NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
144011 |
2kmj   |
16431 | cing | 1-original | 4 | XPLOR/CNS | distance | NOE | ambi |
!
!
! Unambiguous distance restraints from run51 finaldata
! removed swap for H5'1 and H5'2 (rename to H5# and remove inter. and unambig.)
! changed segid to A
!
ASSI { 8}
(( segid A and resid 33 and name H5'#))
(( segid A and resid 33 and name H3' ))
4.510 2.540 1.990 peak 8 spectrum 1 weight 0.11000E+01 volume 0.11152E-02 ppm1 3.550 ppm2 4.422 CV 1
ASSI { 12}
(( segid A and resid 31 and name H2' ))
(( segid A and resid 31 and name H3' ))
2.810 0.990 0.990 peak 12 spectrum 1 weight 0.11000E+01 volume 0.26684E-02 ppm1 3.728 ppm2 4.456 CV 1
ASSI { 14}
(( segid A and resid 33 and name H4' ))
(( segid A and resid 33 and name H3' ))
2.920 1.070 1.070 peak 14 spectrum 1 weight 0.11000E+01 volume 0.31888E-02 ppm1 3.730 ppm2 4.421 CV 1
ASSI { 16}
(( segid A and resid 33 and name H4' ))
(( segid A and resid 34 and name H5'#))
3.120 1.210 1.210 peak 16 spectrum 1 weight 0.11000E+01 volume 0.16951E-02 ppm1 3.731 ppm2 4.335 CV 1
OR { 16}
(( segid A and resid 33 and name H4' ))
(( segid A and resid 34 and name H4' ))
ASSI { 17}
(( segid A and resid 33 and name H4' ))
(( segid A and resid 34 and name H1' ))
4.160 2.170 2.170 peak 17 spectrum 1 weight 0.11000E+01 volume 0.49905E-03 ppm1 3.731 ppm2 5.893 CV 1
ASSI { 18}
(( segid A and resid 16 and name H5'#))
(( segid A and resid 16 and name H1' ))
6.270 4.910 0.230 peak 18 spectrum 1 weight 0.11000E+01 volume 0.11980E-03 ppm1 3.801 ppm2 5.654 CV 1
ASSI { 24}
(( segid A and resid 39 and name H3' ))
(( segid A and resid 40 and name H5 ))
3.390 1.430 1.430 peak 24 spectrum 1 weight 0.11000E+01 volume 0.22027E-02 ppm1 3.943 ppm2 5.406 CV 1
OR { 24}
(( segid A and resid 39 and name H3' ))
(( segid A and resid 40 and name H1' ))
ASSI { 29}
(( segid A and resid 32 and name H3' ))
(( segid A and resid 32 and name H1' ))
3.960 1.960 1.960 peak 29 spectrum 1 weight 0.11000E+01 volume 0.95924E-03 ppm1 3.966 ppm2 6.026 CV 1
OR { 29}
(( segid A and resid 32 and name H5'#))
(( segid A and resid 32 and name H1' ))
ASSI { 31}
(( segid A and resid 46 and name H2' ))
(( segid A and resid 46 and name H4' ))
2.880 1.040 1.040 peak 31 spectrum 1 weight 0.11000E+01 volume 0.80151E-02 ppm1 3.973 ppm2 4.076 CV 1
ASSI { 32}
(( segid A and resid 46 and name H2' ))
(( segid A and resid 46 and name H5 ))
3.790 1.790 1.790 peak 32 spectrum 1 weight 0.11000E+01 volume 0.21178E-02 ppm1 3.977 ppm2 5.571 CV 1
ASSI { 34}
(( segid A and resid 46 and name H2' ))
(( segid A and resid 46 and name H6 ))
3.090 1.200 1.200 peak 34 spectrum 1 weight 0.11000E+01 volume 0.39347E-02 ppm1 3.977 ppm2 7.736 CV 1
ASSI { 39}
(( segid A and resid 33 and name H2' ))
(( segid A and resid 33 and name H5 ))
4.680 2.730 1.820 peak 39 spectrum 1 weight 0.11000E+01 volume 0.45453E-03 ppm1 4.039 ppm2 6.055 CV 1
ASSI { 43}
(( segid A and resid 39 and name H5'#))
(( segid A and resid 39 and name H1' ))
5.460 3.720 1.040 peak 43 spectrum 1 weight 0.11000E+01 volume 0.23045E-03 ppm1 4.060 ppm2 5.201 CV 1
ASSI { 44}
(( segid A and resid 43 and name H5'#))
(( segid A and resid 43 and name H1' ))
4.660 2.710 1.840 peak 44 spectrum 1 weight 0.11000E+01 volume 0.89283E-03 ppm1 4.060 ppm2 5.713 CV 1
ASSI { 47}
(( segid A and resid 27 and name H5'#))
(( segid A and resid 27 and name H1' ))
4.650 2.700 1.850 peak 47 spectrum 1 weight 0.11000E+01 volume 0.66071E-03 ppm1 4.114 ppm2 5.967 CV 1
ASSI { 48}
(( segid A and resid 41 and name H2' ))
(( segid A and resid 42 and name H1' ))
3.730 1.740 1.740 peak 48 spectrum 1 weight 0.11000E+01 volume 0.10547E-02 ppm1 4.123 ppm2 5.352 CV 1
ASSI { 50}
(( segid A and resid 41 and name H2' ))
(( segid A and resid 42 and name H5 ))
3.980 1.980 1.980 peak 50 spectrum 1 weight 0.11000E+01 volume 0.13529E-02 ppm1 4.124 ppm2 5.100 CV 1
ASSI { 53}
(( segid A and resid 41 and name H2' ))
(( segid A and resid 22 and name H2 ))
3.210 1.290 2.290 peak 53 spectrum 1 weight 0.11000E+01 volume 0.31712E-03 ppm1 4.125 ppm2 7.062 CV 1
ASSI { 54}
(( segid A and resid 25 and name H5'#))
(( segid A and resid 25 and name H1' ))
4.290 2.300 2.210 peak 54 spectrum 1 weight 0.11000E+01 volume 0.80878E-03 ppm1 4.152 ppm2 5.945 CV 1
ASSI { 55}
(( segid A and resid 36 and name H5'#))
(( segid A and resid 36 and name H8 ))
3.550 1.580 1.580 peak 55 spectrum 1 weight 0.11000E+01 volume 0.22007E-02 ppm1 4.174 ppm2 8.232 CV 1
ASSI { 56}
(( segid A and resid 32 and name H5'#))
(( segid A and resid 32 and name H1' ))
5.220 3.410 1.280 peak 56 spectrum 1 weight 0.11000E+01 volume 0.37572E-03 ppm1 4.175 ppm2 6.023 CV 1
ASSI { 59}
(( segid A and resid 29 and name H3' ))
(( segid A and resid 29 and name H5 ))
5.280 3.480 1.220 peak 59 spectrum 1 weight 0.11000E+01 volume 0.34491E-03 ppm1 4.186 ppm2 5.135 CV 1
ASSI { 60}
(( segid A and resid 29 and name H3' ))
(( segid A and resid 29 and name H1' ))
3.650 1.660 1.660 peak 60 spectrum 1 weight 0.11000E+01 volume 0.18671E-02 ppm1 4.189 ppm2 5.465 CV 1
ASSI { 61}
(( segid A and resid 46 and name H3' ))
(( segid A and resid 46 and name H2' ))
2.200 0.610 0.610 peak 61 spectrum 1 weight 0.11000E+01 volume 0.12626E-01 ppm1 4.192 ppm2 3.976 CV 1
ASSI { 62}
(( segid A and resid 46 and name H3' ))
(( segid A and resid 46 and name H5 ))
3.800 1.810 1.810 peak 62 spectrum 1 weight 0.11000E+01 volume 0.25645E-02 ppm1 4.192 ppm2 5.571 CV 1
ASSI { 65}
(( segid A and resid 36 and name H3' ))
(( segid A and resid 36 and name H8 ))
3.120 1.210 1.210 peak 65 spectrum 1 weight 0.11000E+01 volume 0.21411E-02 ppm1 4.193 ppm2 8.231 CV 1
ASSI { 66}
(( segid A and resid 36 and name H3' ))
(( segid A and resid 37 and name H5 ))
3.940 1.940 1.940 peak 66 spectrum 1 weight 0.11000E+01 volume 0.69221E-03 ppm1 4.196 ppm2 5.157 CV 1
ASSI { 68}
(( segid A and resid 25 and name H5'#))
(( segid A and resid 25 and name H1' ))
4.430 2.450 2.070 peak 68 spectrum 1 weight 0.11000E+01 volume 0.69241E-03 ppm1 4.209 ppm2 5.946 CV 1
ASSI { 69}
(( segid A and resid 25 and name H5'#))
(( segid A and resid 25 and name H6 ))
3.680 1.690 1.690 peak 69 spectrum 1 weight 0.11000E+01 volume 0.12175E-02 ppm1 4.209 ppm2 7.801 CV 1
ASSI { 70}
(( segid A and resid 26 and name H5'#))
(( segid A and resid 26 and name H8 ))
2.600 0.840 0.840 peak 70 spectrum 1 weight 0.11000E+01 volume 0.81437E-02 ppm1 4.211 ppm2 7.685 CV 1
ASSI { 71}
(( segid A and resid 22 and name H2' ))
