name   HD# )
       ( resid   56 and name    HN )
        5.92  4.12  0.00 peak  913 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HN )
       ( resid   42 and name   HG# )
        3.52  1.72  0.00 peak 1018 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HN )
       ( resid   44 and name   HB# )
        5.81  4.01  0.00 peak 1014 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HA )
       ( resid   42 and name   HG# )
        3.12  1.32  0.00 peak   69 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HA )
       ( resid   52 and name   HG# )
        4.50  2.70  0.00 peak  937 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HB )
       ( resid   52 and name   HG# )
        5.92  4.12  0.00 peak  935 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HG# )
       ( resid   43 and name    HN )
        3.96  2.16  0.00 peak  627 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HG# )
       ( resid   43 and name   HB# )
        5.73  3.93  0.00 peak  631 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HG# )
       ( resid   43 and name   HG# )
        5.73  3.93  0.00 peak  476 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HG# )
       ( resid   44 and name    HN )
        4.47  2.67  0.00 peak  459 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HG# )
       ( resid   44 and name   HB# )
        5.73  3.93  0.00 peak 1019 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   42 and name   HG# )
!       ( resid   45 and name    HN )
!        5.92  4.12  0.00 peak   94 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HG# )
       ( resid   52 and name    HN )
        5.92  4.12  0.00 peak 1012 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   42 and name   HG# )
!       ( resid   52 and name    HB )
!        3.22  1.42  0.00 peak  556 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HG# )
       ( resid   56 and name  HG1# )
        5.66  3.86  0.00 peak 1025 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   43 and name    HN )
!       ( resid   43 and name   HG# )
!        3.40  1.60  0.00 peak  623 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name    HN )
       ( resid   44 and name   HB# )
        5.33  3.53  0.00 peak  622 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name    HA )
       ( resid   43 and name   HB# )
        2.44  0.64  0.00 peak  271 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name    HA )
       ( resid   43 and name   HG# )
        3.55  1.75  0.00 peak  277 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   43 and name   HG# )
!       ( resid   44 and name    HN )
!        3.29  1.49  0.00 peak  457 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name    HN )
       ( resid   44 and name   HB# )
        3.23  1.43  0.00 peak  455 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   44 and name    HN )
!       ( resid   45 and name   HG# )
!        5.81  4.01  0.00 peak  472 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name   HB# )
       ( resid   46 and name    HN )
        5.87  4.07  0.00 peak  327 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HN )
       ( resid   45 and name   HG# )
        4.73  2.93  0.00 peak  489 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HN )
       ( resid   46 and name   HB# )
        5.81  4.01  0.00 peak   86 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   45 and name    HN )
!       ( resid   51 and name   HG# )
!        5.92  4.12  0.00 peak   94 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HA )
       ( resid   45 and name   HG# )
        3.71  1.91  0.00 peak  491 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name   HG# )
       ( resid   46 and name    HN )
        4.21  2.41  0.00 peak  471 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name   HG# )
       ( resid   46 and name    HA )
        4.40  2.60  0.00 peak  491 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name   HG# )
       ( resid   46 and name   HB# )
        5.61  3.81  0.00 peak  495 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name   HG# )
       ( resid   46 and name    HG )
        5.81  4.01  0.00 peak  495 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name   HG# )
       ( resid   47 and name    HN )
        3.73  1.93  0.00 peak  470 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name   HG# )
       ( resid   48 and name    HN )
        5.81  4.01  0.00 peak  468 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name   HG# )
       ( resid   51 and name   HG# )
        4.15  2.35  0.00 peak  467 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name   HG# )
       ( resid   52 and name    HN )
        5.84  4.04  0.00 peak  309 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   46 and name   HB# )
        3.08  1.28  0.00 peak  323 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   46 and name    HN )
!       ( resid   51 and name   HG# )
!        4.45  2.65  0.00 peak  329 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HA )
       ( resid   46 and name   HD# )
        3.78  1.98  0.00 peak  842 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name   HB# )
       ( resid   46 and name   HD# )
        2.44  0.64  0.00 peak  884 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name   HB# )
       ( resid   47 and name    HA )
        5.81  4.01  0.00 peak   80 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name   HD# )
       ( resid   48 and name    HN )
        5.47  3.67  0.00 peak  785 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HN )
       ( resid   51 and name   HG# )
        3.72  1.92  0.00 peak  426 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HA )
       ( resid   48 and name   HB# )
        5.81  4.01  0.00 peak   79 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HA )
       ( resid   51 and name   HG# )
        4.87  3.07  0.00 peak   81 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HB )
       ( resid   51 and name   HG# )
        4.45  2.65  0.00 peak   12 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HB )
       ( resid   52 and name   HG# )
        5.52  3.72  0.00 peak  879 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name  HG2# )
       ( resid   48 and name   HB# )
        3.72  1.92  0.00 peak  868 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name  HG2# )
       ( resid   51 and name   HG# )
        2.41  0.61  0.00 peak 1219 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HN )
       ( resid   48 and name   HB# )
        3.41  1.61  0.00 peak  523 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HN )
       ( resid   48 and name   HG# )
        4.08  2.28  0.00 peak   70 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   48 and name    HN )
!       ( resid   48 and name   HE# )
!        5.81  4.01  0.00 peak   60 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HN )
       ( resid   51 and name   HG# )
        4.66  2.86  0.00 peak   73 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HN )
       ( resid   52 and name   HG# )
        4.73  2.93  0.00 peak   71 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HB# )
       ( resid   49 and name    HN )
        3.64  1.84  0.00 peak  202 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HB# )
       ( resid   50 and name    HN )
        3.96  2.16  0.00 peak  434 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HB# )
       ( resid   50 and name   HB# )
        4.57  2.77  0.00 peak 1042 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HB# )
       ( resid   51 and name   HG# )
        3.02  1.22  0.00 peak  927 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HG# )
       ( resid   48 and name   HE# )
        2.38  0.58  0.00 peak  353 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HG# )
       ( resid   49 and name    HN )
        3.83  2.03  0.00 peak  204 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HG# )
       ( resid   50 and name    HN )
        4.76  2.96  0.00 peak  722 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HG# )
       ( resid   50 and name    HA )
        4.54  2.74  0.00 peak  303 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HG# )
       ( resid   51 and name    HN )
        4.24  2.44  0.00 peak  711 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HG# )
       ( resid   51 and name   HG# )
        3.37  1.57  0.00 peak  928 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HG# )
       ( resid   52 and name    HN )
        4.79  2.99  0.00 peak  315 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HE# )
       ( resid   49 and name    HN )
        5.81  4.01  0.00 peak  199 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HE# )
       ( resid   49 and name    HA )
        5.81  4.01  0.00 peak  253 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HE# )
       ( resid   50 and name    HN )
        4.16  2.36  0.00 peak  432 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HE# )
       ( resid   50 and name   HB# )
        4.62  2.82  0.00 peak 1035 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   48 and name   HE# )
!       ( resid   51 and name   HG# )
!        4.12  2.32  0.00 peak  354 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HN )
       ( resid   49 and name   HB# )
        3.53  1.73  0.00 peak  200 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HA )
       ( resid   52 and name   HG# )
        5.15  3.35  0.00 peak  869 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HA )
       ( resid   53 and name   HB# )
        4.67  2.87  0.00 peak  227 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name   HB# )
       ( resid   50 and name    HN )
        3.56  1.76  0.00 peak  433 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name   HB# )
       ( resid   50 and name   HB# )
        5.09  3.29  0.00 peak 1041 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name   HB# )
       ( resid   51 and name    HN )
        5.81  4.01  0.00 peak  706 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name   HB# )
       ( resid   52 and name   HG# )
        4.89  3.09  0.00 peak  404 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name   HB# )
       ( resid   53 and name    HN )
        5.81  4.01  0.00 peak  776 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name   HB# )
       ( resid   53 and name   HD# )
        4.19  2.39  0.00 peak  798 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name    HN )
       ( resid   51 and name   HG# )
        4.91  3.11  0.00 peak  917 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name    HN )
       ( resid   52 and name   HG# )
        4.38  2.58  0.00 peak  438 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name   HB# )
       ( resid   51 and name   HG# )
        3.62  1.82  0.00 peak 1224 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HN )
       ( resid   51 and name   HG# )
        3.21  1.41  0.00 peak  713 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HN )
       ( resid   52 and name   HG# )
        4.77  2.97  0.00 peak  878 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HA )
       ( resid   51 and name   HG# )
        2.78  0.98  0.00 peak   52 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HA )
       ( resid   54 and name   HB# )
        4.85  3.05  0.00 peak   50 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HB )
       ( resid   52 and name   HG# )
        4.56  2.76  0.00 peak  871 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name   HG# )
       ( resid   52 and name    HN )
        3.46  1.66  0.00 peak  316 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name   HG# )
       ( resid   52 and name    HA )
        5.92  4.12  0.00 peak  979 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name   HG# )
       ( resid   54 and name    HN )
        5.92  4.12  0.00 peak  981 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name   HG# )
       ( resid   54 and name   HG# )
        5.06  3.26  0.00 peak  773 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name   HG# )
       ( resid   54 and name   HE# )
        5.92  4.12  0.00 peak  989 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   52 and name   HG# )
        3.63  1.83  0.00 peak  875 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   53 and name   HB# )
        5.14  3.34  0.00 peak  315 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   52 and name    HN )
!       ( resid   54 and name   HG# )
!        4.58  2.78  0.00 peak  360 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   54 and name   HD# )
        5.60  3.80  0.00 peak  310 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HA )
       ( resid   52 and name   HG# )
        3.02  1.22  0.00 peak   18 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   52 and name    HA )
!       ( resid   54 and name   HD# )
!        5.44  3.64  0.00 peak  653 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name   HG# )
       ( resid   53 and name    HN )
        3.44  1.64  0.00 peak  785 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name   HG# )
       ( resid   53 and name    HA )
        3.63  1.83  0.00 peak  215 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name   HG# )
       ( resid   53 and name   HB# )
        3.96  2.16  0.00 peak  898 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name   HG# )
       ( resid   54 and name    HN )
        4.78  2.98  0.00 peak  538 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   52 and name   HG# )
!       ( resid   54 and name   HG# )
!        5.23  3.43  0.00 peak  839 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name   HG# )
       ( resid   54 and name   HD# )
        5.34  3.54  0.00 peak  941 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name   HG# )
       ( resid   55 and name    HN )
        4.81  3.01  0.00 peak  698 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name   HG# )
       ( resid   56 and name    HB )
        5.92  4.12  0.00 peak  941 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   53 and name   HB# )
        3.19  1.39  0.00 peak  784 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   53 and name   HD# )
        3.88  2.08  0.00 peak  796 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   54 and name   HD# )
        5.39  3.59  0.00 peak  787 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   56 and name  HG1# )
        4.64  2.84  0.00 peak  783 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HA )
       ( resid   53 and name   HD# )
        3.45  1.65  0.00 peak  804 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HB# )
       ( resid   53 and name   HD# )
        2.67  0.87  0.00 peak  807 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   53 and name   HB# )
!       ( resid   56 and name  HD1# )
!        5.30  3.50  0.00 peak 1151 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HD# )
       ( resid   54 and name    HN )
        5.27  3.47  0.00 peak  538 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HD# )
       ( resid   56 and name    HA )
        5.92  4.12  0.00 peak   55 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HD# )
       ( resid   56 and name    HB )
        4.14  2.34  0.00 peak  408 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HD# )
       ( resid   56 and name  HG1# )
        3.97  2.17  0.00 peak  606 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HD# )
       ( resid   57 and name    HA )
        4.80  3.00  0.00 peak  795 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HD# )
       ( resid   57 and name   HG# )
        3.70  1.90  0.00 peak  465 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HN )
       ( resid   54 and name   HG# )
        3.73  1.93  0.00 peak  490 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HN )
       ( resid   56 and name  HG1# )
        5.81  4.01  0.00 peak  633 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HN )
       ( resid   57 and name   HG# )
        4.90  3.10  0.00 peak  485 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HA )
       ( resid   54 and name   HG# )
        3.63  1.83  0.00 peak  191 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HA )
       ( resid   57 and name   HG# )
        5.81  4.01  0.00 peak  462 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name   HB# )
       ( resid   54 and name   HE# )
        4.64  2.84  0.00 peak  557 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name   HG# )
       ( resid   54 and name   HE# )
        2.95  1.15  0.00 peak  357 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name   HG# )
       ( resid   55 and name    HN )
        5.81  4.01  0.00 peak  779 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name   HD# )
       ( resid   54 and name   HE# )
        2.05  0.25  0.00 peak  352 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name    HN )
       ( resid   57 and name   HG# )
        5.31  3.51  0.00 peak  656 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   59 and name   HD# )
        5.92  4.12  0.00 peak   48 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name  HG2# )
       ( resid   57 and name   HG# )
        5.81  4.01  0.00 peak 1047 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name  HG2# )
       ( resid   59 and name   HD# )
        4.29  2.49  0.00 peak 1054 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name  HG1# )
       ( resid   57 and name    HN )
        4.04  2.24  0.00 peak  416 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   59 and name   HD# )
        4.16  2.36  0.00 peak  134 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HA )
       ( resid   59 and name   HD# )
        3.81  2.01  0.00 peak  992 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name   HB2 )
       ( resid   61 and name   HG# )
        5.81  4.01  0.00 peak  412 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name   HD# )
       ( resid   60 and name    HN )
        4.82  3.02  0.00 peak  318 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name   HD# )
       ( resid   62 and name   HB# )
        4.09  2.29  0.00 peak  994 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HN )
       ( resid   61 and name   HB# )
        5.78  3.98  0.00 peak  597 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HN )
       ( resid   61 and name   HG# )
        5.81  4.01  0.00 peak 1195 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name   HB# )
       ( resid   61 and name   HG# )
        5.61  3.81  0.00 peak 1192 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name   HB# )
       ( resid   62 and name    HN )
        5.81  4.01  0.00 peak  250 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name   HB# )
       ( resid   63 and name    HN )
        5.81  4.01  0.00 peak  501 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name   HB# )
       ( resid   63 and name   HE# )
        5.06  3.26  0.00 peak  208 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name   HB# )
       ( resid   63 and name   HD# )
        5.18  3.38  0.00 peak   42 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HN )
       ( resid   61 and name   HB# )
        3.41  1.61  0.00 peak  511 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HN )
       ( resid   61 and name   HG# )
        3.49  1.69  0.00 peak  515 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HA )
       ( resid   61 and name   HG# )
        3.56  1.76  0.00 peak  142 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name   HB# )
       ( resid   62 and name    HN )
        4.03  2.23  0.00 peak  246 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name   HG# )
       ( resid   62 and name    HN )
        4.10  2.30  0.00 peak  245 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name   HG# )
       ( resid   65 and name   HB# )
        5.61  3.81  0.00 peak  410 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HN )
       ( resid   63 and name   HB# )
        5.81  4.01  0.00 peak  253 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HN )
       ( resid   65 and name   HB# )
        5.32  3.52  0.00 peak  248 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HA )
       ( resid   65 and name   HB# )
        5.41  3.61  0.00 peak  302 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HN )
       ( resid   64 and name   HB# )
        5.81  4.01  0.00 peak  506 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HN )
       ( resid   65 and name   HB# )
        5.81  4.01  0.00 peak  508 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name   HB# )
       ( resid   64 and name    HN )
        3.57  1.77  0.00 peak  688 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name   HE# )
       ( resid   67 and name   HD# )
