Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
22934 | 2js1 RC | 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