(( segid A and resid 26 and name H8 ))
2.920 1.070 1.070 peak 71 spectrum 1 weight 0.11000E+01 volume 0.32963E-02 ppm1 4.238 ppm2 7.685 CV 1
ASSI { 72}
(( segid A and resid 22 and name H2' ))
(( segid A and resid 22 and name H8 ))
3.360 1.410 1.410 peak 72 spectrum 1 weight 0.11000E+01 volume 0.25209E-02 ppm1 4.239 ppm2 7.670 CV 1
ASSI { 74}
(( segid A and resid 22 and name H2' ))
(( segid A and resid 22 and name H2 ))
4.490 2.520 2.010 peak 74 spectrum 1 weight 0.11000E+01 volume 0.32670E-03 ppm1 4.243 ppm2 7.061 CV 1
ASSI { 77}
(( segid A and resid 39 and name H5'#))
(( segid A and resid 39 and name H1' ))
5.400 3.640 1.100 peak 77 spectrum 1 weight 0.11000E+01 volume 0.30307E-03 ppm1 4.269 ppm2 5.201 CV 1
ASSI { 79}
(( segid A and resid 40 and name H2' ))
(( segid A and resid 40 and name H1' ))
2.560 0.820 0.820 peak 79 spectrum 1 weight 0.11000E+01 volume 0.62504E-02 ppm1 4.279 ppm2 5.410 CV 1
ASSI { 80}
(( segid A and resid 40 and name H2' ))
(( segid A and resid 41 and name H5 ))
3.700 1.710 1.710 peak 80 spectrum 1 weight 0.11000E+01 volume 0.30315E-02 ppm1 4.280 ppm2 5.600 CV 1
ASSI { 82}
(( segid A and resid 41 and name H4' ))
(( segid A and resid 41 and name H1' ))
3.180 1.270 1.270 peak 82 spectrum 1 weight 0.11000E+01 volume 0.25846E-02 ppm1 4.302 ppm2 5.380 CV 1
ASSI { 85}
(( segid A and resid 40 and name H3' ))
(( segid A and resid 40 and name H1' ))
2.870 1.030 1.030 peak 85 spectrum 1 weight 0.11000E+01 volume 0.73800E-02 ppm1 4.313 ppm2 5.411 CV 1
ASSI { 86}
(( segid A and resid 44 and name H3' ))
(( segid A and resid 44 and name H1' ))
2.950 1.090 1.090 peak 86 spectrum 1 weight 0.11000E+01 volume 0.54299E-02 ppm1 4.320 ppm2 5.606 CV 1
ASSI { 87}
(( segid A and resid 44 and name H3' ))
(( segid A and resid 45 and name H5 ))
3.110 1.210 1.210 peak 87 spectrum 1 weight 0.11000E+01 volume 0.15327E-02 ppm1 4.322 ppm2 5.270 CV 1
ASSI { 88}
(( segid A and resid 36 and name H4' ))
(( segid A and resid 36 and name H8 ))
3.820 1.820 1.820 peak 88 spectrum 1 weight 0.11000E+01 volume 0.16188E-02 ppm1 4.321 ppm2 8.231 CV 1
ASSI { 91}
(( segid A and resid 34 and name H4' ))
(( segid A and resid 34 and name H1' ))
3.000 1.130 1.130 peak 91 spectrum 1 weight 0.11000E+01 volume 0.35081E-02 ppm1 4.335 ppm2 5.894 CV 1
ASSI { 92}
(( segid A and resid 34 and name H5'#))
(( segid A and resid 33 and name H4' ))
2.670 0.890 0.890 peak 92 spectrum 1 weight 0.11000E+01 volume 0.35201E-02 ppm1 4.341 ppm2 3.731 CV 1
ASSI { 93}
(( segid A and resid 42 and name H4' ))
(( segid A and resid 42 and name H1' ))
3.110 1.210 1.210 peak 93 spectrum 1 weight 0.11000E+01 volume 0.25742E-02 ppm1 4.350 ppm2 5.351 CV 1
ASSI { 94}
(( segid A and resid 21 and name H2' ))
(( segid A and resid 21 and name H8 ))
3.720 1.730 1.730 peak 94 spectrum 1 weight 0.11000E+01 volume 0.10464E-02 ppm1 4.357 ppm2 6.929 CV 1
ASSI { 96}
(( segid A and resid 21 and name H2' ))
(( segid A and resid 20 and name H2 ))
4.930 3.040 1.570 peak 96 spectrum 1 weight 0.11000E+01 volume 0.82653E-03 ppm1 4.358 ppm2 6.808 CV 1
ASSI { 98}
(( segid A and resid 44 and name H4' ))
(( segid A and resid 45 and name H5 ))
5.300 3.510 1.200 peak 98 spectrum 1 weight 0.11000E+01 volume 0.77019E-03 ppm1 4.364 ppm2 5.270 CV 1
ASSI { 99}
(( segid A and resid 44 and name H4' ))
(( segid A and resid 44 and name H8 ))
3.710 1.720 1.720 peak 99 spectrum 1 weight 0.11000E+01 volume 0.15010E-02 ppm1 4.365 ppm2 7.142 CV 1
ASSI { 100}
(( segid A and resid 22 and name H4' ))
(( segid A and resid 22 and name H1' ))
2.840 1.010 1.010 peak 100 spectrum 1 weight 0.11000E+01 volume 0.44364E-02 ppm1 4.367 ppm2 5.885 CV 1
ASSI { 103}
(( segid A and resid 29 and name H2' ))
(( segid A and resid 29 and name H1' ))
2.440 0.740 0.740 peak 103 spectrum 1 weight 0.11000E+01 volume 0.66109E-02 ppm1 4.374 ppm2 5.466 CV 1
ASSI { 104}
(( segid A and resid 36 and name H2' ))
(( segid A and resid 37 and name H5 ))
3.920 1.920 1.920 peak 104 spectrum 1 weight 0.11000E+01 volume 0.17918E-02 ppm1 4.380 ppm2 5.158 CV 1
OR { 104}
(( segid A and resid 36 and name H1' ))
(( segid A and resid 37 and name H5 ))
ASSI { 105}
(( segid A and resid 36 and name H1' ))
(( segid A and resid 36 and name H8 ))
3.250 1.320 1.320 peak 105 spectrum 1 weight 0.11000E+01 volume 0.27883E-02 ppm1 4.387 ppm2 8.232 CV 1
OR { 105}
(( segid A and resid 36 and name H2' ))
(( segid A and resid 36 and name H8 ))
ASSI { 106}
(( segid A and resid 21 and name H5'#))
(( segid A and resid 21 and name H8 ))
4.480 2.510 2.020 peak 106 spectrum 1 weight 0.11000E+01 volume 0.66726E-03 ppm1 4.390 ppm2 6.929 CV 1
ASSI { 109}
(( segid A and resid 36 and name H5'#))
(( segid A and resid 36 and name H8 ))
3.030 1.150 1.150 peak 109 spectrum 1 weight 0.11000E+01 volume 0.25651E-02 ppm1 4.404 ppm2 8.231 CV 1
ASSI { 110}
(( segid A and resid 25 and name H2' ))
(( segid A and resid 25 and name H5 ))
3.850 1.850 1.850 peak 110 spectrum 1 weight 0.11000E+01 volume 0.33050E-02 ppm1 4.405 ppm2 5.892 CV 1
ASSI { 111}
(( segid A and resid 25 and name H2' ))
(( segid A and resid 25 and name H1' ))
2.870 1.030 1.030 peak 111 spectrum 1 weight 0.11000E+01 volume 0.44568E-02 ppm1 4.406 ppm2 5.948 CV 1
ASSI { 114}
(( segid A and resid 32 and name H4' ))
(( segid A and resid 33 and name H5 ))
4.990 3.110 1.510 peak 114 spectrum 1 weight 0.11000E+01 volume 0.11110E-02 ppm1 4.411 ppm2 6.053 CV 1
ASSI { 116}
(( segid A and resid 23 and name H2' ))
(( segid A and resid 23 and name H5 ))
3.660 1.670 1.670 peak 116 spectrum 1 weight 0.11000E+01 volume 0.51718E-02 ppm1 4.413 ppm2 5.457 CV 1
OR { 116}
(( segid A and resid 23 and name H4' ))
(( segid A and resid 23 and name H5 ))
ASSI { 119}
(( segid A and resid 43 and name H4' ))
(( segid A and resid 44 and name H8 ))
4.970 3.090 1.530 peak 119 spectrum 1 weight 0.11000E+01 volume 0.74934E-03 ppm1 4.418 ppm2 7.142 CV 1
ASSI { 120}
(( segid A and resid 45 and name H3' ))
(( segid A and resid 45 and name H5 ))
4.240 2.250 2.250 peak 120 spectrum 1 weight 0.11000E+01 volume 0.11042E-02 ppm1 4.421 ppm2 5.270 CV 1
ASSI { 121}
(( segid A and resid 39 and name H2' ))
(( segid A and resid 39 and name H1' ))
2.890 1.050 1.050 peak 121 spectrum 1 weight 0.11000E+01 volume 0.28060E-02 ppm1 4.422 ppm2 5.202 CV 1
ASSI { 122}
(( segid A and resid 45 and name H3' ))
(( segid A and resid 45 and name H6 ))
2.480 0.770 0.770 peak 122 spectrum 1 weight 0.11000E+01 volume 0.57973E-02 ppm1 4.422 ppm2 7.712 CV 1
ASSI { 124}