        4.83  3.03  0.00 peak  209 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name    HN )
       ( resid   66 and name   HG# )
        5.61  3.81  0.00 peak  373 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name   HG# )
        3.10  1.30  0.00 peak  305 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   66 and name   HG# )
        2.95  1.15  0.00 peak  933 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name   HG# )
       ( resid   67 and name    HN )
        3.71  1.91  0.00 peak  290 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name   HG# )
       ( resid   67 and name    HA )
        4.23  2.43  0.00 peak  754 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   66 and name   HG# )
!       ( resid   67 and name   HD# )
!        3.40  1.60  0.00 peak  756 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name   HG# )
       ( resid   69 and name    HN )
        5.92  4.12  0.00 peak 1036 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name   HG# )
       ( resid   70 and name   HG# )
        3.12  1.32  0.00 peak  435 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   70 and name   HB# )
        5.49  3.69  0.00 peak  298 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   70 and name   HG# )
        5.81  4.01  0.00 peak  298 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   67 and name   HD# )
        4.81  3.01  0.00 peak  154 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name   HB2 )
       ( resid   68 and name   HD# )
        5.81  4.01  0.00 peak  341 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name   HD# )
       ( resid   70 and name    HN )
        5.81  4.01  0.00 peak  613 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid   67 and name   HD# )
!       ( resid   70 and name   HB# )
!        4.90  3.10  0.00 peak  619 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   68 and name   HG# )
        3.64  1.84  0.00 peak  795 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   68 and name   HD# )
        4.99  3.19  0.00 peak  793 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   69 and name   HA# )
        4.33  2.53  0.00 peak  791 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   70 and name   HB# )
        5.81  4.01  0.00 peak  800 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   68 and name   HG# )
        3.03  1.23  0.00 peak  211 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   68 and name   HD# )
        5.43  3.63  0.00 peak  337 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name   HB1 )
       ( resid   68 and name   HD# )
        3.39  1.59  0.00 peak  340 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name   HB1 )
       ( resid   69 and name   HA# )
        4.46  2.66  0.00 peak  581 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name   HG# )
       ( resid   69 and name    HN )
        4.68  2.88  0.00 peak 1035 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HN )
       ( resid   69 and name   HA# )
        2.58  0.78  0.00 peak 1033 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HN )
       ( resid   70 and name   HB# )
        5.81  4.01  0.00 peak 1034 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HN )
       ( resid   70 and name   HG# )
        4.75  2.95  0.00 peak  427 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name   HA# )
       ( resid   70 and name    HN )
        3.10  1.30  0.00 peak  367 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name   HA# )
       ( resid   70 and name    HA )
        5.24  3.44  0.00 peak 1177 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HN )
       ( resid   70 and name   HB# )
        3.05  1.25  0.00 peak  369 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HN )
       ( resid   70 and name   HG# )
        3.81  2.01  0.00 peak  437 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HA )
       ( resid   70 and name   HB# )
        2.60  0.80  0.00 peak  239 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HA )
       ( resid   70 and name   HG# )
        3.08  1.28  0.00 peak  239 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HN )
       ( resid   71 and name   HB# )
        3.06  1.26  0.00 peak  759 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HN )
       ( resid   72 and name   HG# )
        5.81  4.01  0.00 peak  768 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HA )
       ( resid   72 and name   HB# )
        4.87  3.07  0.00 peak  182 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name   HB# )
       ( resid   72 and name    HN )
        3.89  2.09  0.00 peak  146 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name   HB# )
       ( resid   73 and name    HN )
        5.61  3.81  0.00 peak  180 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HN )
       ( resid   72 and name   HB# )
        3.48  1.68  0.00 peak  149 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HN )
       ( resid   72 and name   HG# )
        4.16  2.36  0.00 peak  150 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HA )
       ( resid   72 and name   HG# )
        3.61  1.81  0.00 peak  248 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HA )
       ( resid   72 and name   HD# )
        5.81  4.01  0.00 peak  640 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name   HB# )
       ( resid   73 and name    HN )
        3.90  2.10  0.00 peak  182 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name   HB# )
       ( resid   73 and name   HD# )
        5.73  3.93  0.00 peak  521 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HN )
       ( resid   73 and name   HB# )
        3.00  1.20  0.00 peak  183 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HN )
       ( resid   73 and name   HD# )
        4.53  2.73  0.00 peak  858 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HN )
       ( resid   74 and name   HG# )
        5.81  4.01  0.00 peak  181 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HA )
       ( resid   73 and name   HD# )
        3.48  1.68  0.00 peak  299 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HA )
       ( resid   74 and name   HB# )
        5.34  3.54  0.00 peak  582 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HB# )
       ( resid   73 and name   HD# )
        2.70  0.90  0.00 peak  376 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HB# )
       ( resid   74 and name    HN )
        4.12  2.32  0.00 peak  272 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HB# )
       ( resid   74 and name   HG# )
        5.10  3.30  0.00 peak  443 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HD# )
       ( resid   74 and name    HN )
        4.67  2.87  0.00 peak  849 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HD# )
       ( resid   75 and name    HN )
        5.80  4.00  0.00 peak  856 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HD# )
       ( resid   75 and name   HB# )
        5.73  3.93  0.00 peak  853 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HN )
       ( resid   74 and name   HB# )
        3.19  1.39  0.00 peak  589 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HN )
       ( resid   74 and name   HG# )
        3.71  1.91  0.00 peak  270 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   74 and name   HG# )
        3.53  1.73  0.00 peak  278 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name   HB# )
       ( resid   75 and name    HA )
        5.81  4.01  0.00 peak  292 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name    HA )
       ( resid  107 and name  HG1# )
        4.09  2.29  0.00 peak    1 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name  HG1# )
       ( resid  140 and name    HB )
        6.00  4.20  0.00 peak    5 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name  HG2# )
       ( resid  140 and name    HB )
        6.00  4.20  0.00 peak    6 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HA )
       ( resid  140 and name    HB )
        6.00  4.20  0.00 peak    7 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name    HB )
       ( resid  141 and name    HN )
        6.00  4.20  0.00 peak   10 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name    HA )
       ( resid  152 and name  HG1# )
        3.45  1.65  0.00 peak   18 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  138 and name    HA )
       ( resid  141 and name    HG )
        4.15  2.35  0.00 peak   21 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HA )
       ( resid  114 and name  HD2# )
        4.20  2.40  0.00 peak   22 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HA )
       ( resid  162 and name   HB# )
        6.00  4.20  0.00 peak   23 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HA )
       ( resid  114 and name  HD1# )
        4.20  2.40  0.00 peak   24 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name    HB )
       ( resid  108 and name    HA )
        4.84  3.04  0.00 peak   25 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  108 and name    HA )
       ( resid  111 and name    HB )
        3.59  1.79  0.00 peak   26 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  108 and name    HA )
       ( resid  111 and name  HG2# )
        4.48  2.68  0.00 peak   28 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  108 and name    HA )
       ( resid  111 and name  HD1# )
        4.62  2.82  0.00 peak   28 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  130 and name    HN )
!       ( resid  166 and name    HA )
!        6.00  4.20  0.00 peak   34 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  166 and name    HA )
       ( resid  166 and name  HG2# )
        3.43  1.63  0.00 peak   36 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  166 and name    HA )
!       ( resid  167 and name   HG1 )
!        6.00  4.20  0.00 peak   38 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HA )
       ( resid  137 and name  HG1# )
        3.53  1.73  0.00 peak   40 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HA )
       ( resid  141 and name    HG )
        6.00  4.20  0.00 peak   42 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HA )
       ( resid  137 and name  HG2# )
        3.53  1.73  0.00 peak   43 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name    HA )
       ( resid  151 and name  HG2# )
        3.27  1.47  0.00 peak   52 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name    HA )
       ( resid  151 and name  HG1# )
        3.27  1.47  0.00 peak   53 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name    HA )
       ( resid  156 and name  HG2# )
        4.05  2.25  0.00 peak   56 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name    HN )
       ( resid  147 and name    HA )
        5.53  3.73  0.00 peak   70 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  146 and name    HG )
!       ( resid  147 and name    HA )
!        6.00  4.20  0.00 peak   80 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name    HA )
       ( resid  147 and name  HG2# )
        3.59  1.79  0.00 peak   84 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name    HA )
       ( resid  127 and name  HD1# )
        3.32  1.52  0.00 peak   89 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  117 and name    HA )
       ( resid  119 and name    HN )
        6.00  4.20  0.00 peak  102 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  117 and name    HA )
       ( resid  120 and name    HN )
        6.00  4.20  0.00 peak  102 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  117 and name    HA )
       ( resid  125 and name    HN )
        6.00  4.20  0.00 peak  105 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  115 and name    HA )
       ( resid  118 and name  HG1# )
        3.48  1.68  0.00 peak  110 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  125 and name    HN )
       ( resid  126 and name    HA )
        6.00  4.20  0.00 peak  116 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  165 and name    HA )
       ( resid  167 and name    HN )
        6.00  4.20  0.00 peak  116 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name  HG2# )
       ( resid  126 and name    HA )
        3.55  1.75  0.00 peak  118 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name  HD1# )
       ( resid  126 and name    HA )
        4.87  3.07  0.00 peak  119 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name    HA )
       ( resid  129 and name   HB# )
        3.65  1.85  0.00 peak  123 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  129 and name   HB# )
       ( resid  130 and name    HA )
        6.00  4.20  0.00 peak  124 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  130 and name    HA )
       ( resid  166 and name  HG2# )
        5.20  3.40  0.00 peak  126 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  160 and name    HN )
       ( resid  161 and name    HA )
        5.50  3.70  0.00 peak  141 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HA )
       ( resid  118 and name  HG1# )
        6.00  4.20  0.00 peak  151 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  166 and name    HB )
       ( resid  167 and name    HA )
        6.00  4.20  0.00 peak  151 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HD1# )
       ( resid  167 and name    HA )
        4.10  2.30  0.00 peak  152 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  167 and name    HA )
       ( resid  167 and name   HG1 )
        3.44  1.64  0.00 peak  156 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HG2# )
       ( resid  114 and name    HA )
        6.00  4.20  0.00 peak  161 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HA )
       ( resid  118 and name  HD1# )
        6.00  4.20  0.00 peak  175 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name    HB )
       ( resid  119 and name    HA )
        4.76  2.96  0.00 peak  189 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name    HA )
       ( resid  156 and name  HD1# )
        4.44  2.64  0.00 peak  213 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  172 and name    HA )
       ( resid  173 and name    HN )
        3.57  1.77  0.00 peak  219 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  158 and name    HA )
       ( resid  161 and name    HN )
        4.14  2.34  0.00 peak  245 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  164 and name    HA )
       ( resid  167 and name    HN )
        3.84  2.04  0.00 peak  251 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name    HA )
       ( resid  150 and name   HB# )
        6.00  4.20  0.00 peak  259 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  146 and name    HA )
!       ( resid  146 and name    HG )
!        2.58  0.78  0.00 peak  263 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name    HA )
       ( resid  148 and name    HN )
        3.66  1.86  0.00 peak  267 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name    HN )
       ( resid  146 and name    HA )
        2.93  1.13  0.00 peak  268 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name    HA )
       ( resid  152 and name    HN )
        5.69  3.89  0.00 peak  269 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  140 and name  HG2# )
!       ( resid  143 and name    HA )
!        6.00  4.20  0.00 peak  272 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  140 and name    HN )
!       ( resid  143 and name    HA )
!        6.00  4.20  0.00 peak  276 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  174 and name    HA )
       ( resid  174 and name   HG1 )
        4.11  2.31  0.00 peak  278 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  174 and name    HA )
       ( resid  174 and name   HG2 )
        4.11  2.31  0.00 peak  278 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  103 and name    HA )
       ( resid  104 and name    HA )
        4.61  2.81  0.00 peak  279 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  103 and name    HA )
!       ( resid  104 and name    HG )
!        6.00  4.20  0.00 peak  283 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name    HA )
       ( resid  173 and name    HG )
        3.51  1.71  0.00 peak  298 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  124 and name    HA )
       ( resid  125 and name   HB1 )
        6.00  4.20  0.00 peak  314 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  125 and name   HB2 )
       ( resid  130 and name    HN )
        5.83  4.03  0.00 peak  347 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name   HB2 )
       ( resid  146 and name  HD2# )
        3.28  1.48  0.00 peak  349 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  154 and name   HD1 )
       ( resid  154 and name   HE# )
        2.36  0.56  0.00 peak  352 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  154 and name   HD2 )
       ( resid  154 and name   HE# )
        2.36  0.56  0.00 peak  360 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name   HB1 )
       ( resid  173 and name  HD1# )
        3.73  1.93  0.00 peak  376 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name   HB1 )
       ( resid  173 and name  HD2# )
        3.73  1.93  0.00 peak  376 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name   HB2 )
       ( resid  173 and name  HD1# )
        3.73  1.93  0.00 peak  380 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name   HB2 )
       ( resid  173 and name  HD2# )
        3.73  1.93  0.00 peak  380 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name  HD1# )
       ( resid  156 and name    HB )
        5.17  3.37  0.00 peak  408 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name  HG2# )
       ( resid  161 and name   HG2 )
        6.00  4.20  0.00 peak  415 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  117 and name    HN )
!       ( resid  124 and name   HG1 )
!        6.00  4.20  0.00 peak  420 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  117 and name    HN )
       ( resid  124 and name   HG2 )
        6.00  4.20  0.00 peak  450 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  116 and name   HG1 )
       ( resid  117 and name    HN )
        6.00  4.20  0.00 peak  487 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  116 and name   HG1 )
       ( resid  121 and name    HN )
        5.17  3.37  0.00 peak  493 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  116 and name   HG2 )
       ( resid  117 and name    HN )
        6.00  4.20  0.00 peak  506 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name    HN )
       ( resid  126 and name   HB2 )
        4.06  2.26  0.00 peak  516 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  172 and name    HN )
       ( resid  172 and name   HB1 )
        4.02  2.22  0.00 peak  518 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  166 and name    HN )
       ( resid  166 and name    HB )
        4.17  2.37  0.00 peak  535 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  164 and name    HN )
       ( resid  166 and name    HB )
        6.00  4.20  0.00 peak  537 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HD1# )
       ( resid  167 and name   HB1 )
        6.00  4.20  0.00 peak  544 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  124 and name   HB1 )
       ( resid  125 and name    HN )
        6.00  4.20  0.00 peak  547 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name    HN )
       ( resid  151 and name    HB )
        6.00  4.20  0.00 peak  547 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  117 and name    HN )
       ( resid  124 and name   HB1 )
        6.00  4.20  0.00 peak  552 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  117 and name    HN )
!       ( resid  124 and name   HB2 )
!        5.09  3.29  0.00 peak  554 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name    HB )
       ( resid  153 and name    HN )
        4.56  2.76  0.00 peak  555 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  170 and name   HB2 )
       ( resid  171 and name    HN )
        4.13  2.33  0.00 peak  584 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  167 and name    HN )
       ( resid  168 and name   HB1 )
        6.00  4.20  0.00 peak  586 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  122 and name   HB2 )
       ( resid  123 and name    HN )
        4.16  2.36  0.00 peak  629 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  137 and name    HB )
!       ( resid  141 and name    HG )
!        6.00  4.20  0.00 peak  672 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name    HG )
       ( resid  148 and name    HN )
        6.00  4.20  0.00 peak  674 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name    HN )
       ( resid  146 and name    HG )
        5.36  3.56  0.00 peak  677 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name    HG )