(( segid A and resid 39 and name H2' ))
(( segid A and resid 40 and name H6 ))
2.540 0.810 0.810 peak 124 spectrum 1 weight 0.11000E+01 volume 0.35946E-02 ppm1 4.425 ppm2 7.946 CV 1
ASSI { 125}
(( segid A and resid 20 and name H4' ))
(( segid A and resid 21 and name H8 ))
6.500 6.500 0.000 peak 125 spectrum 1 weight 0.11000E+01 volume 0.74245E-04 ppm1 4.434 ppm2 6.927 CV 1
ASSI { 126}
(( segid A and resid 20 and name H4' ))
(( segid A and resid 20 and name H1' ))
2.900 1.050 1.050 peak 126 spectrum 1 weight 0.11000E+01 volume 0.40043E-02 ppm1 4.435 ppm2 5.846 CV 1
ASSI { 129}
(( segid A and resid 29 and name H5'#))
(( segid A and resid 29 and name H6 ))
3.350 1.410 1.410 peak 129 spectrum 1 weight 0.11000E+01 volume 0.22783E-02 ppm1 4.444 ppm2 7.390 CV 1
ASSI { 130}
(( segid A and resid 16 and name H3' ))
(( segid A and resid 16 and name H1' ))
3.670 1.680 1.680 peak 130 spectrum 1 weight 0.11000E+01 volume 0.20378E-02 ppm1 4.440 ppm2 5.655 CV 1
ASSI { 135}
(( segid A and resid 44 and name H2' ))
(( segid A and resid 45 and name H5 ))
4.140 2.150 2.150 peak 135 spectrum 1 weight 0.11000E+01 volume 0.17754E-02 ppm1 4.466 ppm2 5.271 CV 1
ASSI { 138}
(( segid A and resid 42 and name H2' ))
(( segid A and resid 43 and name H8 ))
2.170 0.590 0.590 peak 138 spectrum 1 weight 0.11000E+01 volume 0.46070E-02 ppm1 4.468 ppm2 7.651 CV 1
ASSI { 141}
(( segid A and resid 39 and name H4' ))
(( segid A and resid 39 and name H1' ))
3.560 1.580 1.580 peak 141 spectrum 1 weight 0.11000E+01 volume 0.11734E-02 ppm1 4.472 ppm2 5.201 CV 1
ASSI { 143}
(( segid A and resid 28 and name H2' ))
(( segid A and resid 29 and name H5 ))
3.380 1.430 1.430 peak 143 spectrum 1 weight 0.11000E+01 volume 0.14047E-02 ppm1 4.487 ppm2 5.132 CV 1
ASSI { 151}
(( segid A and resid 42 and name H3' ))
(( segid A and resid 42 and name H1' ))
3.180 1.260 1.260 peak 151 spectrum 1 weight 0.11000E+01 volume 0.39161E-02 ppm1 4.506 ppm2 5.351 CV 1
ASSI { 152}
(( segid A and resid 42 and name H3' ))
(( segid A and resid 42 and name H5 ))
4.930 3.040 1.570 peak 152 spectrum 1 weight 0.11000E+01 volume 0.35191E-03 ppm1 4.510 ppm2 5.098 CV 1
ASSI { 154}
(( segid A and resid 22 and name H3' ))
(( segid A and resid 22 and name H8 ))
2.680 0.900 0.900 peak 154 spectrum 1 weight 0.11000E+01 volume 0.55784E-02 ppm1 4.536 ppm2 7.670 CV 1
ASSI { 156}
(( segid A and resid 43 and name H2' ))
(( segid A and resid 44 and name H1' ))
3.150 1.240 1.240 peak 156 spectrum 1 weight 0.11000E+01 volume 0.21290E-02 ppm1 4.539 ppm2 5.605 CV 1
ASSI { 158}
(( segid A and resid 43 and name H2' ))
(( segid A and resid 20 and name H2 ))
3.160 1.250 2.250 peak 158 spectrum 1 weight 0.11000E+01 volume 0.34839E-03 ppm1 4.539 ppm2 6.808 CV 1
ASSI { 159}
(( segid A and resid 43 and name H2' ))
(( segid A and resid 44 and name H8 ))
2.840 1.010 1.010 peak 159 spectrum 1 weight 0.11000E+01 volume 0.33165E-02 ppm1 4.540 ppm2 7.142 CV 1
ASSI { 160}
(( segid A and resid 43 and name H3' ))
(( segid A and resid 44 and name H8 ))
3.300 1.360 1.360 peak 160 spectrum 1 weight 0.11000E+01 volume 0.23294E-02 ppm1 4.567 ppm2 7.142 CV 1
ASSI { 161}
(( segid A and resid 43 and name H3' ))
(( segid A and resid 43 and name H1' ))
3.270 1.340 1.340 peak 161 spectrum 1 weight 0.11000E+01 volume 0.37941E-02 ppm1 4.568 ppm2 5.714 CV 1
ASSI { 162}
(( segid A and resid 25 and name H3' ))
(( segid A and resid 25 and name H1' ))
3.720 1.730 1.730 peak 162 spectrum 1 weight 0.11000E+01 volume 0.17164E-02 ppm1 4.578 ppm2 5.946 CV 1
ASSI { 163}
(( segid A and resid 25 and name H3' ))
(( segid A and resid 25 and name H6 ))
3.680 1.690 1.690 peak 163 spectrum 1 weight 0.11000E+01 volume 0.23419E-02 ppm1 4.578 ppm2 7.803 CV 1
ASSI { 164}
(( segid A and resid 32 and name H2' ))
(( segid A and resid 31 and name H2' ))
3.660 1.670 1.670 peak 164 spectrum 1 weight 0.11000E+01 volume 0.52690E-03 ppm1 4.589 ppm2 3.727 CV 1
ASSI { 165}
(( segid A and resid 17 and name H2' ))
(( segid A and resid 18 and name H5 ))
3.750 1.760 1.760 peak 165 spectrum 1 weight 0.11000E+01 volume 0.23493E-02 ppm1 4.589 ppm2 5.390 CV 1
ASSI { 167}
(( segid A and resid 32 and name H2' ))
(( segid A and resid 33 and name H5 ))
4.710 2.780 1.790 peak 167 spectrum 1 weight 0.11000E+01 volume 0.48541E-03 ppm1 4.589 ppm2 6.051 CV 1
ASSI { 169}
(( segid A and resid 17 and name H2' ))
(( segid A and resid 18 and name H1' ))
3.200 1.280 1.280 peak 169 spectrum 1 weight 0.11000E+01 volume 0.22869E-02 ppm1 4.590 ppm2 5.439 CV 1
ASSI { 171}
(( segid A and resid 32 and name H2' ))
(( segid A and resid 32 and name H3' ))
2.660 0.890 0.890 peak 171 spectrum 1 weight 0.11000E+01 volume 0.28467E-02 ppm1 4.591 ppm2 3.965 CV 1
OR { 171}
(( segid A and resid 32 and name H2' ))
(( segid A and resid 32 and name H5'#))
ASSI { 173}
(( segid A and resid 20 and name H2' ))
(( segid A and resid 20 and name H8 ))
3.370 1.420 1.420 peak 173 spectrum 1 weight 0.11000E+01 volume 0.19553E-02 ppm1 4.603 ppm2 7.856 CV 1
ASSI { 174}
(( segid A and resid 20 and name H2' ))
(( segid A and resid 21 and name H1' ))
3.090 1.190 1.190 peak 174 spectrum 1 weight 0.11000E+01 volume 0.19466E-02 ppm1 4.605 ppm2 5.422 CV 1
ASSI { 176}
(( segid A and resid 20 and name H2' ))
(( segid A and resid 20 and name H2 ))
4.550 2.590 1.950 peak 176 spectrum 1 weight 0.11000E+01 volume 0.40960E-03 ppm1 4.608 ppm2 6.808 CV 1
ASSI { 178}
(( segid A and resid 16 and name H2' ))
(( segid A and resid 16 and name H8 ))
3.680 1.690 1.690 peak 178 spectrum 1 weight 0.11000E+01 volume 0.15384E-02 ppm1 4.618 ppm2 7.970 CV 1
ASSI { 179}
(( segid A and resid 16 and name H2' ))
(( segid A and resid 16 and name H1' ))
3.050 1.160 1.160 peak 179 spectrum 1 weight 0.11000E+01 volume 0.24561E-02 ppm1 4.620 ppm2 5.655 CV 1
ASSI { 181}
(( segid A and resid 27 and name H2' ))
(( segid A and resid 27 and name H2 ))
4.150 2.150 2.150 peak 181 spectrum 1 weight 0.11000E+01 volume 0.52469E-03 ppm1 4.651 ppm2 7.389 CV 1
ASSI { 184}
(( segid A and resid 26 and name H4' ))
(( segid A and resid 26 and name H1' ))
2.910 1.060 1.060 peak 184 spectrum 1 weight 0.11000E+01 volume 0.45419E-02 ppm1 4.655 ppm2 5.825 CV 1
ASSI { 185}
(( segid A and resid 26 and name H4' ))
(( segid A and resid 26 and name H8 ))
3.700 1.710 1.710 peak 185 spectrum 1 weight 0.11000E+01 volume 0.25086E-02 ppm1 4.655 ppm2 7.687 CV 1
ASSI { 186}
(( segid A and resid 26 and name H4' ))
(( segid A and resid 26 and name H2' ))