       ( resid  174 and name    HN )
        4.46  2.66  0.00 peak  681 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name    HN )
       ( resid  173 and name    HG )
        4.49  2.69  0.00 peak  682 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  140 and name    HN )
!       ( resid  141 and name    HG )
!        6.00  4.20  0.00 peak  692 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  139 and name    HN )
!       ( resid  141 and name    HG )
!        6.00  4.20  0.00 peak  695 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  159 and name  HD2# )
!       ( resid  163 and name    HA )
!        6.00  4.20  0.00 peak  713 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name  HD1# )
       ( resid  162 and name    HN )
        6.00  4.20  0.00 peak  736 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  159 and name    HG )
       ( resid  160 and name    HN )
        6.00  4.20  0.00 peak  740 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  130 and name    HN )
       ( resid  166 and name  HG2# )
        3.96  2.16  0.00 peak  751 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name    HN )
       ( resid  146 and name  HD1# )
        4.91  3.11  0.00 peak  757 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HD1# )
       ( resid  167 and name   HG1 )
        4.93  3.13  0.00 peak  773 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name   HB1 )
       ( resid  146 and name  HD1# )
        3.28  1.48  0.00 peak  786 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name   HB2 )
       ( resid  146 and name  HD1# )
        3.28  1.48  0.00 peak  787 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name    HN )
       ( resid  153 and name  HD1# )
        4.53  2.73  0.00 peak  792 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name    HA )
       ( resid  153 and name  HD1# )
        4.21  2.41  0.00 peak  795 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name    HN )
       ( resid  153 and name  HD2# )
        4.53  2.73  0.00 peak  796 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name  HD2# )
       ( resid  156 and name    HB )
        5.17  3.37  0.00 peak  800 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name    HA )
       ( resid  153 and name  HD2# )
        4.21  2.41  0.00 peak  804 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name  HD2# )
       ( resid  110 and name   HE# )
        4.98  3.18  0.00 peak  809 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name  HD2# )
       ( resid  110 and name   HD# )
        6.00  4.20  0.00 peak  810 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name  HD2# )
       ( resid  109 and name   HE# )
        4.75  2.95  0.00 peak  811 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name    HA )
       ( resid  104 and name  HD2# )
        4.34  2.54  0.00 peak  812 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name    HN )
       ( resid  104 and name  HD2# )
        6.00  4.20  0.00 peak  817 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name  HD1# )
       ( resid  110 and name   HE# )
        4.98  3.18  0.00 peak  820 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name  HD1# )
       ( resid  110 and name   HD# )
        6.00  4.20  0.00 peak  821 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name  HD1# )
       ( resid  109 and name   HE# )
        4.75  2.95  0.00 peak  822 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name  HD1# )
       ( resid  109 and name   HD# )
        5.59  3.79  0.00 peak  823 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name    HA )
       ( resid  104 and name  HD1# )
        4.34  2.54  0.00 peak  824 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name    HN )
       ( resid  107 and name  HG2# )
        4.85  3.05  0.00 peak  829 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name    HN )
       ( resid  147 and name  HG2# )
        6.00  4.20  0.00 peak  830 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name  HG2# )
       ( resid  152 and name    HN )
        4.99  3.19  0.00 peak  831 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name    HN )
       ( resid  146 and name  HD2# )
        4.91  3.11  0.00 peak  841 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name  HG2# )
       ( resid  148 and name    HN )
        3.95  2.15  0.00 peak  862 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name  HG2# )
       ( resid  151 and name    HN )
        6.00  4.20  0.00 peak  864 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name    HA )
       ( resid  107 and name  HG2# )
        4.09  2.29  0.00 peak  865 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  147 and name  HG2# )
!       ( resid  151 and name    HB )
!        3.06  1.26  0.00 peak  867 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name    HN )
       ( resid  152 and name  HG2# )
        5.13  3.33  0.00 peak  875 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name    HA )
       ( resid  152 and name  HG2# )
        3.45  1.65  0.00 peak  880 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name   HB1 )
       ( resid  146 and name  HD2# )
        3.28  1.48  0.00 peak  884 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name    HZ )
       ( resid  137 and name  HG1# )
        4.31  2.51  0.00 peak  888 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name   HE# )
       ( resid  137 and name  HG1# )
        4.11  2.31  0.00 peak  889 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name   HE# )
       ( resid  137 and name  HG2# )
        4.11  2.31  0.00 peak  904 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name    HN )
       ( resid  151 and name  HG2# )
        5.55  3.75  0.00 peak  918 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name    HN )
       ( resid  151 and name  HG2# )
        4.92  3.12  0.00 peak  920 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  130 and name    HA )
       ( resid  166 and name  HG1# )
        5.20  3.40  0.00 peak  929 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  130 and name    HN )
       ( resid  166 and name  HG1# )
        3.88  2.08  0.00 peak  932 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  166 and name    HA )
!       ( resid  166 and name  HG1# )
!        3.43  1.63  0.00 peak  933 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name    HN )
       ( resid  152 and name  HG1# )
        5.13  3.33  0.00 peak  942 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  162 and name    HN )
       ( resid  162 and name   HB# )
        4.09  2.29  0.00 peak  956 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  159 and name    HA )
       ( resid  162 and name   HB# )
        6.00  4.20  0.00 peak  957 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name  HD1# )
       ( resid  162 and name   HB# )
        3.91  2.11  0.00 peak  959 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name    HA )
       ( resid  140 and name  HG2# )
        3.55  1.75  0.00 peak  965 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HA )
       ( resid  140 and name  HG2# )
        5.52  3.72  0.00 peak  967 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name  HG1# )
       ( resid  161 and name   HG1 )
        6.00  4.20  0.00 peak  974 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name  HG1# )
       ( resid  161 and name   HG2 )
        6.00  4.20  0.00 peak  977 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HN )
       ( resid  159 and name  HD1# )
        5.39  3.59  0.00 peak  990 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  159 and name  HD1# )
!       ( resid  163 and name    HA )
!        6.00  4.20  0.00 peak  991 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name  HG2# )
       ( resid  143 and name    HN )
        5.19  3.39  0.00 peak 1017 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name    HN )
       ( resid  142 and name  HG2# )
        4.09  2.29  0.00 peak 1021 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  150 and name   HB# )
       ( resid  151 and name    HN )
        4.61  2.81  0.00 peak 1032 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HE2 )
       ( resid  150 and name   HB# )
        5.27  3.47  0.00 peak 1034 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HE1 )
       ( resid  150 and name   HB# )
        5.27  3.47  0.00 peak 1035 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  150 and name   HB# )
       ( resid  151 and name    HB )
        6.00  4.20  0.00 peak 1036 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  150 and name    HN )
       ( resid  150 and name   HB# )
        3.44  1.64  0.00 peak 1038 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  150 and name   HB# )
       ( resid  153 and name    HN )
        5.44  3.64  0.00 peak 1040 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  139 and name    HN )
!       ( resid  156 and name  HG2# )
!        6.00  4.20  0.00 peak 1045 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  153 and name    HN )
!       ( resid  156 and name  HG2# )
!        6.00  4.20  0.00 peak 1045 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name    HN )
       ( resid  156 and name  HG2# )
        6.00  4.20  0.00 peak 1046 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name  HG2# )
       ( resid  157 and name    HN )
        6.00  4.20  0.00 peak 1050 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name  HG2# )
       ( resid  160 and name    HN )
        6.00  4.20  0.00 peak 1050 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name    HA )
       ( resid  156 and name  HG2# )
        6.00  4.20  0.00 peak 1051 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name  HG2# )
       ( resid  157 and name    HA )
        6.00  4.20  0.00 peak 1051 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  142 and name    HB )
!       ( resid  156 and name  HG2# )
!        6.00  4.20  0.00 peak 1053 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  138 and name    HA )
       ( resid  156 and name  HG2# )
        6.00  4.20  0.00 peak 1055 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  125 and name    HN )
       ( resid  129 and name   HB# )
        3.80  2.00  0.00 peak 1056 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  124 and name   HB1 )
       ( resid  129 and name   HB# )
        5.10  3.30  0.00 peak 1060 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  129 and name    HN )
       ( resid  129 and name   HB# )
        3.86  2.06  0.00 peak 1064 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HA )
       ( resid  129 and name   HB# )
        4.23  2.43  0.00 peak 1067 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HG2# )
       ( resid  129 and name   HB# )
        5.40  3.60  0.00 peak 1073 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HG2# )
       ( resid  128 and name    HN )
        6.00  4.20  0.00 peak 1078 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name    HN )
       ( resid  127 and name  HG2# )
        6.00  4.20  0.00 peak 1084 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name  HG2# )
       ( resid  118 and name  HG1# )
        3.35  1.55  0.00 peak 1087 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  115 and name    HN )
       ( resid  118 and name  HG2# )
        5.06  3.26  0.00 peak 1088 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name    HN )
       ( resid  118 and name  HG2# )
        4.43  2.63  0.00 peak 1089 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name  HG2# )
       ( resid  119 and name    HN )
        4.72  2.92  0.00 peak 1090 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  115 and name    HA )
       ( resid  118 and name  HG2# )
        5.28  3.48  0.00 peak 1091 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name    HA )
       ( resid  118 and name  HG2# )
        3.81  2.01  0.00 peak 1092 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name  HG2# )
       ( resid  118 and name  HG1# )
        3.19  1.39  0.00 peak 1095 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name  HG2# )
       ( resid  129 and name   HB# )
        3.62  1.82  0.00 peak 1096 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HG2# )
       ( resid  114 and name    HN )
        6.00  4.20  0.00 peak 1114 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HG2# )
       ( resid  162 and name    HA )
        4.50  2.70  0.00 peak 1116 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HA )
       ( resid  111 and name  HG2# )
        4.13  2.33  0.00 peak 1117 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HG2# )
       ( resid  162 and name   HB# )
        3.41  1.61  0.00 peak 1120 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HD1# )
       ( resid  162 and name    HA )
        4.49  2.69  0.00 peak 1125 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HA )
       ( resid  111 and name  HD1# )
        6.00  4.20  0.00 peak 1126 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HB )
       ( resid  111 and name  HD1# )
        2.98  1.18  0.00 peak 1130 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HD1# )
       ( resid  162 and name   HB# )
        3.56  1.76  0.00 peak 1132 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name    HN )
       ( resid  118 and name  HD1# )
        4.99  3.19  0.00 peak 1135 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name  HD1# )
       ( resid  119 and name    HA )
        6.00  4.20  0.00 peak 1136 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name  HD1# )
       ( resid  129 and name   HB# )
        4.55  2.75  0.00 peak 1137 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  115 and name    HA )
       ( resid  118 and name  HD1# )
        3.94  2.14  0.00 peak 1139 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name    HA )
       ( resid  118 and name  HD1# )
        4.49  2.69  0.00 peak 1140 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name    HN )
       ( resid  156 and name  HD1# )
        5.19  3.39  0.00 peak 1146 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name    HA )
       ( resid  156 and name  HD1# )
        6.00  4.20  0.00 peak 1148 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name    HB )
       ( resid  156 and name  HD1# )
        5.86  4.06  0.00 peak 1149 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name    HB )
       ( resid  156 and name  HD1# )
        3.48  1.68  0.00 peak 1150 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HD1# )
       ( resid  167 and name    HN )
        6.00  4.20  0.00 peak 1153 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HD1# )
       ( resid  171 and name    HN )
        4.98  3.18  0.00 peak 1154 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name    HN )
       ( resid  127 and name  HD1# )
        5.00  3.20  0.00 peak 1155 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HD1# )
       ( resid  163 and name   HE# )
        6.00  4.20  0.00 peak 1156 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name    HB )
       ( resid  127 and name  HD1# )
        3.28  1.48  0.00 peak 1161 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  121 and name    HA )
       ( resid  124 and name   HB2 )
        6.00  4.20  0.00 peak 1179 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name  HG2# )
       ( resid  161 and name   HG1 )
        6.00  4.20  0.00 peak 1192 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  141 and name    HN )
       ( resid  141 and name    HG )
        6.00  4.20  0.00 peak 1211 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name  HD2# )
       ( resid  162 and name   HB# )
        3.91  2.11  0.00 peak 1213 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HD# )
       ( resid  159 and name  HD2# )
        6.00  4.20  0.00 peak 1215 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name  HG2# )
       ( resid  151 and name  HG2# )
        2.79  0.99  0.00 peak 1218 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name  HG2# )
       ( resid  151 and name  HG1# )
        2.79  0.99  0.00 peak 1219 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name  HG1# )
       ( resid  129 and name   HB# )
        5.35  3.55  0.00 peak 1227 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  129 and name   HB# )
       ( resid  166 and name    HB )
        5.61  3.81  0.00 peak 1227 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  116 and name    HA )
       ( resid  120 and name   HE# )
        4.71  2.91  0.00 peak 1231 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  119 and name    HN )
       ( resid  120 and name   HE# )
        5.85  4.05  0.00 peak 1233 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  117 and name    HN )
       ( resid  120 and name   HE# )
        6.00  4.20  0.00 peak 1234 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  156 and name  HD1# )
!       ( resid  160 and name    HN )
!        6.00  4.20  0.00 peak 1243 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  103 and name    HA )
       ( resid  104 and name    HN )
        3.44  1.64  0.00 peak   45 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name    HN )
       ( resid  104 and name    HG )
        4.88  3.08  0.00 peak   48 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name    HN )
       ( resid  104 and name  HD1# )
        6.00  4.20  0.00 peak   51 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name    HN )
       ( resid  151 and name    HN )
        6.00  4.20  0.00 peak   59 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name    HN )
       ( resid  148 and name    HN )
        5.37  3.57  0.00 peak   66 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name    HA )
       ( resid  148 and name    HN )
        3.28  1.48  0.00 peak   67 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name    HB )
       ( resid  148 and name    HN )
        6.00  4.20  0.00 peak   72 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name    HN )
       ( resid  151 and name  HG1# )
        5.55  3.75  0.00 peak   73 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  125 and name   HB1 )
       ( resid  126 and name    HN )
        4.39  2.59  0.00 peak   80 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name    HN )
       ( resid  126 and name   HB1 )
        4.06  2.26  0.00 peak   82 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name    HN )
       ( resid  126 and name   HG1 )
        5.14  3.34  0.00 peak   83 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name    HN )
       ( resid  126 and name   HG2 )
        5.14  3.34  0.00 peak   83 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  145 and name    HN )
       ( resid  146 and name    HG )
        6.00  4.20  0.00 peak   86 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  145 and name    HN )
!       ( resid  147 and name    HN )
!        4.83  3.03  0.00 peak   89 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HN )
       ( resid  115 and name    HA )
        5.96  4.16  0.00 peak   96 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  112 and name    HN )
       ( resid  114 and name    HN )
        5.65  3.85  0.00 peak  101 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HN )
       ( resid  116 and name    HN )
        5.85  4.05  0.00 peak  101 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HN )
       ( resid  114 and name    HG )
        3.83  2.03  0.00 peak  107 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HN )
       ( resid  114 and name  HD2# )
        3.96  2.16  0.00 peak  108 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HN )
       ( resid  114 and name  HD1# )
        3.96  2.16  0.00 peak  109 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HN )
       ( resid  133 and name   HE# )
        6.00  4.20  0.00 peak  110 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name    HA )
       ( resid  129 and name    HN )
        4.98  3.18  0.00 peak  112 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  129 and name    HN )
!       ( resid  130 and name   HE# )
!        6.00  4.20  0.00 peak  113 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  128 and name    HN )
       ( resid  129 and name    HN )
        4.15  2.35  0.00 peak  115 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  125 and name   HB2 )
       ( resid  129 and name    HN )
        4.46  2.66  0.00 peak  119 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  129 and name    HN )
       ( resid  131 and name    HN )
        6.00  4.20  0.00 peak  122 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name    HN )
       ( resid  129 and name    HN )
        5.65  3.85  0.00 peak  123 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name    HB )
       ( resid  129 and name    HN )
        6.00  4.20  0.00 peak  125 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HG2# )
       ( resid  129 and name    HN )
        6.00  4.20  0.00 peak  126 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  159 and name    HN )
       ( resid  159 and name  HD1# )
        4.98  3.18  0.00 peak  133 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  159 and name    HN )
       ( resid  159 and name  HD2# )
        4.98  3.18  0.00 peak  134 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name  HD1# )
       ( resid  159 and name    HN )
        6.00  4.20  0.00 peak  139 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name    HB )
       ( resid  159 and name    HN )
        6.00  4.20  0.00 peak  140 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  171 and name    HA )
       ( resid  172 and name    HN )
        3.07  1.27  0.00 peak  144 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  172 and name    HN )
       ( resid  174 and name   HG1 )
        6.00  4.20  0.00 peak  147 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  172 and name    HN )
       ( resid  174 and name   HG2 )
        6.00  4.20  0.00 peak  147 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  172 and name    HN )
       ( resid  172 and name   HB2 )
        4.02  2.22  0.00 peak  149 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HN )
       ( resid  162 and name    HA )
        5.83  4.03  0.00 peak  154 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HN )
       ( resid  162 and name   HB# )
        4.38  2.58  0.00 peak  157 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HN )
       ( resid  111 and name  HD1# )
        4.03  2.23  0.00 peak  158 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HN )
       ( resid  113 and name    HN )
        6.00  4.20  0.00 peak  161 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HN )
       ( resid  111 and name    HB )
        3.37  1.57  0.00 peak  162 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  125 and name    HN )
       ( resid  128 and name    HN )
        6.00  4.20  0.00 peak  170 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  138 and name    HA )
       ( resid  141 and name    HN )
        6.00  4.20  0.00 peak  173 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  125 and name    HN )
!       ( resid  125 and name   HB1 )
!        3.39  1.59  0.00 peak  175 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  124 and name   HB2 )
       ( resid  125 and name    HN )
        3.75  1.95  0.00 peak  176 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  172 and name    HN )
!       ( resid  173 and name    HN )
!        3.54  1.74  0.00 peak  178 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  132 and name    HN )
       ( resid  133 and name    HN )
        3.91  2.11  0.00 peak  186 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name    HN )
       ( resid  133 and name   HD# )
        4.91  3.11  0.00 peak  187 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name    HN )
       ( resid  133 and name   HB1 )
        3.88  2.08  0.00 peak  188 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  130 and name    HA )
       ( resid  133 and name    HN )
        4.44  2.64  0.00 peak  189 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name    HN )
       ( resid  133 and name   HB2 )
        3.88  2.08  0.00 peak  190 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name    HN )
       ( resid  150 and name    HA )
        5.70  3.90  0.00 peak  194 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name    HN )
       ( resid  149 and name    HN )
        4.56  2.76  0.00 peak  196 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name    HA )
       ( resid  149 and name    HN )
        3.11  1.31  0.00 peak  198 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name    HN )
       ( resid  149 and name   HB1 )
        4.14  2.34  0.00 peak  200 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name    HN )
       ( resid  149 and name   HB2 )
        4.14  2.34  0.00 peak  201 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HN )
       ( resid  111 and name  HG2# )
        4.12  2.32  0.00 peak  205 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  102 and name   HB1 )
       ( resid  103 and name    HN )
        5.08  3.28  0.00 peak  206 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  103 and name    HN )
       ( resid  104 and name    HN )
        6.00  4.20  0.00 peak  207 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  102 and name   HB2 )
       ( resid  103 and name    HN )
        5.08  3.28  0.00 peak  209 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name    HN )
       ( resid  141 and name    HN )
        3.76  1.96  0.00 peak  212 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  114 and name    HA )
!       ( resid  125 and name    HN )
!        6.00  4.20  0.00 peak  216 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name  HG2# )
       ( resid  141 and name    HN )
        4.55  2.75  0.00 peak  219 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  141 and name    HN )
       ( resid  142 and name    HN )
        3.55  1.75  0.00 peak  222 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name   HE# )
       ( resid  137 and name    HN )
        6.00  4.20  0.00 peak  226 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name   HD# )
       ( resid  137 and name    HN )
        6.00  4.20  0.00 peak  226 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HN )
       ( resid  137 and name    HB )
        3.77  1.97  0.00 peak  231 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HN )
       ( resid  159 and name  HD2# )
        5.39  3.59  0.00 peak  235 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name    HN )
       ( resid  137 and name    HN )
        6.00  4.20  0.00 peak  236 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  129 and name   HB# )
       ( resid  133 and name    HN )
        6.00  4.20  0.00 peak  237 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  114 and name  HD2# )
!       ( resid  162 and name    HN )
!        6.00  4.20  0.00 peak  250 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  124 and name    HN )
       ( resid  125 and name    HN )
        4.41  2.61  0.00 peak  259 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  123 and name    HN )
       ( resid  124 and name    HN )
        3.39  1.59  0.00 peak  260 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  124 and name    HN )
       ( resid  124 and name   HB2 )
        3.59  1.79  0.00 peak  264 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  121 and name    HA )
       ( resid  124 and name    HN )
        6.00  4.20  0.00 peak  267 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  174 and name    HN )
!       ( resid  175 and name    HN )
!        3.61  1.81  0.00 peak  268 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name    HA )
       ( resid  174 and name    HN )
        3.22  1.42  0.00 peak  269 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name    HN )
       ( resid  111 and name    HN )
        4.31  2.51  0.00 peak  274 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  109 and name   HD# )
       ( resid  110 and name    HN )
        4.68  2.88  0.00 peak  275 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  109 and name    HN )
       ( resid  110 and name    HN )
        4.24  2.44  0.00 peak  278 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  109 and name   HE# )
!       ( resid  110 and name    HN )
!        4.92  3.12  0.00 peak  279 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  165 and name    HN )
       ( resid  167 and name    HN )
        4.71  2.91  0.00 peak  282 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  167 and name    HN )
       ( resid  168 and name    HN )
        3.61  1.81  0.00 peak  283 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  167 and name    HN )
!       ( resid  167 and name   HB1 )
!        2.88  1.08  0.00 peak  288 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  167 and name    HN )
       ( resid  167 and name   HB2 )
        3.66  1.86  0.00 peak  289 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  108 and name    HA )
       ( resid  110 and name    HN )
        4.85  3.05  0.00 peak  292 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  159 and name    HN )
       ( resid  160 and name    HN )
        3.82  2.02  0.00 peak  295 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  159 and name  HD1# )
       ( resid  160 and name    HN )
        6.00  4.20  0.00 peak  297 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  159 and name   HB2 )
!       ( resid  160 and name    HN )
!        3.28  1.48  0.00 peak  302 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  166 and name    HN )
       ( resid  167 and name   HG1 )
        4.66  2.86  0.00 peak  303 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  166 and name    HN )
       ( resid  166 and name  HG2# )
        3.70  1.90  0.00 peak  304 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  166 and name    HN )
       ( resid  166 and name  HG1# )
        3.70  1.90  0.00 peak  305 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name    HN )
       ( resid  153 and name    HA )
        6.00  4.20  0.00 peak  313 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  159 and name  HD2# )
       ( resid  160 and name    HN )
        6.00  4.20  0.00 peak  318 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  145 and name    HN )
!       ( resid  146 and name    HN )
!        3.61  1.81  0.00 peak  324 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name    HN )
       ( resid  147 and name    HB )
        5.29  3.49  0.00 peak  326 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  165 and name    HN )
       ( resid  166 and name    HN )
        3.41  1.61  0.00 peak  334 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name    HN )
       ( resid  125 and name    HN )
        6.00  4.20  0.00 peak  342 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  138 and name    HN )
       ( resid  141 and name    HN )
        6.00  4.20  0.00 peak  342 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HN )
       ( resid  138 and name    HN )
        3.55  1.75  0.00 peak  343 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  138 and name    HN )
       ( resid  139 and name    HN )
        3.87  2.07  0.00 peak  343 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  138 and name    HN )
       ( resid  140 and name    HN )
        5.93  4.13  0.00 peak  344 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  115 and name    HA )
       ( resid  118 and name    HN )
        4.44  2.64  0.00 peak  345 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name  HG2# )
       ( resid  138 and name    HN )
        4.63  2.83  0.00 peak  351 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name   HE# )
       ( resid  138 and name    HN )
        6.00  4.20  0.00 peak  352 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name   HD# )
       ( resid  138 and name    HN )
        6.00  4.20  0.00 peak  352 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HE# )
       ( resid  138 and name    HN )
        6.00  4.20  0.00 peak  353 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HB )
       ( resid  138 and name    HN )
        4.58  2.78  0.00 peak  354 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name    HA )
       ( resid  152 and name    HN )
        4.98  3.18  0.00 peak  356 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name    HN )
       ( resid  152 and name    HB )
        3.70  1.90  0.00 peak  357 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  169 and name    HN )
       ( resid  170 and name    HN )
        3.33  1.53  0.00 peak  362 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  168 and name    HN )
       ( resid  170 and name    HN )
        4.88  3.08  0.00 peak  363 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  167 and name    HA )
       ( resid  170 and name    HN )
        4.29  2.49  0.00 peak  368 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HD1# )
       ( resid  170 and name    HN )
        5.25  3.45  0.00 peak  373 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  138 and name    HN )
       ( resid  140 and name    HB )
        6.00  4.20  0.00 peak  374 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name    HN )
       ( resid  129 and name   HB# )
        4.93  3.13  0.00 peak  378 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name    HN )
       ( resid  118 and name  HG1# )
        3.55  1.75  0.00 peak  380 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name  HG1# )
       ( resid  138 and name    HN )
        4.63  2.83  0.00 peak  382 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name    HN )
       ( resid  107 and name    HB )
        4.07  2.27  0.00 peak  387 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name    HN )
       ( resid  107 and name  HG1# )
        4.85  3.05  0.00 peak  389 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name    HN )
       ( resid  110 and name    HN )
        6.00  4.20  0.00 peak  390 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name    HN )
       ( resid  136 and name    HN )
        6.00  4.20  0.00 peak  396 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name    HN )
       ( resid  134 and name    HN )
        3.85  2.05  0.00 peak  398 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name    HN )
       ( resid  135 and name    HN )
        4.15  2.35  0.00 peak  398 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  132 and name    HN )
       ( resid  134 and name    HN )
        6.00  4.20  0.00 peak  407 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name    HN )
       ( resid  157 and name    HN )
        4.26  2.46  0.00 peak  411 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  154 and name    HA )
       ( resid  157 and name    HN )
        4.49  2.69  0.00 peak  412 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  155 and name    HA )
       ( resid  157 and name    HN )
        4.84  3.04  0.00 peak  412 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name  HD1# )
       ( resid  157 and name    HN )
        4.52  2.72  0.00 peak  414 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  150 and name    HN )
       ( resid  151 and name    HA )
        6.00  4.20  0.00 peak  417 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  130 and name    HA )
       ( resid  134 and name    HN )
        3.89  2.09  0.00 peak  418 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name    HN )
       ( resid  147 and name    HN )
        3.23  1.43  0.00 peak  420 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name    HA )
       ( resid  147 and name    HN )
        3.55  1.75  0.00 peak  421 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name    HN )
       ( resid  147 and name    HB )
        3.74  1.94  0.00 peak  423 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name    HN )
       ( resid  147 and name  HG2# )
        4.21  2.41  0.00 peak  425 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name    HN )
       ( resid  151 and name  HG1# )
        4.92  3.12  0.00 peak  426 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name    HN )
       ( resid  150 and name    HN )
        4.18  2.38  0.00 peak  427 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  150 and name    HN )
       ( resid  152 and name    HN )
        4.98  3.18  0.00 peak  428 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  150 and name    HN )
       ( resid  151 and name    HN )
        3.87  2.07  0.00 peak  429 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name  HG2# )
       ( resid  150 and name    HN )
        6.00  4.20  0.00 peak  442 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  174 and name    HA )
       ( resid  175 and name    HN )
        3.37  1.57  0.00 peak  447 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  147 and name    HN )
!       ( resid  151 and name    HA )
!        6.00  4.20  0.00 peak  451 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  144 and name    HN )
       ( resid  145 and name    HN )
        4.68  2.88  0.00 peak  453 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name  HG2# )
       ( resid  144 and name    HN )
        6.00  4.20  0.00 peak  458 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name    HN )
       ( resid  144 and name    HN )
        5.16  3.36  0.00 peak  460 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  141 and name    HA )
       ( resid  144 and name    HN )
        5.42  3.62  0.00 peak  462 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name    HB )
       ( resid  144 and name    HN )
        5.64  3.84  0.00 peak  464 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  125 and name    HA )
!       ( resid  128 and name    HN )
!        4.64  2.84  0.00 peak  468 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  125 and name   HB2 )
       ( resid  128 and name    HN )
        3.71  1.91  0.00 peak  469 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  121 and name    HN )
       ( resid  122 and name    HN )
        3.90  2.10  0.00 peak  471 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  120 and name    HN )
!       ( resid  121 and name    HN )
!        3.26  1.46  0.00 peak  472 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  121 and name    HN )
       ( resid  122 and name    HA )
        4.48  2.68  0.00 peak  476 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  116 and name   HG2 )
       ( resid  121 and name    HN )
        5.17  3.37  0.00 peak  483 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name    HN )
       ( resid  154 and name    HN )
        3.79  1.99  0.00 peak  486 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  154 and name    HN )
       ( resid  155 and name    HN )
        4.11  2.31  0.00 peak  486 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name    HN )
       ( resid  154 and name    HN )
        4.42  2.62  0.00 peak  487 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  154 and name    HN )
       ( resid  156 and name    HN )
        5.09  3.29  0.00 peak  487 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name    HA )
       ( resid  154 and name    HN )
        4.33  2.53  0.00 peak  488 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name    HN )
       ( resid  154 and name    HN )
        6.00  4.20  0.00 peak  491 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HE# )
       ( resid  163 and name    HN )
        6.00  4.20  0.00 peak  495 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  162 and name    HN )
       ( resid  163 and name    HN )
        3.73  1.93  0.00 peak  497 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  162 and name   HB# )
       ( resid  163 and name    HN )
        4.21  2.41  0.00 peak  502 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HD1# )
       ( resid  163 and name    HN )
        5.65  3.85  0.00 peak  505 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  159 and name    HG )
       ( resid  163 and name    HN )
        6.00  4.20  0.00 peak  505 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  163 and name    HN )
       ( resid  166 and name    HB )
        6.00  4.20  0.00 peak  508 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HD# )
       ( resid  163 and name    HN )
        5.78  3.98  0.00 peak  509 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  161 and name    HA )
       ( resid  163 and name    HN )
        6.00  4.20  0.00 peak  510 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  163 and name    HN )
       ( resid  164 and name    HA )
        6.00  4.20  0.00 peak  510 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  161 and name    HN )
       ( resid  162 and name    HA )
        6.00  4.20  0.00 peak  514 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  122 and name    HN )
       ( resid  124 and name    HN )
        4.71  2.91  0.00 peak  517 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  121 and name    HA )
       ( resid  122 and name    HN )
        3.42  1.62  0.00 peak  519 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  116 and name    HA )
       ( resid  122 and name    HN )
        6.00  4.20  0.00 peak  521 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  154 and name    HN )