4.080 2.090 2.090 peak 186 spectrum 1 weight 0.11000E+01 volume 0.97189E-03 ppm1 4.657 ppm2 4.903 CV 1
ASSI { 187}
(( segid A and resid 26 and name H4' ))
(( segid A and resid 26 and name H3' ))
3.510 1.540 1.540 peak 187 spectrum 1 weight 0.11000E+01 volume 0.12148E-02 ppm1 4.657 ppm2 4.924 CV 1
ASSI { 189}
(( segid A and resid 26 and name H4' ))
(( segid A and resid 23 and name H1' ))
4.390 2.410 2.110 peak 189 spectrum 1 weight 0.11000E+01 volume 0.11284E-02 ppm1 4.658 ppm2 5.782 CV 1
ASSI { 190}
(( segid A and resid 23 and name H3' ))
(( segid A and resid 26 and name H8 ))
4.330 2.350 2.170 peak 190 spectrum 1 weight 0.11000E+01 volume 0.65451E-03 ppm1 4.716 ppm2 7.686 CV 1
ASSI { 191}
(( segid A and resid 23 and name H3' ))
(( segid A and resid 23 and name H6 ))
3.850 1.860 1.860 peak 191 spectrum 1 weight 0.11000E+01 volume 0.23999E-02 ppm1 4.717 ppm2 7.621 CV 1
ASSI { 192}
(( segid A and resid 23 and name H3' ))
(( segid A and resid 23 and name H1' ))
3.920 1.920 1.920 peak 192 spectrum 1 weight 0.11000E+01 volume 0.13544E-02 ppm1 4.719 ppm2 5.784 CV 1
! ASSI { 193}
! (( segid A and resid 23 and name H3' ))
! (( segid A and resid 23 and name H5 ))
! 2.940 1.080 1.080 peak 193 spectrum 1 weight 0.11000E+01 volume 0.53186E-03 ppm1 4.720 ppm2 5.459 CV 1
ASSI { 194}
(( segid A and resid 38 and name H2' ))
(( segid A and resid 27 and name H2 ))
4.660 2.720 1.840 peak 194 spectrum 1 weight 0.11000E+01 volume 0.40574E-03 ppm1 4.730 ppm2 7.390 CV 1
ASSI { 195}
(( segid A and resid 38 and name H2' ))
(( segid A and resid 38 and name H5 ))
4.950 3.060 1.550 peak 195 spectrum 1 weight 0.11000E+01 volume 0.33821E-03 ppm1 4.731 ppm2 5.401 CV 1
ASSI { 196}
(( segid A and resid 38 and name H2' ))
(( segid A and resid 38 and name H6 ))
3.840 1.840 1.840 peak 196 spectrum 1 weight 0.11000E+01 volume 0.63486E-03 ppm1 4.731 ppm2 7.859 CV 1
ASSI { 197}
(( segid A and resid 38 and name H2' ))
(( segid A and resid 38 and name H1' ))
2.480 0.770 0.770 peak 197 spectrum 1 weight 0.11000E+01 volume 0.73711E-02 ppm1 4.732 ppm2 5.620 CV 1
ASSI { 198}
(( segid A and resid 38 and name H2' ))
(( segid A and resid 39 and name H6 ))
3.060 1.170 1.170 peak 198 spectrum 1 weight 0.11000E+01 volume 0.13599E-02 ppm1 4.732 ppm2 7.415 CV 1
ASSI { 199}
(( segid A and resid 38 and name H2' ))
(( segid A and resid 39 and name H1' ))
3.740 1.750 1.750 peak 199 spectrum 1 weight 0.11000E+01 volume 0.67949E-03 ppm1 4.733 ppm2 5.203 CV 1
ASSI { 200}
(( segid A and resid 34 and name H2' ))
(( segid A and resid 34 and name H3' ))
2.900 1.050 1.050 peak 200 spectrum 1 weight 0.11000E+01 volume 0.17903E-02 ppm1 4.740 ppm2 5.553 CV 1
ASSI { 201}
(( segid A and resid 38 and name H2' ))
(( segid A and resid 39 and name H5 ))
4.160 2.160 2.160 peak 201 spectrum 1 weight 0.11000E+01 volume 0.18036E-02 ppm1 4.734 ppm2 5.538 CV 1
ASSI { 202}
(( segid A and resid 34 and name H2' ))
(( segid A and resid 34 and name H1' ))
2.560 0.820 0.820 peak 202 spectrum 1 weight 0.11000E+01 volume 0.55940E-02 ppm1 4.739 ppm2 5.895 CV 1
ASSI { 203}
(( segid A and resid 34 and name H2' ))
(( segid A and resid 34 and name H8 ))
3.510 1.540 1.540 peak 203 spectrum 1 weight 0.11000E+01 volume 0.18746E-02 ppm1 4.739 ppm2 7.801 CV 1
ASSI { 204}
(( segid A and resid 34 and name H2' ))
(( segid A and resid 36 and name H8 ))
4.300 2.310 2.200 peak 204 spectrum 1 weight 0.11000E+01 volume 0.47497E-03 ppm1 4.739 ppm2 8.231 CV 1
ASSI { 205}
(( segid A and resid 26 and name H2' ))
(( segid A and resid 27 and name H1' ))
3.830 1.830 1.830 peak 205 spectrum 1 weight 0.11000E+01 volume 0.84497E-03 ppm1 4.899 ppm2 5.967 CV 1
ASSI { 206}
(( segid A and resid 26 and name H2' ))
(( segid A and resid 27 and name H8 ))
2.560 0.820 0.820 peak 206 spectrum 1 weight 0.11000E+01 volume 0.70616E-02 ppm1 4.899 ppm2 7.711 CV 1
ASSI { 208}
(( segid A and resid 26 and name H2' ))
(( segid A and resid 27 and name H5'#))
4.200 2.210 2.210 peak 208 spectrum 1 weight 0.11000E+01 volume 0.60013E-03 ppm1 4.901 ppm2 4.116 CV 1
ASSI { 209}
(( segid A and resid 26 and name H3' ))
(( segid A and resid 23 and name H1' ))
3.570 1.600 1.600 peak 209 spectrum 1 weight 0.11000E+01 volume 0.14562E-02 ppm1 4.910 ppm2 5.781 CV 1
OR { 209}
(( segid A and resid 26 and name H2' ))
(( segid A and resid 23 and name H1' ))
ASSI { 210}
(( segid A and resid 42 and name H5 ))
(( segid A and resid 41 and name H1' ))
2.910 1.060 3.060 peak 210 spectrum 1 weight 0.11000E+01 volume 0.56332E-03 ppm1 5.095 ppm2 5.379 CV 1
ASSI { 212}
(( segid A and resid 42 and name H5 ))
(( segid A and resid 41 and name H5 ))
4.180 2.190 2.190 peak 212 spectrum 1 weight 0.11000E+01 volume 0.48255E-03 ppm1 5.096 ppm2 5.598 CV 1
ASSI { 214}
(( segid A and resid 42 and name H5 ))
(( segid A and resid 42 and name H1' ))
4.450 2.470 2.050 peak 214 spectrum 1 weight 0.11000E+01 volume 0.79621E-03 ppm1 5.097 ppm2 5.351 CV 1
ASSI { 215}
(( segid A and resid 29 and name H5 ))
(( segid A and resid 29 and name H1' ))
4.560 2.600 1.940 peak 215 spectrum 1 weight 0.11000E+01 volume 0.60967E-03 ppm1 5.129 ppm2 5.465 CV 1
ASSI { 217}
(( segid A and resid 29 and name H5 ))
(( segid A and resid 28 and name H3' ))
4.090 2.100 2.100 peak 217 spectrum 1 weight 0.11000E+01 volume 0.65354E-03 ppm1 5.130 ppm2 4.440 CV 1
ASSI { 218}
(( segid A and resid 29 and name H5 ))
(( segid A and resid 28 and name H1' ))
3.130 1.220 2.220 peak 218 spectrum 1 weight 0.11000E+01 volume 0.36707E-03 ppm1 5.130 ppm2 5.814 CV 1
ASSI { 221}
(( segid A and resid 37 and name H5 ))
(( segid A and resid 36 and name H2' ))
3.670 1.680 1.680 peak 221 spectrum 1 weight 0.11000E+01 volume 0.25387E-02 ppm1 5.155 ppm2 4.379 CV 1
ASSI { 222}
(( segid A and resid 37 and name H5 ))
(( segid A and resid 37 and name H1' ))
4.450 2.480 2.050 peak 222 spectrum 1 weight 0.11000E+01 volume 0.79752E-03 ppm1 5.155 ppm2 5.492 CV 1
ASSI { 224}
(( segid A and resid 37 and name H5 ))
(( segid A and resid 36 and name H8 ))
5.010 3.130 1.490 peak 224 spectrum 1 weight 0.11000E+01 volume 0.17088E-03 ppm1 5.155 ppm2 8.229 CV 1
ASSI { 225}
(( segid A and resid 37 and name H5 ))
(( segid A and resid 38 and name H5 ))
3.870 1.870 1.870 peak 225 spectrum 1 weight 0.11000E+01 volume 0.81182E-03 ppm1 5.156 ppm2 5.399 CV 1
ASSI { 226}
(( segid A and resid 39 and name H1' ))
(( segid A and resid 39 and name H5 ))
5.270 3.470 1.230 peak 226 spectrum 1 weight 0.11000E+01 volume 0.31697E-03 ppm1 5.198 ppm2 5.536 CV 1
ASSI { 228}
(( segid A and resid 39 and name H1' ))
(( segid A and resid 40 and name H5 ))
4.340 2.350 2.160 peak 228 spectrum 1 weight 0.11000E+01 volume 0.10357E-02 ppm1 5.200 ppm2 5.407 CV 1
OR { 228}
(( segid A and resid 39 and name H1' ))
(( segid A and resid 40 and name H1' ))
ASSI { 229}
(( segid A and resid 39 and name H1' ))
(( segid A and resid 38 and name H1' ))
4.560 2.590 1.940 peak 229 spectrum 1 weight 0.11000E+01 volume 0.42462E-03 ppm1 5.200 ppm2 5.619 CV 1
ASSI { 231}
(( segid A and resid 39 and name H1' ))
(( segid A and resid 39 and name H6 ))
3.710 1.720 1.720 peak 231 spectrum 1 weight 0.11000E+01 volume 0.78387E-03 ppm1 5.200 ppm2 7.413 CV 1
ASSI { 232}
(( segid A and resid 45 and name H5 ))
(( segid A and resid 45 and name H2' ))
4.480 2.510 2.020 peak 232 spectrum 1 weight 0.11000E+01 volume 0.64434E-03 ppm1 5.269 ppm2 4.008 CV 1
ASSI { 233}
(( segid A and resid 45 and name H5 ))
(( segid A and resid 44 and name H1' ))
2.680 0.900 3.400 peak 233 spectrum 1 weight 0.11000E+01 volume 0.92926E-03 ppm1 5.269 ppm2 5.605 CV 1
ASSI { 236}
(( segid A and resid 45 and name H5 ))
(( segid A and resid 46 and name H5 ))
4.060 2.060 2.060 peak 236 spectrum 1 weight 0.11000E+01 volume 0.59837E-03 ppm1 5.271 ppm2 5.572 CV 1
ASSI { 237}
(( segid A and resid 45 and name H5 ))
(( segid A and resid 45 and name H1' ))
4.060 2.060 2.060 peak 237 spectrum 1 weight 0.11000E+01 volume 0.14770E-02 ppm1 5.272 ppm2 5.410 CV 1
ASSI { 238}
(( segid A and resid 42 and name H1' ))
(( segid A and resid 20 and name H2 ))
4.680 2.740 1.820 peak 238 spectrum 1 weight 0.11000E+01 volume 0.26018E-03 ppm1 5.351 ppm2 6.807 CV 1
ASSI { 240}
(( segid A and resid 42 and name H1' ))
(( segid A and resid 43 and name H1' ))
4.710 2.780 1.790 peak 240 spectrum 1 weight 0.11000E+01 volume 0.37800E-03 ppm1 5.352 ppm2 5.713 CV 1
ASSI { 243}
(( segid A and resid 41 and name H1' ))
(( segid A and resid 42 and name H6 ))
4.540 2.580 1.960 peak 243 spectrum 1 weight 0.11000E+01 volume 0.17345E-02 ppm1 5.380 ppm2 7.739 CV 1
ASSI { 245}
(( segid A and resid 18 and name H5 ))
(( segid A and resid 17 and name H8 ))
3.670 1.680 1.680 peak 245 spectrum 1 weight 0.11000E+01 volume 0.91951E-03 ppm1 5.392 ppm2 7.425 CV 1
ASSI { 250}
(( segid A and resid 40 and name H1' ))
(( segid A and resid 41 and name H6 ))
3.740 1.750 1.750 peak 250 spectrum 1 weight 0.11000E+01 volume 0.29200E-02 ppm1 5.408 ppm2 7.842 CV 1
ASSI { 251}
(( segid A and resid 45 and name H1' ))
(( segid A and resid 46 and name H6 ))
4.100 2.100 2.100 peak 251 spectrum 1 weight 0.11000E+01 volume 0.31691E-02 ppm1 5.410 ppm2 7.732 CV 1
ASSI { 252}
(( segid A and resid 19 and name H1' ))
(( segid A and resid 20 and name H8 ))
4.090 2.090 2.090 peak 252 spectrum 1 weight 0.11000E+01 volume 0.32359E-02 ppm1 5.416 ppm2 7.855 CV 1
ASSI { 258}
(( segid A and resid 29 and name H1' ))
(( segid A and resid 29 and name H6 ))
3.610 1.630 1.630 peak 258 spectrum 1 weight 0.11000E+01 volume 0.80675E-03 ppm1 5.465 ppm2 7.389 CV 1
ASSI { 260}
(( segid A and resid 37 and name H1' ))
(( segid A and resid 37 and name H5'#))
3.820 1.820 1.820 peak 260 spectrum 1 weight 0.11000E+01 volume 0.25963E-02 ppm1 5.492 ppm2 4.327 CV 1
ASSI { 262}
(( segid A and resid 39 and name H5 ))
(( segid A and resid 38 and name H6 ))
3.320 1.380 1.380 peak 262 spectrum 1 weight 0.11000E+01 volume 0.25806E-03 ppm1 5.534 ppm2 7.861 CV 1
ASSI { 265}
(( segid A and resid 39 and name H5 ))
(( segid A and resid 39 and name H2' ))
3.870 1.880 1.880 peak 265 spectrum 1 weight 0.11000E+01 volume 0.17059E-02 ppm1 5.537 ppm2 4.419 CV 1
ASSI { 266}
(( segid A and resid 34 and name H3' ))
(( segid A and resid 33 and name H4' ))
3.070 1.170 3.170 peak 266 spectrum 1 weight 0.11000E+01 volume 0.41521E-03 ppm1 5.547 ppm2 3.730 CV 1
ASSI { 267}
(( segid A and resid 34 and name H3' ))
(( segid A and resid 34 and name H1' ))
3.810 1.810 1.810 peak 267 spectrum 1 weight 0.11000E+01 volume 0.13353E-02 ppm1 5.547 ppm2 5.895 CV 1
ASSI { 268}
(( segid A and resid 34 and name H3' ))
(( segid A and resid 34 and name H4' ))
2.980 1.110 1.110 peak 268 spectrum 1 weight 0.11000E+01 volume 0.33405E-02 ppm1 5.548 ppm2 4.335 CV 1
ASSI { 270}
(( segid A and resid 46 and name H5 ))
(( segid A and resid 45 and name H1' ))
2.370 0.700 3.700 peak 270 spectrum 1 weight 0.11000E+01 volume 0.19501E-02 ppm1 5.570 ppm2 5.410 CV 1
ASSI { 271}
(( segid A and resid 46 and name H5 ))
(( segid A and resid 46 and name H1' ))
4.340 2.350 2.160 peak 271 spectrum 1 weight 0.11000E+01 volume 0.87216E-03 ppm1 5.570 ppm2 5.828 CV 1
ASSI { 273}
(( segid A and resid 41 and name H5 ))
(( segid A and resid 41 and name H1' ))
4.410 2.430 2.090 peak 273 spectrum 1 weight 0.11000E+01 volume 0.85041E-03 ppm1 5.597 ppm2 5.381 CV 1
ASSI { 279}
(( segid A and resid 31 and name H1' ))
(( segid A and resid 33 and name H5 ))
5.030 3.170 1.470 peak 279 spectrum 1 weight 0.11000E+01 volume 0.61322E-03 ppm1 5.609 ppm2 6.052 CV 1
ASSI { 281}
(( segid A and resid 31 and name H5 ))
(( segid A and resid 29 and name H1' ))
4.210 2.220 2.220 peak 281 spectrum 1 weight 0.11000E+01 volume 0.11139E-02 ppm1 5.614 ppm2 5.465 CV 1
ASSI { 282}
(( segid A and resid 38 and name H1' ))
(( segid A and resid 38 and name H6 ))
3.320 1.380 1.380 peak 282 spectrum 1 weight 0.11000E+01 volume 0.14479E-02 ppm1 5.617 ppm2 7.861 CV 1
ASSI { 283}
(( segid A and resid 38 and name H1' ))
(( segid A and resid 27 and name H2 ))
4.200 2.210 2.210 peak 283 spectrum 1 weight 0.11000E+01 volume 0.81550E-03 ppm1 5.619 ppm2 7.388 CV 1
ASSI { 284}
(( segid A and resid 38 and name H1' ))
(( segid A and resid 39 and name H6 ))
4.970 3.090 1.530 peak 284 spectrum 1 weight 0.11000E+01 volume 0.76833E-03 ppm1 5.620 ppm2 7.413 CV 1
ASSI { 294}
(( segid A and resid 28 and name H1' ))
(( segid A and resid 28 and name H2' ))
2.830 1.000 1.000 peak 294 spectrum 1 weight 0.11000E+01 volume 0.33943E-02 ppm1 5.814 ppm2 4.483 CV 1
ASSI { 298}
(( segid A and resid 17 and name H1' ))
(( segid A and resid 18 and name H5 ))
5.200 3.370 1.300 peak 298 spectrum 1 weight 0.11000E+01 volume 0.54137E-03 ppm1 5.817 ppm2 5.388 CV 1
ASSI { 299}
(( segid A and resid 17 and name H1' ))
(( segid A and resid 18 and name H6 ))
4.190 2.190 2.190 peak 299 spectrum 1 weight 0.11000E+01 volume 0.32234E-02 ppm1 5.818 ppm2 7.675 CV 1
ASSI { 300}
(( segid A and resid 17 and name H1' ))
(( segid A and resid 18 and name H1' ))