       ( resid  157 and name    HN )
        5.82  4.02  0.00 peak  535 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  159 and name    HN )
       ( resid  161 and name    HN )
        6.00  4.20  0.00 peak  540 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HD1# )
       ( resid  161 and name    HN )
        5.89  4.09  0.00 peak  543 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  106 and name    HN )
!       ( resid  109 and name    HN )
!        4.07  2.27  0.00 peak  545 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  109 and name    HN )
       ( resid  109 and name   HD# )
        5.30  3.50  0.00 peak  546 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name    HA )
       ( resid  109 and name    HN )
        3.73  1.93  0.00 peak  550 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name    HB )
       ( resid  109 and name    HN )
        4.79  2.99  0.00 peak  554 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  104 and name    HA )
!       ( resid  109 and name    HN )
!        6.00  4.20  0.00 peak  558 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  130 and name    HN )
       ( resid  133 and name   HD# )
        6.00  4.20  0.00 peak  560 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name    HN )
       ( resid  127 and name    HN )
        3.81  2.01  0.00 peak  564 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name    HN )
       ( resid  128 and name    HN )
        3.96  2.16  0.00 peak  566 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  125 and name    HA )
!       ( resid  127 and name    HN )
!        4.86  3.06  0.00 peak  567 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name   HG1 )
       ( resid  127 and name    HN )
        5.13  3.33  0.00 peak  572 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name   HG2 )
       ( resid  127 and name    HN )
        5.13  3.33  0.00 peak  572 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name    HN )
       ( resid  127 and name  HG2# )
        3.91  2.11  0.00 peak  573 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  115 and name    HN )
       ( resid  116 and name    HN )
        3.39  1.59  0.00 peak  576 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  129 and name    HN )
       ( resid  130 and name    HN )
        3.64  1.84  0.00 peak  583 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name  HG2# )
       ( resid  130 and name    HN )
        5.68  3.88  0.00 peak  592 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  128 and name    HN )
       ( resid  130 and name    HN )
        5.61  3.81  0.00 peak  594 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  155 and name    HN )
       ( resid  158 and name    HN )
        5.64  3.84  0.00 peak  595 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  158 and name    HN )
       ( resid  159 and name    HN )
        3.73  1.93  0.00 peak  596 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  130 and name    HN )
       ( resid  166 and name    HB )
        4.48  2.68  0.00 peak  600 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  158 and name    HN )
       ( resid  159 and name   HB2 )
        4.80  3.00  0.00 peak  601 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HG2# )
       ( resid  130 and name    HN )
        6.00  4.20  0.00 peak  605 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  127 and name  HD1# )
!       ( resid  130 and name    HN )
!        6.00  4.20  0.00 peak  605 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name  HD1# )
       ( resid  158 and name    HN )
        6.00  4.20  0.00 peak  606 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  108 and name    HA )
       ( resid  112 and name    HN )
        4.13  2.33  0.00 peak  610 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HB )
       ( resid  112 and name    HN )
        3.02  1.22  0.00 peak  612 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  141 and name    HN )
       ( resid  143 and name    HN )
        5.54  3.74  0.00 peak  616 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name    HN )
       ( resid  143 and name    HN )
        3.93  2.13  0.00 peak  617 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  143 and name    HN )
       ( resid  144 and name    HN )
        3.37  1.57  0.00 peak  619 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  141 and name    HA )
       ( resid  143 and name    HN )
        4.56  2.76  0.00 peak  621 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name    HB )
       ( resid  143 and name    HN )
        4.21  2.41  0.00 peak  624 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name  HG2# )
       ( resid  143 and name    HN )
        6.00  4.20  0.00 peak  626 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name  HG1# )
       ( resid  143 and name    HN )
        5.19  3.39  0.00 peak  627 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  131 and name    HN )
       ( resid  133 and name    HN )
        6.00  4.20  0.00 peak  629 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  131 and name    HN )
!       ( resid  134 and name   HD# )
!        5.68  3.88  0.00 peak  631 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  130 and name   HE# )
       ( resid  131 and name    HN )
        5.73  3.93  0.00 peak  636 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  129 and name   HB# )
       ( resid  131 and name    HN )
        6.00  4.20  0.00 peak  637 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  130 and name    HN )
       ( resid  131 and name    HN )
        4.01  2.21  0.00 peak  638 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HG2# )
       ( resid  131 and name    HN )
        5.86  4.06  0.00 peak  643 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name    HN )
       ( resid  112 and name    HN )
        5.63  3.83  0.00 peak  647 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  155 and name    HN )
       ( resid  157 and name    HN )
        6.00  4.20  0.00 peak  653 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  155 and name    HN )
       ( resid  156 and name    HN )
        3.65  1.85  0.00 peak  654 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  135 and name    HN )
       ( resid  136 and name    HN )
        4.08  2.28  0.00 peak  660 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name    HN )
       ( resid  119 and name    HN )
        3.54  1.74  0.00 peak  664 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name    HA )
       ( resid  156 and name    HN )
        4.51  2.71  0.00 peak  675 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name    HA )
       ( resid  156 and name    HN )
        5.38  3.58  0.00 peak  677 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  163 and name    HN )
       ( resid  164 and name    HN )
        4.25  2.45  0.00 peak  682 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  164 and name    HN )
       ( resid  168 and name    HN )
        6.00  4.20  0.00 peak  683 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  163 and name   HE# )
       ( resid  164 and name    HN )
        4.38  2.58  0.00 peak  685 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HD1# )
       ( resid  164 and name    HN )
        6.00  4.20  0.00 peak  690 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HN )
       ( resid  112 and name    HN )
        4.10  2.30  0.00 peak  692 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HG2# )
       ( resid  112 and name    HN )
        3.79  1.99  0.00 peak  693 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name    HA )
       ( resid  155 and name    HN )
        4.36  2.56  0.00 peak  696 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  113 and name    HN )
       ( resid  133 and name   HE# )
        5.63  3.83  0.00 peak  702 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name    HN )
       ( resid  152 and name    HN )
        4.13  2.33  0.00 peak  707 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name    HA )
       ( resid  151 and name    HN )
        5.24  3.44  0.00 peak  708 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name    HN )
       ( resid  151 and name  HG2# )
        3.87  2.07  0.00 peak  713 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name    HN )
       ( resid  151 and name  HG1# )
        3.87  2.07  0.00 peak  714 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name    HN )
       ( resid  153 and name    HN )
        5.25  3.45  0.00 peak  716 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  115 and name    HN )
       ( resid  118 and name  HD1# )
        4.40  2.60  0.00 peak  720 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HN )
       ( resid  115 and name    HN )
        4.24  2.44  0.00 peak  721 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  114 and name    HG )
!       ( resid  115 and name    HN )
!        3.33  1.53  0.00 peak  727 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HA )
       ( resid  115 and name    HN )
        5.52  3.72  0.00 peak  729 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  117 and name    HN )
       ( resid  119 and name    HN )
        4.01  2.21  0.00 peak  732 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HG2# )
       ( resid  113 and name    HN )
        6.00  4.20  0.00 peak  733 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  113 and name    HN )
       ( resid  114 and name    HN )
        4.08  2.28  0.00 peak  736 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  112 and name    HN )
       ( resid  113 and name    HN )
        3.37  1.57  0.00 peak  737 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  113 and name    HN )
       ( resid  115 and name    HN )
        5.01  3.21  0.00 peak  747 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  170 and name   HB1 )
       ( resid  171 and name    HN )
        4.13  2.33  0.00 peak  760 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  130 and name    HN )
       ( resid  132 and name    HN )
        4.48  2.68  0.00 peak  764 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  131 and name    HN )
       ( resid  132 and name    HN )
        4.39  2.59  0.00 peak  769 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HD1# )
       ( resid  168 and name    HN )
        6.00  4.20  0.00 peak  775 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name    HN )
       ( resid  153 and name    HN )
        4.08  2.28  0.00 peak  777 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name    HA )
       ( resid  153 and name    HN )
        5.24  3.44  0.00 peak  780 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name    HN )
       ( resid  156 and name    HB )
        6.00  4.20  0.00 peak  787 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  164 and name    HA )
       ( resid  168 and name    HN )
        4.04  2.24  0.00 peak  790 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  168 and name    HN )
!       ( resid  168 and name   HB1 )
!        3.02  1.22  0.00 peak  794 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  167 and name   HB1 )
!       ( resid  168 and name    HN )
!        3.24  1.44  0.00 peak  795 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  167 and name   HB2 )
       ( resid  168 and name    HN )
        4.15  2.35  0.00 peak  796 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  167 and name   HG1 )
       ( resid  168 and name    HN )
        4.52  2.72  0.00 peak  797 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  166 and name    HA )
       ( resid  168 and name    HN )
        6.00  4.20  0.00 peak  798 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  168 and name    HN )
       ( resid  170 and name   HG1 )
        6.00  4.20  0.00 peak  800 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  168 and name    HN )
       ( resid  170 and name   HG2 )
        6.00  4.20  0.00 peak  801 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  116 and name    HN )
       ( resid  120 and name    HN )
        6.00  4.20  0.00 peak  803 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name    HN )
       ( resid  120 and name    HN )
        5.93  4.13  0.00 peak  806 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  120 and name    HN )
       ( resid  121 and name    HA )
        6.00  4.20  0.00 peak  811 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  106 and name    HN )
       ( resid  107 and name    HN )
        6.00  4.20  0.00 peak  840 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  123 and name    HN )
!       ( resid  125 and name    HN )
!        4.56  2.76  0.00 peak  845 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  121 and name    HA )
       ( resid  123 and name    HN )
        4.54  2.74  0.00 peak  847 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  122 and name    HA )
       ( resid  123 and name    HN )
        3.55  1.75  0.00 peak  849 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  122 and name   HB1 )
       ( resid  123 and name    HN )
        4.16  2.36  0.00 peak  852 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  123 and name    HN )
       ( resid  124 and name   HB2 )
        4.22  2.42  0.00 peak  853 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  123 and name    HN )
       ( resid  124 and name    HA )
        5.60  3.80  0.00 peak  854 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name    HA )
       ( resid  106 and name    HN )
        6.00  4.20  0.00 peak  857 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name    HN )
       ( resid  106 and name    HN )
        6.00  4.20  0.00 peak  859 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name    HN )
       ( resid  142 and name    HN )
        5.53  3.73  0.00 peak  875 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name    HN )
       ( resid  140 and name  HG2# )
        3.99  2.19  0.00 peak  877 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  136 and name    HN )
       ( resid  138 and name    HN )
        5.92  4.12  0.00 peak  894 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  136 and name    HN )
       ( resid  137 and name    HN )
        3.70  1.90  0.00 peak  895 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  139 and name    HN )
       ( resid  140 and name    HN )
        3.98  2.18  0.00 peak  895 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  139 and name    HN )
       ( resid  140 and name    HB )
        6.00  4.20  0.00 peak  986 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  139 and name    HN )
       ( resid  141 and name    HN )
        6.00  4.20  0.00 peak  988 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  139 and name    HN )
       ( resid  142 and name    HB )
        5.60  3.80  0.00 peak  994 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name  HG2# )
       ( resid  142 and name    HN )
        6.00  4.20  0.00 peak 1008 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name    HN )
       ( resid  142 and name  HG1# )
        4.09  2.29  0.00 peak 1018 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  168 and name    HN )
       ( resid  169 and name    HN )
        2.93  1.13  0.00 peak 1023 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  168 and name   HB1 )
       ( resid  169 and name    HN )
        3.52  1.72  0.00 peak 1026 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  167 and name   HG1 )
       ( resid  169 and name    HN )
        6.00  4.20  0.00 peak 1027 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name  HD1# )
       ( resid  169 and name    HN )
        6.00  4.20  0.00 peak 1028 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HD1# )
       ( resid  169 and name    HN )
        6.00  4.20  0.00 peak 1028 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  167 and name    HN )
       ( resid  169 and name    HN )
        5.15  3.35  0.00 peak 1029 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  169 and name    HN )
       ( resid  170 and name    HA )
        5.04  3.24  0.00 peak 1032 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  108 and name    HA )
       ( resid  111 and name    HN )
        4.27  2.47  0.00 peak 1037 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  163 and name   HD# )
       ( resid  164 and name    HN )
        4.23  2.43  0.00 peak   37 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  163 and name    HN )
       ( resid  163 and name   HD# )
        4.56  2.76  0.00 peak   45 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name    HZ )
       ( resid  137 and name  HG2# )
        4.31  2.51  0.00 peak   54 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name    HN )
       ( resid  134 and name   HD# )
        4.87  3.07  0.00 peak   59 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HD# )
       ( resid  163 and name    HA )
        4.43  2.63  0.00 peak   61 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name    HA )
       ( resid  134 and name   HD# )
        4.44  2.64  0.00 peak   62 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HD# )
       ( resid  159 and name  HD1# )
        6.00  4.20  0.00 peak   64 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  109 and name   HD# )
       ( resid  110 and name   HE# )
        4.69  2.89  0.00 peak   68 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name    HA )
       ( resid  109 and name   HD# )
        5.06  3.26  0.00 peak   72 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name  HD2# )
       ( resid  109 and name   HD# )
        5.59  3.79  0.00 peak   73 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name    HN )
       ( resid  109 and name   HD# )
        5.00  3.20  0.00 peak   74 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  109 and name   HD# )
       ( resid  110 and name    HZ )
        6.00  4.20  0.00 peak   75 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name   HD# )
       ( resid  134 and name    HN )
        4.36  2.56  0.00 peak   77 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HG )
       ( resid  133 and name   HD# )
        6.00  4.20  0.00 peak   82 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name   HD# )
       ( resid  162 and name   HB# )
        6.00  4.20  0.00 peak   82 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name   HE# )
       ( resid  110 and name   HD# )
        3.15  1.35  0.00 peak   93 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  110 and name   HD# )
!       ( resid  159 and name    HA )
!        3.44  1.64  0.00 peak   95 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  109 and name   HE# )
       ( resid  110 and name   HD# )
        5.15  3.35  0.00 peak   97 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name   HD# )
       ( resid  133 and name   HE# )
        5.32  3.52  0.00 peak   97 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name   HD# )
       ( resid  137 and name    HB )
        6.00  4.20  0.00 peak   98 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name   HD# )
       ( resid  159 and name   HB2 )
        6.00  4.20  0.00 peak   98 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name    HN )
       ( resid  109 and name   HE# )
        5.26  3.46  0.00 peak  168 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  109 and name   HE# )
       ( resid  110 and name   HE# )
        4.70  2.90  0.00 peak  169 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name    HA )
       ( resid  109 and name   HE# )
        4.82  3.02  0.00 peak  173 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  109 and name   HE# )
!       ( resid  110 and name    HZ )
!        4.37  2.57  0.00 peak  174 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name   HE# )
       ( resid  159 and name    HG )
        4.78  2.98  0.00 peak  180 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HG )
       ( resid  133 and name   HE# )
        4.77  2.97  0.00 peak  183 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name   HE# )
       ( resid  134 and name    HN )
        5.84  4.04  0.00 peak  188 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  163 and name    HN )
       ( resid  163 and name   HE# )
        6.00  4.20  0.00 peak  202 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  163 and name   HE# )
       ( resid  163 and name   HD# )
        2.93  1.13  0.00 peak  204 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  163 and name   HE# )
       ( resid  167 and name   HG1 )
        3.95  2.15  0.00 peak  210 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HE# )
       ( resid  160 and name    HN )