4.600 2.650 1.900 peak 300 spectrum 1 weight 0.11000E+01 volume 0.52304E-03 ppm1 5.819 ppm2 5.439 CV 1
ASSI { 302}
(( segid A and resid 26 and name H1' ))
(( segid A and resid 27 and name H8 ))
3.510 1.540 1.540 peak 302 spectrum 1 weight 0.11000E+01 volume 0.34050E-02 ppm1 5.824 ppm2 7.710 CV 1
ASSI { 303}
(( segid A and resid 26 and name H1' ))
(( segid A and resid 22 and name H2 ))
4.430 2.450 2.070 peak 303 spectrum 1 weight 0.11000E+01 volume 0.35518E-03 ppm1 5.825 ppm2 7.062 CV 1
ASSI { 304}
(( segid A and resid 46 and name H1' ))
(( segid A and resid 45 and name H1' ))
4.210 2.210 2.210 peak 304 spectrum 1 weight 0.11000E+01 volume 0.93687E-03 ppm1 5.827 ppm2 5.411 CV 1
ASSI { 305}
(( segid A and resid 46 and name H1' ))
(( segid A and resid 46 and name H6 ))
3.100 1.200 1.200 peak 305 spectrum 1 weight 0.11000E+01 volume 0.23024E-02 ppm1 5.827 ppm2 7.737 CV 1
ASSI { 306}
(( segid A and resid 20 and name H1' ))
(( segid A and resid 20 and name H8 ))
3.420 1.460 1.460 peak 306 spectrum 1 weight 0.11000E+01 volume 0.13484E-02 ppm1 5.846 ppm2 7.855 CV 1
ASSI { 307}
(( segid A and resid 20 and name H1' ))
(( segid A and resid 20 and name H2 ))
4.270 2.280 2.230 peak 307 spectrum 1 weight 0.11000E+01 volume 0.50316E-03 ppm1 5.847 ppm2 6.808 CV 1
ASSI { 308}
(( segid A and resid 20 and name H1' ))
(( segid A and resid 21 and name H8 ))
4.840 2.930 1.660 peak 308 spectrum 1 weight 0.11000E+01 volume 0.11811E-02 ppm1 5.847 ppm2 6.930 CV 1
ASSI { 309}
(( segid A and resid 33 and name H1' ))
(( segid A and resid 33 and name H6 ))
3.300 1.360 1.360 peak 309 spectrum 1 weight 0.11000E+01 volume 0.10038E-02 ppm1 5.874 ppm2 7.630 CV 1
ASSI { 310}
(( segid A and resid 22 and name H1' ))
(( segid A and resid 21 and name H1' ))
5.250 3.450 1.250 peak 310 spectrum 1 weight 0.11000E+01 volume 0.19015E-03 ppm1 5.883 ppm2 5.425 CV 1
ASSI { 311}
(( segid A and resid 22 and name H1' ))
(( segid A and resid 22 and name H8 ))
3.290 1.350 1.350 peak 311 spectrum 1 weight 0.11000E+01 volume 0.21134E-02 ppm1 5.884 ppm2 7.670 CV 1
ASSI { 316}
(( segid A and resid 27 and name H1' ))
(( segid A and resid 28 and name H1' ))
4.270 2.280 2.230 peak 316 spectrum 1 weight 0.11000E+01 volume 0.60912E-03 ppm1 5.967 ppm2 5.816 CV 1
ASSI { 319}
(( segid A and resid 32 and name H1' ))
(( segid A and resid 32 and name H5 ))
6.150 4.720 0.350 peak 319 spectrum 1 weight 0.11000E+01 volume 0.14104E-03 ppm1 6.022 ppm2 5.793 CV 1
ASSI { 322}
(( segid A and resid 33 and name H5 ))
(( segid A and resid 32 and name H6 ))
3.600 1.620 2.620 peak 322 spectrum 1 weight 0.11000E+01 volume 0.15829E-03 ppm1 6.056 ppm2 7.959 CV 1
ASSI { 323}
(( segid A and resid 20 and name H2 ))
(( segid A and resid 21 and name H8 ))
5.710 4.080 0.790 peak 323 spectrum 1 weight 0.11000E+01 volume 0.14567E-03 ppm1 6.809 ppm2 6.928 CV 1
ASSI { 324}
(( segid A and resid 21 and name H8 ))
(( segid A and resid 20 and name H8 ))
6.500 6.040 0.000 peak 324 spectrum 1 weight 0.11000E+01 volume 0.38030E-04 ppm1 6.926 ppm2 7.856 CV 1
ASSI { 325}
(( segid A and resid 21 and name H8 ))
(( segid A and resid 22 and name H8 ))
5.850 4.270 0.650 peak 325 spectrum 1 weight 0.11000E+01 volume 0.12795E-03 ppm1 6.927 ppm2 7.669 CV 1
ASSI { 326}
(( segid A and resid 22 and name H2 ))
(( segid A and resid 40 and name H1' ))
5.070 3.210 1.430 peak 326 spectrum 1 weight 0.11000E+01 volume 0.26435E-03 ppm1 7.060 ppm2 5.405 CV 1
OR { 326}
(( segid A and resid 22 and name H2 ))
(( segid A and resid 40 and name H5 ))
ASSI { 327}
(( segid A and resid 22 and name H2 ))
(( segid A and resid 26 and name H8 ))
4.230 2.230 2.230 peak 327 spectrum 1 weight 0.11000E+01 volume 0.48303E-03 ppm1 7.060 ppm2 7.686 CV 1
ASSI { 328}
(( segid A and resid 22 and name H2 ))
(( segid A and resid 22 and name H1' ))
4.490 2.520 2.010 peak 328 spectrum 1 weight 0.11000E+01 volume 0.34471E-03 ppm1 7.061 ppm2 5.885 CV 1
ASSI { 330}
(( segid A and resid 44 and name H8 ))
(( segid A and resid 43 and name H8 ))
4.780 2.860 1.720 peak 330 spectrum 1 weight 0.11000E+01 volume 0.20482E-03 ppm1 7.143 ppm2 7.646 CV 1
ASSI { 333}
(( segid A and resid 27 and name H2 ))
(( segid A and resid 28 and name H8 ))
4.370 2.390 2.130 peak 333 spectrum 1 weight 0.11000E+01 volume 0.52587E-03 ppm1 7.389 ppm2 7.535 CV 1
ASSI { 334}
(( segid A and resid 29 and name H6 ))
(( segid A and resid 31 and name H6 ))
5.720 4.080 0.780 peak 334 spectrum 1 weight 0.11000E+01 volume 0.27995E-03 ppm1 7.389 ppm2 7.709 CV 1
ASSI { 335}
(( segid A and resid 27 and name H2 ))
(( segid A and resid 28 and name H2' ))
3.770 1.780 1.780 peak 335 spectrum 1 weight 0.11000E+01 volume 0.23385E-02 ppm1 7.390 ppm2 4.481 CV 1
ASSI { 337}
(( segid A and resid 17 and name H8 ))
(( segid A and resid 17 and name H5'#))
3.020 1.140 1.140 peak 337 spectrum 1 weight 0.11000E+01 volume 0.35505E-02 ppm1 7.425 ppm2 4.436 CV 1
ASSI { 338}
(( segid A and resid 17 and name H8 ))
(( segid A and resid 18 and name H6 ))
5.310 3.520 1.190 peak 338 spectrum 1 weight 0.11000E+01 volume 0.27694E-03 ppm1 7.428 ppm2 7.673 CV 1
ASSI { 339}
(( segid A and resid 17 and name H8 ))
(( segid A and resid 16 and name H8 ))
3.560 1.580 1.580 peak 339 spectrum 1 weight 0.11000E+01 volume 0.17011E-03 ppm1 7.430 ppm2 7.969 CV 1
ASSI { 340}
(( segid A and resid 28 and name H8 ))
(( segid A and resid 27 and name H8 ))
4.760 2.830 1.740 peak 340 spectrum 1 weight 0.11000E+01 volume 0.52831E-03 ppm1 7.536 ppm2 7.711 CV 1
ASSI { 341}
(( segid A and resid 23 and name H6 ))
(( segid A and resid 23 and name H2' ))
2.200 0.600 0.600 peak 341 spectrum 1 weight 0.11000E+01 volume 0.11515E-01 ppm1 7.623 ppm2 4.412 CV 1
OR { 341}
(( segid A and resid 23 and name H6 ))
(( segid A and resid 23 and name H4' ))
ASSI { 343}
(( segid A and resid 33 and name H6 ))
(( segid A and resid 32 and name H6 ))
3.630 1.650 2.650 peak 343 spectrum 1 weight 0.11000E+01 volume 0.14953E-03 ppm1 7.632 ppm2 7.958 CV 1
ASSI { 344}
(( segid A and resid 43 and name H8 ))
(( segid A and resid 20 and name H2 ))
3.600 1.620 1.620 peak 344 spectrum 1 weight 0.11000E+01 volume 0.15876E-03 ppm1 7.649 ppm2 6.808 CV 1
ASSI { 348}
(( segid A and resid 26 and name H8 ))
(( segid A and resid 26 and name H5'#))
2.600 0.840 0.840 peak 348 spectrum 1 weight 0.11000E+01 volume 0.73752E-02 ppm1 7.685 ppm2 4.416 CV 1
ASSI { 349}
(( segid A and resid 19 and name H6 ))
(( segid A and resid 20 and name H8 ))
4.880 2.980 1.620 peak 349 spectrum 1 weight 0.11000E+01 volume 0.54285E-03 ppm1 7.685 ppm2 7.854 CV 1
ASSI { 350}
(( segid A and resid 26 and name H8 ))
(( segid A and resid 26 and name H3' ))
3.820 1.830 1.830 peak 350 spectrum 1 weight 0.11000E+01 volume 0.12451E-02 ppm1 7.687 ppm2 4.920 CV 1
ASSI { 351}
(( segid A and resid 31 and name H6 ))
(( segid A and resid 29 and name H1' ))
4.080 2.080 2.080 peak 351 spectrum 1 weight 0.11000E+01 volume 0.16385E-02 ppm1 7.711 ppm2 5.464 CV 1
ASSI { 352}
(( segid A and resid 31 and name H6 ))
(( segid A and resid 29 and name H2' ))
1.780 0.390 0.420 peak 352 spectrum 1 weight 0.11000E+01 volume 0.57704E-02 ppm1 7.712 ppm2 4.375 CV 1
ASSI { 354}
(( segid A and resid 46 and name H6 ))
(( segid A and resid 46 and name H4' ))
3.530 1.560 1.560 peak 354 spectrum 1 weight 0.11000E+01 volume 0.19044E-02 ppm1 7.739 ppm2 4.074 CV 1
ASSI { 355}
(( segid A and resid 37 and name H6 ))
(( segid A and resid 37 and name H5'#))
3.170 1.260 1.260 peak 355 spectrum 1 weight 0.11000E+01 volume 0.25230E-02 ppm1 7.753 ppm2 4.327 CV 1
ASSI { 356}
(( segid A and resid 37 and name H6 ))
(( segid A and resid 36 and name H2' ))
2.710 0.920 0.920 peak 356 spectrum 1 weight 0.11000E+01 volume 0.57645E-02 ppm1 7.753 ppm2 4.380 CV 1
ASSI { 357}
(( segid A and resid 37 and name H6 ))
(( segid A and resid 36 and name H8 ))
6.500 5.390 0.000 peak 357 spectrum 1 weight 0.11000E+01 volume 0.77295E-04 ppm1 7.757 ppm2 8.233 CV 1
ASSI { 358}
(( segid A and resid 34 and name H8 ))
(( segid A and resid 33 and name H4' ))
3.730 1.740 2.240 peak 358 spectrum 1 weight 0.11000E+01 volume 0.12799E-03 ppm1 7.798 ppm2 3.732 CV 1
ASSI { 359}
(( segid A and resid 25 and name H6 ))
(( segid A and resid 25 and name H4' ))
4.030 2.030 2.030 peak 359 spectrum 1 weight 0.11000E+01 volume 0.14037E-02 ppm1 7.807 ppm2 4.464 CV 1
ASSI { 360}
(( segid A and resid 41 and name H6 ))
(( segid A and resid 22 and name H2 ))
5.000 3.120 1.500 peak 360 spectrum 1 weight 0.11000E+01 volume 0.22084E-04 ppm1 7.839 ppm2 7.061 CV 1
ASSI { 361}
(( segid A and resid 38 and name H6 ))
(( segid A and resid 39 and name H6 ))
6.500 5.610 0.000 peak 361 spectrum 1 weight 0.11000E+01 volume 0.37024E-04 ppm1 7.859 ppm2 7.415 CV 1
ASSI { 363}
(( segid A and resid 40 and name H6 ))
(( segid A and resid 40 and name H3' ))
3.500 1.530 1.530 peak 363 spectrum 1 weight 0.11000E+01 volume 0.89907E-03 ppm1 7.947 ppm2 4.305 CV 1
ASSI { 367}
(( segid A and resid 36 and name H8 ))
(( segid A and resid 34 and name H1' ))
3.570 1.600 2.600 peak 367 spectrum 1 weight 0.11000E+01 volume 0.16578E-03 ppm1 8.231 ppm2 5.895 CV 1
ASSI { 368}
(( segid A and resid 18 and name H6 ))
(( segid A and resid 18 and name H3' ))
2.490 0.770 0.770 peak 368 spectrum 1 weight 0.11000E+01 volume 0.62101E-02 ppm1 7.679 ppm2 4.430 CV 1
ASSI { 369}
(( segid A and resid 26 and name H8 ))
(( segid A and resid 26 and name H2' ))
3.640 1.660 1.660 peak 369 spectrum 1 weight 0.11000E+01 volume 0.11027E-02 ppm1 7.690 ppm2 4.907 CV 1
ASSI { 6}
(( segid A and resid 33 and name H4' ))
(( segid A and resid 33 and name H5'#))
2.940 0.870 0.870 peak 6 spectrum 1 weight 0.11000E+01 volume 0.17737E-02 ppm1 3.730 ppm2 2.667 CV 1
ASSI { 7}
(( segid A and resid 31 and name H2' ))
(( segid A and resid 33 and name H6 ))
3.540 1.260 1.260 peak 7 spectrum 1 weight 0.11000E+01 volume 0.69448E-03 ppm1 3.730 ppm2 7.624 CV 1
ASSI { 8}
(( segid A and resid 31 and name H2' ))
(( segid A and resid 31 and name H6 ))
3.410 1.170 1.170 peak 8 spectrum 1 weight 0.11000E+01 volume 0.75989E-03 ppm1 3.730 ppm2 7.705 CV 1
ASSI { 11}
(( segid A and resid 21 and name H5'#))
(( segid A and resid 21 and name H8 ))
3.780 1.430 1.430 peak 11 spectrum 1 weight 0.11000E+01 volume 0.74434E-03 ppm1 3.966 ppm2 6.922 CV 1
ASSI { 12}
(( segid A and resid 32 and name H5'#))
(( segid A and resid 33 and name H5 ))
2.500 0.620 0.620 peak 12 spectrum 1 weight 0.10000E+01 volume 0.40615E-02 ppm1 3.968 ppm2 6.050 CV 1
OR { 12}
(( segid A and resid 32 and name H3' ))
(( segid A and resid 33 and name H5 ))
ASSI { 15}
(( segid A and resid 45 and name H2' ))
(( segid A and resid 17 and name H22 ))
3.500 1.220 1.220 peak 15 spectrum 1 weight 0.11000E+01 volume 0.70668E-03 ppm1 3.990 ppm2 6.205 CV 1
OR { 15}
(( segid A and resid 45 and name H2' ))
(( segid A and resid 17 and name H21 ))
ASSI { 16}
(( segid A and resid 44 and name H5'#))
(( segid A and resid 44 and name H8 ))
3.450 1.190 1.190 peak 16 spectrum 1 weight 0.11000E+01 volume 0.13869E-02 ppm1 3.991 ppm2 7.138 CV 1
ASSI { 17}
(( segid A and resid 45 and name H2' ))
(( segid A and resid 46 and name H5 ))
2.930 0.860 0.860 peak 17 spectrum 1 weight 0.11000E+01 volume 0.23831E-02 ppm1 3.997 ppm2 5.571 CV 1
ASSI { 18}
(( segid A and resid 45 and name H2' ))
(( segid A and resid 46 and name H6 ))
2.000 0.400 0.400 peak 18 spectrum 1 weight 0.10000E+01 volume 0.12652E-01 ppm1 3.995 ppm2 7.724 CV 1
ASSI { 20}
(( segid A and resid 39 and name H5'#))
(( segid A and resid 39 and name H6 ))
2.670 0.710 0.710 peak 20 spectrum 1 weight 0.11000E+01 volume 0.29062E-02 ppm1 4.055 ppm2 7.407 CV 1
ASSI { 25}
(( segid A and resid 36 and name H3' ))
(( segid A and resid 36 and name H8 ))
2.720 0.740 0.740 peak 25 spectrum 1 weight 0.10000E+01 volume 0.37600E-02 ppm1 4.181 ppm2 8.227 CV 1
OR { 25}
(( segid A and resid 36 and name H5'#))
(( segid A and resid 36 and name H8 ))
ASSI { 26}
(( segid A and resid 46 and name H3' ))
(( segid A and resid 46 and name H6 ))
2.100 0.440 0.440 peak 26 spectrum 1 weight 0.11000E+01 volume 0.11048E-01 ppm1 4.192 ppm2 7.723 CV 1
ASSI { 27}
(( segid A and resid 18 and name H2' ))
(( segid A and resid 18 and name H1' ))
2.310 0.540 0.540 peak 27 spectrum 1 weight 0.11000E+01 volume 0.65888E-02 ppm1 4.208 ppm2 5.436 CV 1
ASSI { 30}
(( segid A and resid 40 and name H2' ))
(( segid A and resid 41 and name H6 ))
2.200 0.480 0.480 peak 30 spectrum 1 weight 0.11000E+01 volume 0.91516E-02 ppm1 4.285 ppm2 7.834 CV 1
ASSI { 31}
(( segid A and resid 40 and name H3' ))
(( segid A and resid 40 and name H6 ))
2.750 0.750 0.750 peak 31 spectrum 1 weight 0.10000E+01 volume 0.27716E-02 ppm1 4.295 ppm2 7.939 CV 1
OR { 31}
(( segid A and resid 40 and name H2' ))
(( segid A and resid 40 and name H6 ))
ASSI { 33}
(( segid A and resid 44 and name H3' ))
(( segid A and resid 44 and name H8 ))
2.690 0.720 0.720 peak 33 spectrum 1 weight 0.11000E+01 volume 0.31726E-02 ppm1 4.319 ppm2 7.138 CV 1