        5.40  3.60  0.00 peak  214 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HE# )
       ( resid  134 and name   HD# )
        3.07  1.27  0.00 peak  215 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name    HA )
       ( resid  134 and name   HE# )
        5.41  3.61  0.00 peak  217 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  102 and name   HB# )
       ( resid  103 and name    HN )
        4.45  2.65  0.00 peak  206 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  103 and name    HA )
       ( resid  104 and name   HB# )
        4.47  2.67  0.00 peak  282 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  103 and name   HG# )
       ( resid  104 and name    HN )
        5.84  3.98  0.00 peak  429 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  103 and name   HG# )
       ( resid  104 and name   HD# )
        5.79  3.99  0.00 peak  825 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name    HN )
       ( resid  104 and name   HB# )
        3.57  1.77  0.00 peak   47 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name    HN )
       ( resid  104 and name   HD# )
        4.50  2.70  0.00 peak   51 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name    HA )
       ( resid  104 and name   HD# )
        3.68  1.88  0.00 peak  824 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name   HB# )
       ( resid  104 and name   HD# )
        2.80  1.00  0.00 peak 1185 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name   HD# )
       ( resid  109 and name   HE# )
        4.06  2.26  0.00 peak  822 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name   HD# )
       ( resid  109 and name   HD# )
        4.37  2.57  0.00 peak   73 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  104 and name   HD# )
       ( resid  110 and name   HE# )
        4.15  2.35  0.00 peak  820 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  106 and name    HN )
!       ( resid  109 and name   HB# )
!        3.65  1.85  0.00 peak  861 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name    HN )
       ( resid  107 and name   HG# )
        4.20  2.40  0.00 peak  829 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name   HG# )
       ( resid  110 and name    HN )
        5.69  3.89  0.00 peak 1005 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name   HG# )
       ( resid  161 and name    HN )
        5.92  4.12  0.00 peak 1006 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name   HG# )
       ( resid  161 and name   HG# )
        3.63  1.83  0.00 peak  977 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  107 and name   HG# )
       ( resid  162 and name    HN )
        5.92  4.12  0.00 peak 1006 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  108 and name   HB# )
       ( resid  109 and name    HN )
        4.11  2.31  0.00 peak  555 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  108 and name   HB# )
       ( resid  111 and name    HN )
        5.50  3.70  0.00 peak  163 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  108 and name   HB# )
       ( resid  111 and name  HG2# )
        5.14  3.34  0.00 peak 1113 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name   HB# )
       ( resid  137 and name   HG# )
        5.18  3.38  0.00 peak  860 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name   HB# )
       ( resid  159 and name   HD# )
        4.40  2.60  0.00 peak  993 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name   HB# )
       ( resid  162 and name    HN )
        5.81  4.01  0.00 peak  252 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name   HB# )
       ( resid  162 and name   HB# )
        4.94  3.14  0.00 peak  954 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name   HE# )
       ( resid  137 and name   HG# )
        3.51  1.71  0.00 peak  904 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name   HE# )
       ( resid  159 and name   HD# )
        3.82  2.02  0.00 peak   89 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name   HD# )
       ( resid  137 and name   HG# )
        3.82  2.02  0.00 peak   96 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  110 and name    HZ )
       ( resid  137 and name   HG# )
        3.15  1.35  0.00 peak  888 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HN )
       ( resid  111 and name  HG1# )
        4.15  2.35  0.00 peak  158 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HN )
       ( resid  161 and name   HG# )
        5.81  4.01  0.00 peak  163 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name    HB )
       ( resid  161 and name   HG# )
        5.81  4.01  0.00 peak  410 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HG2# )
       ( resid  112 and name   HG# )
        4.76  2.96  0.00 peak  453 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HG2# )
       ( resid  114 and name   HD# )
        3.52  1.72  0.00 peak 1238 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HG1# )
       ( resid  113 and name    HN )
        5.81  4.01  0.00 peak  985 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HG1# )
       ( resid  161 and name   HG# )
        4.17  2.37  0.00 peak  983 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HG1# )
       ( resid  162 and name    HN )
        3.89  2.09  0.00 peak  980 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HG1# )
       ( resid  162 and name    HA )
        3.48  1.68  0.00 peak  304 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HD1# )
       ( resid  114 and name   HD# )
        4.10  2.30  0.00 peak 1239 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HD1# )
       ( resid  161 and name   HB# )
        4.40  2.60  0.00 peak 1128 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  111 and name  HD1# )
       ( resid  161 and name   HG# )
        4.07  2.27  0.00 peak 1129 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  112 and name    HN )
       ( resid  112 and name   HB# )
        3.32  1.52  0.00 peak  649 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  112 and name    HN )
       ( resid  112 and name   HG# )
        3.70  1.90  0.00 peak  454 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  112 and name    HN )
       ( resid  113 and name   HB# )
        5.03  3.23  0.00 peak  613 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  112 and name    HN )
       ( resid  114 and name   HD# )
        4.62  2.82  0.00 peak  646 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  112 and name    HA )
       ( resid  112 and name   HG# )
        3.35  1.55  0.00 peak  170 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  112 and name   HG# )
       ( resid  113 and name    HN )
        5.81  4.01  0.00 peak  432 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  113 and name    HN )
       ( resid  114 and name   HD# )
        5.38  3.58  0.00 peak  746 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  113 and name   HB# )
       ( resid  115 and name    HN )
        5.81  4.01  0.00 peak  725 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  113 and name   HB# )
       ( resid  133 and name   HE# )
        4.45  2.65  0.00 peak  182 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HN )
       ( resid  114 and name   HB# )
        3.54  1.74  0.00 peak  105 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HN )
       ( resid  114 and name   HD# )
        3.38  1.58  0.00 peak  108 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HN )
       ( resid  133 and name   HB# )
        5.81  4.01  0.00 peak   98 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name    HA )
       ( resid  133 and name   HB# )
        5.69  3.89  0.00 peak  149 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HB# )
       ( resid  118 and name  HG2# )
        3.94  2.14  0.00 peak 1094 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HB# )
       ( resid  118 and name  HD1# )
        4.85  3.05  0.00 peak 1142 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  115 and name    HN )
        3.80  2.00  0.00 peak  730 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  117 and name    HN )
        5.92  4.12  0.00 peak  752 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  129 and name    HN )
        5.92  4.12  0.00 peak  736 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  129 and name   HB# )
        5.92  4.12  0.00 peak  733 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  130 and name    HN )
        5.92  4.12  0.00 peak  603 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  130 and name    HA )
        4.69  2.89  0.00 peak  126 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  133 and name    HN )
        5.92  4.12  0.00 peak  192 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  133 and name   HB# )
        5.07  3.27  0.00 peak 1212 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  133 and name   HE# )
        3.89  2.09  0.00 peak  686 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  133 and name   HD# )
        3.78  1.98  0.00 peak   83 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  134 and name    HN )
        5.87  4.07  0.00 peak  403 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  159 and name   HD# )
        4.52  2.72  0.00 peak  996 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  161 and name   HG# )
        5.73  3.93  0.00 peak 1192 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  114 and name   HD# )
!       ( resid  162 and name    HN )
!        5.22  3.42  0.00 peak  250 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  162 and name    HA )
        3.88  2.08  0.00 peak  300 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  162 and name   HB# )
        2.93  1.13  0.00 peak  959 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  163 and name    HN )
        5.44  3.64  0.00 peak  504 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  163 and name    HA )
        4.16  2.36  0.00 peak  737 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  166 and name    HN )
        5.92  4.12  0.00 peak  740 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  114 and name   HD# )
       ( resid  166 and name    HB )
        3.94  2.14  0.00 peak  538 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  115 and name    HN )
       ( resid  115 and name   HB# )
        3.39  1.59  0.00 peak  727 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  115 and name   HB# )
       ( resid  116 and name    HN )
        3.15  1.35  0.00 peak  652 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  116 and name    HA )
       ( resid  116 and name   HG# )
        3.17  1.37  0.00 peak  164 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  116 and name   HG# )
       ( resid  117 and name    HA )
        4.44  2.64  0.00 peak  498 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  116 and name   HG# )
       ( resid  118 and name    HN )
        5.81  4.01  0.00 peak  505 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  116 and name   HG# )
       ( resid  120 and name    HN )
        4.50  2.70  0.00 peak  809 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  116 and name   HG# )
       ( resid  121 and name    HN )
        4.45  2.65  0.00 peak  483 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  116 and name   HG# )
       ( resid  122 and name    HN )
        4.06  2.26  0.00 peak  523 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  116 and name   HG# )
!       ( resid  122 and name   HB# )
!        2.66  0.86  0.00 peak 1198 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  117 and name    HA )
       ( resid  120 and name   HG# )
        5.81  4.01  0.00 peak  103 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  117 and name   HB# )
       ( resid  118 and name  HG2# )
        4.06  2.26  0.00 peak 1093 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  117 and name   HB# )
       ( resid  119 and name    HN )
        4.75  2.95  0.00 peak  704 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name    HA )
       ( resid  126 and name   HB# )
        4.18  2.38  0.00 peak   51 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name    HA )
       ( resid  126 and name   HG# )
        4.77  2.97  0.00 peak  777 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name  HG2# )
       ( resid  124 and name   HG# )
        5.29  3.49  0.00 peak  452 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name  HG2# )
       ( resid  126 and name   HG# )
        3.37  1.57  0.00 peak 1229 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name  HD1# )
       ( resid  126 and name   HG# )
        4.13  2.33  0.00 peak 1138 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  118 and name  HD1# )
       ( resid  170 and name   HG# )
        4.94  3.14  0.00 peak 1142 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  119 and name    HN )
       ( resid  119 and name   HG# )
        4.65  2.85  0.00 peak  423 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  119 and name    HN )
       ( resid  126 and name   HG# )
        5.81  4.01  0.00 peak  674 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  119 and name    HA )
       ( resid  119 and name   HG# )
        3.55  1.75  0.00 peak  424 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  120 and name    HN )
!       ( resid  120 and name   HG# )
!        3.58  1.78  0.00 peak  805 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  120 and name    HN )
       ( resid  121 and name   HB# )
        5.81  4.01  0.00 peak  398 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  120 and name    HA )
       ( resid  120 and name   HG# )
        3.33  1.53  0.00 peak  243 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  120 and name   HB# )
       ( resid  121 and name    HN )
        3.28  1.48  0.00 peak  482 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  120 and name   HB# )
       ( resid  122 and name    HN )
        4.31  2.51  0.00 peak  525 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  121 and name    HN )
       ( resid  121 and name   HB# )
        3.28  1.48  0.00 peak  480 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  121 and name    HN )
       ( resid  122 and name   HB# )
        4.16  2.36  0.00 peak  481 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  121 and name    HA )
       ( resid  122 and name   HB# )
        5.81  4.01  0.00 peak 1179 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  121 and name   HB# )
       ( resid  124 and name    HN )
        5.81  4.01  0.00 peak  266 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  122 and name    HN )
       ( resid  122 and name   HB# )
        3.34  1.54  0.00 peak  524 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  122 and name    HN )
       ( resid  122 and name   HG# )
        4.88  3.08  0.00 peak  458 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  122 and name    HA )
       ( resid  122 and name   HG# )
        3.32  1.52  0.00 peak  206 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  122 and name   HB# )
       ( resid  123 and name    HN )
        3.59  1.79  0.00 peak  629 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  122 and name   HG# )
       ( resid  123 and name    HN )
        4.37  2.57  0.00 peak  461 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  124 and name    HN )
       ( resid  124 and name   HG# )
        4.41  2.61  0.00 peak  422 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  124 and name    HA )
       ( resid  124 and name   HG# )
        3.57  1.77  0.00 peak  308 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  124 and name   HG# )
       ( resid  129 and name    HN )
        4.36  2.56  0.00 peak  120 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  124 and name   HG# )
       ( resid  129 and name   HB# )
        3.65  1.85  0.00 peak 1068 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  124 and name   HG# )
       ( resid  132 and name    HN )
        5.05  3.25  0.00 peak  767 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  124 and name   HG# )
       ( resid  133 and name    HN )
        4.31  2.51  0.00 peak  191 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  125 and name    HA )
       ( resid  126 and name   HB# )
        5.30  3.50  0.00 peak  316 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name    HN )
       ( resid  126 and name   HB# )
        3.56  1.76  0.00 peak   82 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name    HN )
       ( resid  126 and name   HG# )
        4.42  2.62  0.00 peak   83 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name    HA )
       ( resid  126 and name   HG# )
        3.65  1.85  0.00 peak  117 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  126 and name   HB# )
!       ( resid  127 and name  HG2# )
!        4.26  2.46  0.00 peak 1070 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name   HB# )
       ( resid  127 and name  HG1# )
        5.61  3.81  0.00 peak  510 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name   HB# )
       ( resid  129 and name    HN )
        5.81  4.01  0.00 peak  129 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name   HG# )
       ( resid  127 and name    HN )
        4.41  2.61  0.00 peak  572 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  126 and name   HG# )
       ( resid  129 and name    HN )
        5.81  4.01  0.00 peak  128 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name    HN )
       ( resid  127 and name  HG1# )
        5.81  4.01  0.00 peak  660 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name    HA )
       ( resid  166 and name   HG# )
        5.34  3.54  0.00 peak  727 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name    HA )
       ( resid  167 and name   HD# )
        4.95  3.15  0.00 peak  614 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HG2# )
       ( resid  127 and name  HG1# )
        3.17  1.37  0.00 peak 1083 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HG2# )
       ( resid  167 and name   HD# )
        5.75  3.95  0.00 peak 1072 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HG1# )
       ( resid  171 and name    HN )
        5.81  4.01  0.00 peak  656 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HD1# )
       ( resid  167 and name   HD# )
        2.68  0.88  0.00 peak  616 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HD1# )
       ( resid  170 and name   HB# )
        5.40  3.60  0.00 peak 1160 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  127 and name  HD1# )
       ( resid  170 and name   HG# )
        5.81  4.01  0.00 peak 1160 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  129 and name    HN )
       ( resid  166 and name   HG# )
        4.13  2.33  0.00 peak  752 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  129 and name   HB# )
       ( resid  133 and name   HB# )
        4.28  2.48  0.00 peak 1059 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  130 and name    HN )
       ( resid  133 and name   HB# )
        4.41  2.61  0.00 peak  586 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  130 and name    HN )
       ( resid  167 and name   HD# )
        5.77  3.97  0.00 peak  588 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  130 and name    HA )
       ( resid  133 and name   HB# )
        5.81  4.01  0.00 peak  127 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  130 and name    HA )
       ( resid  166 and name   HG# )
        4.12  2.32  0.00 peak  929 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  131 and name    HN )
       ( resid  133 and name   HB# )
        5.03  3.23  0.00 peak  641 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  132 and name    HN )
       ( resid  133 and name   HB# )
        5.81  4.01  0.00 peak  771 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name    HN )
       ( resid  133 and name   HB# )
        3.30  1.50  0.00 peak  188 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name   HB# )
       ( resid  134 and name    HN )
        4.05  2.25  0.00 peak  397 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name   HB# )
       ( resid  135 and name    HN )
        5.72  3.92  0.00 peak  667 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name   HE# )
       ( resid  137 and name   HG# )
        3.92  2.12  0.00 peak  946 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name   HE# )
       ( resid  159 and name   HD# )
        3.35  1.55  0.00 peak  187 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name   HD# )
       ( resid  137 and name   HG# )
        4.43  2.63  0.00 peak  946 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  133 and name   HD# )
       ( resid  159 and name   HD# )
        4.17  2.37  0.00 peak   84 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name    HN )
       ( resid  138 and name   HG# )
        5.63  3.83  0.00 peak  406 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HB# )
       ( resid  138 and name   HG# )
        5.38  3.58  0.00 peak  761 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HE# )
       ( resid  137 and name   HG# )
        5.11  3.31  0.00 peak  852 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HE# )
       ( resid  138 and name   HG# )
        4.34  2.54  0.00 peak  764 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HE# )
       ( resid  160 and name   HB# )
        5.34  3.54  0.00 peak  219 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HE# )
       ( resid  163 and name   HB# )
        4.23  2.43  0.00 peak  216 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HD# )
       ( resid  138 and name   HG# )
        5.60  3.80  0.00 peak  769 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HD# )
       ( resid  159 and name   HD# )
        5.13  3.33  0.00 peak   64 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  134 and name   HD# )
       ( resid  163 and name   HB# )
        4.17  2.37  0.00 peak   66 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  135 and name    HN )
       ( resid  135 and name   HB# )
        3.14  1.34  0.00 peak  743 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  136 and name    HN )
       ( resid  137 and name   HG# )
        4.85  3.05  0.00 peak  888 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HN )
       ( resid  137 and name   HG# )
        3.40  1.60  0.00 peak  902 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HN )
       ( resid  138 and name   HG# )
        4.65  2.85  0.00 peak  233 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HN )
       ( resid  159 and name   HD# )
        4.49  2.69  0.00 peak  990 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HA )
       ( resid  137 and name   HG# )
        2.77  0.97  0.00 peak   40 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HB )
       ( resid  138 and name   HG# )
        4.93  3.13  0.00 peak  766 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name    HB )
       ( resid  159 and name   HD# )
        4.41  2.61  0.00 peak  995 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name   HG# )
       ( resid  138 and name    HN )
        3.19  1.39  0.00 peak  382 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name   HG# )
       ( resid  138 and name    HA )
        3.47  1.67  0.00 peak   19 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name   HG# )
       ( resid  140 and name    HB )
        5.24  3.44  0.00 peak    6 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name   HG# )
       ( resid  140 and name  HG2# )
        4.87  3.07  0.00 peak  972 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name   HG# )
       ( resid  141 and name    HN )
        3.85  2.05  0.00 peak  220 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name   HG# )
       ( resid  141 and name   HB# )
        3.95  2.15  0.00 peak  893 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name   HG# )
       ( resid  141 and name   HD# )
        2.99  1.19  0.00 peak 1217 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name   HG# )
       ( resid  142 and name    HN )
        5.25  3.45  0.00 peak  857 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name   HG# )
       ( resid  156 and name    HA )
        5.51  3.71  0.00 peak   55 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name   HG# )
       ( resid  159 and name    HN )
        5.52  3.72  0.00 peak  132 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  137 and name   HG# )
       ( resid  159 and name   HD# )
        3.18  1.38  0.00 peak  895 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  138 and name    HN )
       ( resid  138 and name   HG# )
        3.11  1.31  0.00 peak  350 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  138 and name    HN )
       ( resid  139 and name   HB# )
        5.04  3.24  0.00 peak  346 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  138 and name    HN )
       ( resid  141 and name   HD# )
        5.18  3.38  0.00 peak  351 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  138 and name    HA )
       ( resid  141 and name   HD# )
        4.41  2.61  0.00 peak   21 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  138 and name    HA )
       ( resid  142 and name   HG# )
        5.92  4.12  0.00 peak 1019 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  138 and name   HG# )
       ( resid  139 and name    HN )
        5.92  4.12  0.00 peak  768 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  138 and name   HG# )
       ( resid  159 and name   HB2 )
        5.57  3.77  0.00 peak  766 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  138 and name   HG# )
       ( resid  159 and name   HD# )
        3.42  1.62  0.00 peak  767 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  139 and name    HN )
       ( resid  139 and name   HB# )
        3.32  1.52  0.00 peak  992 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  139 and name    HN )
       ( resid  142 and name   HG# )
        5.92  4.12  0.00 peak  985 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  139 and name    HA )
       ( resid  142 and name   HG# )
        5.92  4.12  0.00 peak 1018 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  139 and name   HB# )
       ( resid  140 and name    HN )
        3.30  1.50  0.00 peak  886 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  139 and name   HB# )
       ( resid  140 and name  HG2# )
        5.81  4.01  0.00 peak  966 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  139 and name   HB# )
       ( resid  141 and name    HN )
        5.78  3.98  0.00 peak  215 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  139 and name   HB# )
       ( resid  142 and name    HN )
        5.81  4.01  0.00 peak 1007 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name    HN )
       ( resid  141 and name   HB# )
        5.33  3.53  0.00 peak  881 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name    HN )
       ( resid  141 and name   HD# )
        5.35  3.55  0.00 peak  888 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name    HN )
       ( resid  142 and name   HG# )
        5.56  3.76  0.00 peak  981 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name    HN )
       ( resid  143 and name   HB# )
        5.84  4.04  0.00 peak  633 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  140 and name    HN )
!       ( resid  143 and name   HG# )
!        5.81  4.01  0.00 peak  479 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name    HB )
       ( resid  141 and name   HD# )
        5.92  4.12  0.00 peak    6 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name  HG2# )
       ( resid  141 and name   HB# )
        4.60  2.80  0.00 peak  915 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name  HG2# )
       ( resid  141 and name   HD# )
        5.10  3.30  0.00 peak  972 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name  HG2# )
       ( resid  143 and name   HB# )
        5.81  4.01  0.00 peak  969 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  140 and name  HG2# )
       ( resid  143 and name   HG# )
        5.81  4.01  0.00 peak  968 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  141 and name    HN )
       ( resid  141 and name   HB# )
        3.06  1.26  0.00 peak  218 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  141 and name    HN )
       ( resid  141 and name   HD# )
        3.85  2.05  0.00 peak  221 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  141 and name    HA )
       ( resid  141 and name   HD# )
        3.95  2.15  0.00 peak  906 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  141 and name    HG )
       ( resid  159 and name   HD# )
        5.92  4.12  0.00 peak  694 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  141 and name   HD# )
       ( resid  142 and name    HN )
        4.31  2.51  0.00 peak 1019 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  141 and name   HD# )
       ( resid  152 and name    HA )
        5.92  4.12  0.00 peak  914 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  141 and name   HD# )
       ( resid  155 and name    HN )
        5.10  3.30  0.00 peak  659 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  141 and name   HD# )
       ( resid  155 and name    HA )
        4.81  3.01  0.00 peak  907 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  141 and name   HD# )
       ( resid  156 and name    HN )
        5.92  4.12  0.00 peak  913 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name    HN )
       ( resid  142 and name   HG# )
        3.52  1.72  0.00 peak 1018 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name    HN )
       ( resid  144 and name   HB# )
        5.81  4.01  0.00 peak 1014 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name    HA )
       ( resid  142 and name   HG# )
        3.12  1.32  0.00 peak   69 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name    HA )
       ( resid  152 and name   HG# )
        4.50  2.70  0.00 peak  937 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name    HB )
       ( resid  152 and name   HG# )
        5.92  4.12  0.00 peak  935 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name   HG# )
       ( resid  143 and name    HN )
        3.96  2.16  0.00 peak  627 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name   HG# )
       ( resid  143 and name   HB# )
        5.73  3.93  0.00 peak  631 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name   HG# )
       ( resid  143 and name   HG# )
        5.73  3.93  0.00 peak  476 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name   HG# )
       ( resid  144 and name    HN )
        4.47  2.67  0.00 peak  459 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name   HG# )
       ( resid  144 and name   HB# )
        5.73  3.93  0.00 peak 1019 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  142 and name   HG# )
!       ( resid  145 and name    HN )
!        5.92  4.12  0.00 peak   94 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name   HG# )
       ( resid  152 and name    HN )
        5.92  4.12  0.00 peak 1012 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  142 and name   HG# )
!       ( resid  152 and name    HB )
!        3.22  1.42  0.00 peak  556 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  142 and name   HG# )
       ( resid  156 and name  HG1# )
        5.66  3.86  0.00 peak 1025 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  143 and name    HN )
!       ( resid  143 and name   HG# )
!        3.40  1.60  0.00 peak  623 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  143 and name    HN )
       ( resid  144 and name   HB# )
        5.33  3.53  0.00 peak  622 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  143 and name    HA )
       ( resid  143 and name   HB# )
        2.44  0.64  0.00 peak  271 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  143 and name    HA )
       ( resid  143 and name   HG# )
        3.55  1.75  0.00 peak  277 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  143 and name   HG# )
!       ( resid  144 and name    HN )
!        3.29  1.49  0.00 peak  457 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  144 and name    HN )
       ( resid  144 and name   HB# )
        3.23  1.43  0.00 peak  455 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  144 and name    HN )
!       ( resid  145 and name   HG# )
!        5.81  4.01  0.00 peak  472 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  144 and name   HB# )
       ( resid  146 and name    HN )
        5.87  4.07  0.00 peak  327 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  145 and name    HN )
       ( resid  145 and name   HG# )
        4.73  2.93  0.00 peak  489 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  145 and name    HN )
       ( resid  146 and name   HB# )
        5.81  4.01  0.00 peak   86 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  145 and name    HN )
!       ( resid  151 and name   HG# )
!        5.92  4.12  0.00 peak   94 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  145 and name    HA )
       ( resid  145 and name   HG# )
        3.71  1.91  0.00 peak  491 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  145 and name   HG# )
       ( resid  146 and name    HN )
        4.21  2.41  0.00 peak  471 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  145 and name   HG# )
       ( resid  146 and name    HA )
        4.40  2.60  0.00 peak  491 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  145 and name   HG# )
       ( resid  146 and name   HB# )
        5.61  3.81  0.00 peak  495 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  145 and name   HG# )
       ( resid  146 and name    HG )
        5.81  4.01  0.00 peak  495 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  145 and name   HG# )
       ( resid  147 and name    HN )
        3.73  1.93  0.00 peak  470 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  145 and name   HG# )
       ( resid  148 and name    HN )
        5.81  4.01  0.00 peak  468 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  145 and name   HG# )
       ( resid  151 and name   HG# )
        4.15  2.35  0.00 peak  467 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  145 and name   HG# )
       ( resid  152 and name    HN )
        5.84  4.04  0.00 peak  309 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name    HN )
       ( resid  146 and name   HB# )
        3.08  1.28  0.00 peak  323 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  146 and name    HN )
!       ( resid  151 and name   HG# )
!        4.45  2.65  0.00 peak  329 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name    HA )
       ( resid  146 and name   HD# )
        3.78  1.98  0.00 peak  842 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name   HB# )
       ( resid  146 and name   HD# )
        2.44  0.64  0.00 peak  884 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name   HB# )
       ( resid  147 and name    HA )
        5.81  4.01  0.00 peak   80 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  146 and name   HD# )
       ( resid  148 and name    HN )
        5.47  3.67  0.00 peak  785 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name    HN )
       ( resid  151 and name   HG# )
        3.72  1.92  0.00 peak  426 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name    HA )
       ( resid  148 and name   HB# )
        5.81  4.01  0.00 peak   79 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name    HA )
       ( resid  151 and name   HG# )
        4.87  3.07  0.00 peak   81 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name    HB )
       ( resid  151 and name   HG# )
        4.45  2.65  0.00 peak   12 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name    HB )
       ( resid  152 and name   HG# )
        5.52  3.72  0.00 peak  879 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name  HG2# )
       ( resid  148 and name   HB# )
        3.72  1.92  0.00 peak  868 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  147 and name  HG2# )
       ( resid  151 and name   HG# )
        2.41  0.61  0.00 peak 1219 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name    HN )
       ( resid  148 and name   HB# )
        3.41  1.61  0.00 peak  523 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name    HN )
       ( resid  148 and name   HG# )
        4.08  2.28  0.00 peak   70 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  148 and name    HN )
!       ( resid  148 and name   HE# )
!        5.81  4.01  0.00 peak   60 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name    HN )
       ( resid  151 and name   HG# )
        4.66  2.86  0.00 peak   73 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name    HN )
       ( resid  152 and name   HG# )
        4.73  2.93  0.00 peak   71 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HB# )
       ( resid  149 and name    HN )
        3.64  1.84  0.00 peak  202 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HB# )
       ( resid  150 and name    HN )
        3.96  2.16  0.00 peak  434 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HB# )
       ( resid  150 and name   HB# )
        4.57  2.77  0.00 peak 1042 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HB# )
       ( resid  151 and name   HG# )
        3.02  1.22  0.00 peak  927 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HG# )
       ( resid  148 and name   HE# )
        2.38  0.58  0.00 peak  353 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HG# )
       ( resid  149 and name    HN )
        3.83  2.03  0.00 peak  204 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HG# )
       ( resid  150 and name    HN )
        4.76  2.96  0.00 peak  722 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HG# )
       ( resid  150 and name    HA )
        4.54  2.74  0.00 peak  303 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HG# )
       ( resid  151 and name    HN )
        4.24  2.44  0.00 peak  711 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HG# )
       ( resid  151 and name   HG# )
        3.37  1.57  0.00 peak  928 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HG# )
       ( resid  152 and name    HN )
        4.79  2.99  0.00 peak  315 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HE# )
       ( resid  149 and name    HN )
        5.81  4.01  0.00 peak  199 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HE# )
       ( resid  149 and name    HA )
        5.81  4.01  0.00 peak  253 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HE# )
       ( resid  150 and name    HN )
        4.16  2.36  0.00 peak  432 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  148 and name   HE# )
       ( resid  150 and name   HB# )
        4.62  2.82  0.00 peak 1035 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  148 and name   HE# )
!       ( resid  151 and name   HG# )
!        4.12  2.32  0.00 peak  354 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name    HN )
       ( resid  149 and name   HB# )
        3.53  1.73  0.00 peak  200 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name    HA )
       ( resid  152 and name   HG# )
        5.15  3.35  0.00 peak  869 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name    HA )
       ( resid  153 and name   HB# )
        4.67  2.87  0.00 peak  227 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name   HB# )
       ( resid  150 and name    HN )
        3.56  1.76  0.00 peak  433 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name   HB# )
       ( resid  150 and name   HB# )
        5.09  3.29  0.00 peak 1041 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name   HB# )
       ( resid  151 and name    HN )
        5.81  4.01  0.00 peak  706 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name   HB# )
       ( resid  152 and name   HG# )
        4.89  3.09  0.00 peak  404 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name   HB# )
       ( resid  153 and name    HN )
        5.81  4.01  0.00 peak  776 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  149 and name   HB# )
       ( resid  153 and name   HD# )
        4.19  2.39  0.00 peak  798 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  150 and name    HN )
       ( resid  151 and name   HG# )
        4.91  3.11  0.00 peak  917 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  150 and name    HN )
       ( resid  152 and name   HG# )
        4.38  2.58  0.00 peak  438 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  150 and name   HB# )
       ( resid  151 and name   HG# )
        3.62  1.82  0.00 peak 1224 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name    HN )
       ( resid  151 and name   HG# )
        3.21  1.41  0.00 peak  713 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name    HN )
       ( resid  152 and name   HG# )
        4.77  2.97  0.00 peak  878 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name    HA )
       ( resid  151 and name   HG# )
        2.78  0.98  0.00 peak   52 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name    HA )
       ( resid  154 and name   HB# )
        4.85  3.05  0.00 peak   50 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name    HB )
       ( resid  152 and name   HG# )
        4.56  2.76  0.00 peak  871 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name   HG# )
       ( resid  152 and name    HN )
        3.46  1.66  0.00 peak  316 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name   HG# )
       ( resid  152 and name    HA )
        5.92  4.12  0.00 peak  979 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name   HG# )
       ( resid  154 and name    HN )
        5.92  4.12  0.00 peak  981 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name   HG# )
       ( resid  154 and name   HG# )
        5.06  3.26  0.00 peak  773 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  151 and name   HG# )
       ( resid  154 and name   HE# )
        5.92  4.12  0.00 peak  989 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name    HN )
       ( resid  152 and name   HG# )
        3.63  1.83  0.00 peak  875 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name    HN )
       ( resid  153 and name   HB# )
        5.14  3.34  0.00 peak  315 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  152 and name    HN )
!       ( resid  154 and name   HG# )
!        4.58  2.78  0.00 peak  360 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name    HN )
       ( resid  154 and name   HD# )
        5.60  3.80  0.00 peak  310 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name    HA )
       ( resid  152 and name   HG# )
        3.02  1.22  0.00 peak   18 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  152 and name    HA )
!       ( resid  154 and name   HD# )
!        5.44  3.64  0.00 peak  653 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name   HG# )
       ( resid  153 and name    HN )
        3.44  1.64  0.00 peak  785 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name   HG# )
       ( resid  153 and name    HA )
        3.63  1.83  0.00 peak  215 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name   HG# )
       ( resid  153 and name   HB# )
        3.96  2.16  0.00 peak  898 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name   HG# )
       ( resid  154 and name    HN )
        4.78  2.98  0.00 peak  538 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  152 and name   HG# )
!       ( resid  154 and name   HG# )
!        5.23  3.43  0.00 peak  839 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name   HG# )
       ( resid  154 and name   HD# )
        5.34  3.54  0.00 peak  941 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name   HG# )
       ( resid  155 and name    HN )
        4.81  3.01  0.00 peak  698 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  152 and name   HG# )
       ( resid  156 and name    HB )
        5.92  4.12  0.00 peak  941 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name    HN )
       ( resid  153 and name   HB# )
        3.19  1.39  0.00 peak  784 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name    HN )
       ( resid  153 and name   HD# )
        3.88  2.08  0.00 peak  796 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name    HN )
       ( resid  154 and name   HD# )
        5.39  3.59  0.00 peak  787 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name    HN )
       ( resid  156 and name  HG1# )
        4.64  2.84  0.00 peak  783 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name    HA )
       ( resid  153 and name   HD# )
        3.45  1.65  0.00 peak  804 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name   HB# )
       ( resid  153 and name   HD# )
        2.67  0.87  0.00 peak  807 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  153 and name   HB# )
!       ( resid  156 and name  HD1# )
!        5.30  3.50  0.00 peak 1151 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name   HD# )
       ( resid  154 and name    HN )
        5.27  3.47  0.00 peak  538 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name   HD# )
       ( resid  156 and name    HA )
        5.92  4.12  0.00 peak   55 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name   HD# )
       ( resid  156 and name    HB )
        4.14  2.34  0.00 peak  408 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name   HD# )
       ( resid  156 and name  HG1# )
        3.97  2.17  0.00 peak  606 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name   HD# )
       ( resid  157 and name    HA )
        4.80  3.00  0.00 peak  795 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  153 and name   HD# )
       ( resid  157 and name   HG# )
        3.70  1.90  0.00 peak  465 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  154 and name    HN )
       ( resid  154 and name   HG# )
        3.73  1.93  0.00 peak  490 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  154 and name    HN )
       ( resid  156 and name  HG1# )
        5.81  4.01  0.00 peak  633 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  154 and name    HN )
       ( resid  157 and name   HG# )
        4.90  3.10  0.00 peak  485 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  154 and name    HA )
       ( resid  154 and name   HG# )
        3.63  1.83  0.00 peak  191 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  154 and name    HA )
       ( resid  157 and name   HG# )
        5.81  4.01  0.00 peak  462 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  154 and name   HB# )
       ( resid  154 and name   HE# )
        4.64  2.84  0.00 peak  557 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  154 and name   HG# )
       ( resid  154 and name   HE# )
        2.95  1.15  0.00 peak  357 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  154 and name   HG# )
       ( resid  155 and name    HN )
        5.81  4.01  0.00 peak  779 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  154 and name   HD# )
       ( resid  154 and name   HE# )
        2.05  0.25  0.00 peak  352 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  155 and name    HN )
       ( resid  157 and name   HG# )
        5.31  3.51  0.00 peak  656 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name    HA )
       ( resid  159 and name   HD# )
        5.92  4.12  0.00 peak   48 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name  HG2# )
       ( resid  157 and name   HG# )
        5.81  4.01  0.00 peak 1047 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name  HG2# )
       ( resid  159 and name   HD# )
        4.29  2.49  0.00 peak 1054 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  156 and name  HG1# )
       ( resid  157 and name    HN )
        4.04  2.24  0.00 peak  416 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  159 and name    HN )
       ( resid  159 and name   HD# )
        4.16  2.36  0.00 peak  134 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  159 and name    HA )
       ( resid  159 and name   HD# )
        3.81  2.01  0.00 peak  992 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  159 and name   HB2 )
       ( resid  161 and name   HG# )
        5.81  4.01  0.00 peak  412 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  159 and name   HD# )
       ( resid  160 and name    HN )
        4.82  3.02  0.00 peak  318 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  159 and name   HD# )
       ( resid  162 and name   HB# )
        4.09  2.29  0.00 peak  994 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  160 and name    HN )
       ( resid  161 and name   HB# )
        5.78  3.98  0.00 peak  597 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  160 and name    HN )
       ( resid  161 and name   HG# )
        5.81  4.01  0.00 peak 1195 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  160 and name   HB# )
       ( resid  161 and name   HG# )
        5.61  3.81  0.00 peak 1192 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  160 and name   HB# )
       ( resid  162 and name    HN )
        5.81  4.01  0.00 peak  250 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  160 and name   HB# )
       ( resid  163 and name    HN )
        5.81  4.01  0.00 peak  501 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  160 and name   HB# )
       ( resid  163 and name   HE# )
        5.06  3.26  0.00 peak  208 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  160 and name   HB# )
       ( resid  163 and name   HD# )
        5.18  3.38  0.00 peak   42 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  161 and name    HN )
       ( resid  161 and name   HB# )
        3.41  1.61  0.00 peak  511 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  161 and name    HN )
       ( resid  161 and name   HG# )
        3.49  1.69  0.00 peak  515 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  161 and name    HA )
       ( resid  161 and name   HG# )
        3.56  1.76  0.00 peak  142 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  161 and name   HB# )
       ( resid  162 and name    HN )
        4.03  2.23  0.00 peak  246 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  161 and name   HG# )
       ( resid  162 and name    HN )
        4.10  2.30  0.00 peak  245 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  161 and name   HG# )
       ( resid  165 and name   HB# )
        5.61  3.81  0.00 peak  410 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  162 and name    HN )
       ( resid  163 and name   HB# )
        5.81  4.01  0.00 peak  253 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  162 and name    HN )
       ( resid  165 and name   HB# )
        5.32  3.52  0.00 peak  248 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  162 and name    HA )
       ( resid  165 and name   HB# )
        5.41  3.61  0.00 peak  302 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  163 and name    HN )
       ( resid  164 and name   HB# )
        5.81  4.01  0.00 peak  506 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  163 and name    HN )
       ( resid  165 and name   HB# )
        5.81  4.01  0.00 peak  508 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  163 and name   HB# )
       ( resid  164 and name    HN )
        3.57  1.77  0.00 peak  688 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  163 and name   HE# )
       ( resid  167 and name   HD# )
        4.83  3.03  0.00 peak  209 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  165 and name    HN )
       ( resid  166 and name   HG# )
        5.61  3.81  0.00 peak  373 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  166 and name    HN )
       ( resid  166 and name   HG# )
        3.10  1.30  0.00 peak  305 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  166 and name    HA )
       ( resid  166 and name   HG# )
        2.95  1.15  0.00 peak  933 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  166 and name   HG# )
       ( resid  167 and name    HN )
        3.71  1.91  0.00 peak  290 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  166 and name   HG# )
       ( resid  167 and name    HA )
        4.23  2.43  0.00 peak  754 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  166 and name   HG# )
!       ( resid  167 and name   HD# )
!        3.40  1.60  0.00 peak  756 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  166 and name   HG# )
       ( resid  169 and name    HN )
        5.92  4.12  0.00 peak 1036 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  166 and name   HG# )
       ( resid  170 and name   HG# )
        3.12  1.32  0.00 peak  435 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  167 and name    HN )
       ( resid  170 and name   HB# )
        5.49  3.69  0.00 peak  298 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  167 and name    HN )
       ( resid  170 and name   HG# )
        5.81  4.01  0.00 peak  298 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  167 and name    HA )
       ( resid  167 and name   HD# )
        4.81  3.01  0.00 peak  154 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  167 and name   HB2 )
       ( resid  168 and name   HD# )
        5.81  4.01  0.00 peak  341 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  167 and name   HD# )
       ( resid  170 and name    HN )
        5.81  4.01  0.00 peak  613 volume 0.00 ppm1 0.000 ppm2 0.000

!assign ( resid  167 and name   HD# )
!       ( resid  170 and name   HB# )
!        4.90  3.10  0.00 peak  619 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  168 and name    HN )
       ( resid  168 and name   HG# )
        3.64  1.84  0.00 peak  795 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  168 and name    HN )
       ( resid  168 and name   HD# )
        4.99  3.19  0.00 peak  793 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  168 and name    HN )
       ( resid  169 and name   HA# )
        4.33  2.53  0.00 peak  791 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  168 and name    HN )
       ( resid  170 and name   HB# )
        5.81  4.01  0.00 peak  800 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  168 and name    HA )
       ( resid  168 and name   HG# )
        3.03  1.23  0.00 peak  211 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  168 and name    HA )
       ( resid  168 and name   HD# )
        5.43  3.63  0.00 peak  337 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  168 and name   HB1 )
       ( resid  168 and name   HD# )
        3.39  1.59  0.00 peak  340 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  168 and name   HB1 )
       ( resid  169 and name   HA# )
        4.46  2.66  0.00 peak  581 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  168 and name   HG# )
       ( resid  169 and name    HN )
        4.68  2.88  0.00 peak 1035 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  169 and name    HN )
       ( resid  169 and name   HA# )
        2.58  0.78  0.00 peak 1033 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  169 and name    HN )
       ( resid  170 and name   HB# )
        5.81  4.01  0.00 peak 1034 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  169 and name    HN )
       ( resid  170 and name   HG# )
        4.75  2.95  0.00 peak  427 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  169 and name   HA# )
       ( resid  170 and name    HN )
        3.10  1.30  0.00 peak  367 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  169 and name   HA# )
       ( resid  170 and name    HA )
        5.24  3.44  0.00 peak 1177 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  170 and name    HN )
       ( resid  170 and name   HB# )
        3.05  1.25  0.00 peak  369 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  170 and name    HN )
       ( resid  170 and name   HG# )
        3.81  2.01  0.00 peak  437 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  170 and name    HA )
       ( resid  170 and name   HB# )
        2.60  0.80  0.00 peak  239 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  170 and name    HA )
       ( resid  170 and name   HG# )
        3.08  1.28  0.00 peak  239 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  171 and name    HN )
       ( resid  171 and name   HB# )
        3.06  1.26  0.00 peak  759 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  171 and name    HN )
       ( resid  172 and name   HG# )
        5.81  4.01  0.00 peak  768 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  171 and name    HA )
       ( resid  172 and name   HB# )
        4.87  3.07  0.00 peak  182 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  171 and name   HB# )
       ( resid  172 and name    HN )
        3.89  2.09  0.00 peak  146 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  171 and name   HB# )
       ( resid  173 and name    HN )
        5.61  3.81  0.00 peak  180 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  172 and name    HN )
       ( resid  172 and name   HB# )
        3.48  1.68  0.00 peak  149 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  172 and name    HN )
       ( resid  172 and name   HG# )
        4.16  2.36  0.00 peak  150 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  172 and name    HA )
       ( resid  172 and name   HG# )
        3.61  1.81  0.00 peak  248 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  172 and name    HA )
       ( resid  172 and name   HD# )
        5.81  4.01  0.00 peak  640 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  172 and name   HB# )
       ( resid  173 and name    HN )
        3.90  2.10  0.00 peak  182 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  172 and name   HB# )
       ( resid  173 and name   HD# )
        5.73  3.93  0.00 peak  521 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name    HN )
       ( resid  173 and name   HB# )
        3.00  1.20  0.00 peak  183 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name    HN )
       ( resid  173 and name   HD# )
        4.53  2.73  0.00 peak  858 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name    HN )
       ( resid  174 and name   HG# )
        5.81  4.01  0.00 peak  181 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name    HA )
       ( resid  173 and name   HD# )
        3.48  1.68  0.00 peak  299 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name    HA )
       ( resid  174 and name   HB# )
        5.34  3.54  0.00 peak  582 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name   HB# )
       ( resid  173 and name   HD# )
        2.70  0.90  0.00 peak  376 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name   HB# )
       ( resid  174 and name    HN )
        4.12  2.32  0.00 peak  272 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name   HB# )
       ( resid  174 and name   HG# )
        5.10  3.30  0.00 peak  443 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name   HD# )
       ( resid  174 and name    HN )
        4.67  2.87  0.00 peak  849 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name   HD# )
       ( resid  175 and name    HN )
        5.80  4.00  0.00 peak  856 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  173 and name   HD# )
       ( resid  175 and name   HB# )
        5.73  3.93  0.00 peak  853 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  174 and name    HN )
       ( resid  174 and name   HB# )
        3.19  1.39  0.00 peak  589 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  174 and name    HN )
       ( resid  174 and name   HG# )
        3.71  1.91  0.00 peak  270 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  174 and name    HA )
       ( resid  174 and name   HG# )
        3.53  1.73  0.00 peak  278 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid  174 and name   HB# )
       ( resid  175 and name    HA )
        5.81  4.01  0.00 peak  292 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HA )
       ( resid  153 and name  HD2# )
        5.27  3.47  0.00 peak    2 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HA )
       ( resid  153 and name  HD1# )
        5.27  3.47  0.00 peak    6 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name  HD2# )
       ( resid  149 and name    HA )
        5.27  3.47  0.00 peak   12 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name  HD1# )
       ( resid  149 and name    HA )
        5.27  3.47  0.00 peak   16 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HG# )
       ( resid  156 and name  HD1# )
        5.77  3.97  0.00 peak   19 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HG# )
       ( resid  157 and name    HA )
        4.87  3.07  0.00 peak   17 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HG# )
       ( resid  157 and name   HG# )
        3.67  1.87  0.00 peak   18 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HA )
       ( resid  153 and name   HD# )
        4.19  2.39  0.00 peak    6 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name   HB# )
       ( resid  153 and name   HD# )
        4.12  2.32  0.00 peak    4 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HB )
       ( resid  153 and name   HD# )
        5.27  3.47  0.00 peak    3 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HD# )
       ( resid  149 and name    HA )
        4.19  2.39  0.00 peak   16 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HD# )
       ( resid  149 and name   HB# )
        4.12  2.32  0.00 peak   14 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HD# )
       ( resid  152 and name    HB )
        5.27  3.47  0.00 peak   13 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name  HD1# )
       ( resid  142 and name   HG# )
        5.77  3.97  0.00 peak    9 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   57 and name    HA )
       ( resid  142 and name   HG# )
        4.87  3.07  0.00 peak    7 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   57 and name   HG# )
       ( resid  142 and name   HG# )
        3.67  1.87  0.00 peak    8 volume 0.00 ppm1 0.000 ppm2 0.000



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Contact the webmaster for help, if required. Saturday, September 19, 2020 12:47:14 AM GMT (wattos1)