ASSI { 34}
(( segid A and resid 36 and name H4' ))
(( segid A and resid 34 and name H3' ))
3.360 1.130 1.130 peak 34 spectrum 1 weight 0.11000E+01 volume 0.35494E-02 ppm1 4.321 ppm2 5.542 CV 1
ASSI { 35}
(( segid A and resid 21 and name H2' ))
(( segid A and resid 21 and name H1' ))
2.210 0.490 0.490 peak 35 spectrum 1 weight 0.11000E+01 volume 0.93222E-02 ppm1 4.364 ppm2 5.422 CV 1
ASSI { 36}
(( segid A and resid 37 and name H2' ))
(( segid A and resid 37 and name H1' ))
2.290 0.520 0.520 peak 36 spectrum 1 weight 0.11000E+01 volume 0.73849E-02 ppm1 4.396 ppm2 5.486 CV 1
ASSI { 37}
(( segid A and resid 36 and name H5'#))
(( segid A and resid 36 and name H8 ))
2.530 0.640 0.640 peak 37 spectrum 1 weight 0.10000E+01 volume 0.53438E-02 ppm1 4.396 ppm2 8.227 CV 1
OR { 37}
(( segid A and resid 36 and name H1' ))
(( segid A and resid 36 and name H8 ))
OR { 37}
(( segid A and resid 36 and name H2' ))
(( segid A and resid 36 and name H8 ))
ASSI { 38}
(( segid A and resid 25 and name H2' ))
(( segid A and resid 25 and name H6 ))
2.180 0.470 0.470 peak 38 spectrum 1 weight 0.11000E+01 volume 0.10903E-01 ppm1 4.405 ppm2 7.803 CV 1
ASSI { 39}
(( segid A and resid 37 and name H2' ))
(( segid A and resid 38 and name H6 ))
1.840 0.340 0.360 peak 39 spectrum 1 weight 0.10000E+01 volume 0.16878E-01 ppm1 4.408 ppm2 7.852 CV 1
OR { 39}
(( segid A and resid 37 and name H3' ))
(( segid A and resid 38 and name H6 ))
ASSI { 41}
(( segid A and resid 23 and name H2' ))
(( segid A and resid 23 and name H1' ))
2.610 0.680 0.680 peak 41 spectrum 1 weight 0.11000E+01 volume 0.44895E-02 ppm1 4.416 ppm2 5.781 CV 1
ASSI { 42}
(( segid A and resid 32 and name H4' ))
(( segid A and resid 32 and name H1' ))
3.010 0.910 0.910 peak 42 spectrum 1 weight 0.11000E+01 volume 0.18598E-02 ppm1 4.416 ppm2 6.023 CV 1
ASSI { 43}
(( segid A and resid 33 and name H3' ))
(( segid A and resid 33 and name H5'#))
3.300 1.090 1.090 peak 43 spectrum 1 weight 0.11000E+01 volume 0.75844E-03 ppm1 4.417 ppm2 2.667 CV 1
ASSI { 46}
(( segid A and resid 44 and name H2' ))
(( segid A and resid 44 and name H1' ))
2.370 0.560 0.560 peak 46 spectrum 1 weight 0.11000E+01 volume 0.68345E-02 ppm1 4.458 ppm2 5.608 CV 1
ASSI { 47}
(( segid A and resid 42 and name H2' ))
(( segid A and resid 42 and name H1' ))
2.490 0.620 0.620 peak 47 spectrum 1 weight 0.11000E+01 volume 0.39867E-02 ppm1 4.473 ppm2 5.349 CV 1
ASSI { 48}
(( segid A and resid 19 and name H2' ))
(( segid A and resid 19 and name H1' ))
2.230 0.500 0.500 peak 48 spectrum 1 weight 0.10000E+01 volume 0.98422E-02 ppm1 4.485 ppm2 5.415 CV 1
ASSI { 50}
(( segid A and resid 28 and name H2' ))
(( segid A and resid 28 and name H8 ))
2.560 0.650 1.150 peak 50 spectrum 1 weight 0.11000E+01 volume 0.48348E-02 ppm1 4.480 ppm2 7.531 CV 1
ASSI { 52}
(( segid A and resid 43 and name H2' ))
(( segid A and resid 44 and name H8 ))
2.260 0.510 0.510 peak 52 spectrum 1 weight 0.10000E+01 volume 0.99332E-02 ppm1 4.545 ppm2 7.138 CV 1
OR { 52}
(( segid A and resid 43 and name H3' ))
(( segid A and resid 44 and name H8 ))
ASSI { 53}
(( segid A and resid 17 and name H2' ))
(( segid A and resid 18 and name H6 ))
2.090 0.440 0.440 peak 53 spectrum 1 weight 0.10000E+01 volume 0.10820E-01 ppm1 4.576 ppm2 7.663 CV 1
ASSI { 55}
(( segid A and resid 32 and name H2' ))
(( segid A and resid 32 and name H6 ))
2.320 0.540 0.540 peak 55 spectrum 1 weight 0.11000E+01 volume 0.71488E-02 ppm1 4.594 ppm2 7.952 CV 1
ASSI { 59}
(( segid A and resid 27 and name H2' ))
(( segid A and resid 27 and name H8 ))
2.660 0.710 1.210 peak 59 spectrum 1 weight 0.11000E+01 volume 0.45302E-02 ppm1 4.647 ppm2 7.706 CV 1
ASSI { 61}
(( segid A and resid 26 and name H2' ))
(( segid A and resid 26 and name H1' ))
2.420 0.580 0.580 peak 61 spectrum 1 weight 0.11000E+01 volume 0.70995E-02 ppm1 4.896 ppm2 5.831 CV 1
ASSI { 62}
(( segid A and resid 26 and name H2' ))
(( segid A and resid 27 and name H8 ))
2.340 0.550 0.550 peak 62 spectrum 1 weight 0.10000E+01 volume 0.86416E-02 ppm1 4.897 ppm2 7.706 CV 1
OR { 62}
(( segid A and resid 26 and name H3' ))
(( segid A and resid 27 and name H8 ))
ASSI { 63}
(( segid A and resid 42 and name H5 ))
(( segid A and resid 42 and name H6 ))
2.370 0.560 0.560 peak 63 spectrum 1 weight 0.11000E+01 volume 0.50119E-02 ppm1 5.095 ppm2 7.730 CV 1
ASSI { 64}
(( segid A and resid 42 and name H5 ))
(( segid A and resid 41 and name H6 ))
3.580 1.290 1.290 peak 64 spectrum 1 weight 0.11000E+01 volume 0.76771E-03 ppm1 5.100 ppm2 7.833 CV 1
ASSI { 66}
(( segid A and resid 29 and name H5 ))
(( segid A and resid 28 and name H8 ))
3.480 1.210 1.210 peak 66 spectrum 1 weight 0.11000E+01 volume 0.70888E-03 ppm1 5.131 ppm2 7.530 CV 1
ASSI { 67}
(( segid A and resid 29 and name H5 ))
(( segid A and resid 29 and name H41 ))
2.550 0.650 0.650 peak 67 spectrum 1 weight 0.11000E+01 volume 0.33215E-02 ppm1 5.138 ppm2 6.711 CV 1
ASSI { 68}
(( segid A and resid 29 and name H5 ))
(( segid A and resid 29 and name H6 ))
2.360 0.560 0.560 peak 68 spectrum 1 weight 0.11000E+01 volume 0.62604E-02 ppm1 5.139 ppm2 7.379 CV 1
ASSI { 69}
(( segid A and resid 37 and name H5 ))
(( segid A and resid 38 and name H6 ))
4.040 1.630 1.630 peak 69 spectrum 1 weight 0.11000E+01 volume 0.59603E-03 ppm1 5.149 ppm2 7.855 CV 1
ASSI { 72}
(( segid A and resid 39 and name H1' ))
(( segid A and resid 27 and name H2 ))
2.540 0.640 0.640 peak 72 spectrum 1 weight 0.11000E+01 volume 0.52435E-02 ppm1 5.183 ppm2 7.391 CV 1
ASSI { 73}
(( segid A and resid 39 and name H1' ))
(( segid A and resid 40 and name H6 ))
4.230 1.790 1.790 peak 73 spectrum 1 weight 0.11000E+01 volume 0.88181E-03 ppm1 5.188 ppm2 7.934 CV 1
ASSI { 78}
(( segid A and resid 41 and name H1' ))
(( segid A and resid 22 and name H2 ))
2.920 0.850 0.850 peak 78 spectrum 1 weight 0.11000E+01 volume 0.23270E-02 ppm1 5.382 ppm2 7.056 CV 1
ASSI { 79}
(( segid A and resid 18 and name H5 ))
(( segid A and resid 18 and name H6 ))
2.150 0.460 0.460 peak 79 spectrum 1 weight 0.11000E+01 volume 0.11104E-01 ppm1 5.391 ppm2 7.663 CV 1
ASSI { 80}
(( segid A and resid 38 and name H5 ))
(( segid A and resid 38 and name H6 ))
2.250 0.510 0.510 peak 80 spectrum 1 weight 0.11000E+01 volume 0.78842E-02 ppm1 5.395 ppm2 7.853 CV 1
ASSI { 81}
(( segid A and resid 40 and name H5 ))
(( segid A and resid 40 and name H6 ))
2.260 0.510 0.510 peak 81 spectrum 1 weight 0.11000E+01 volume 0.83735E-02 ppm1 5.399 ppm2 7.934 CV 1
ASSI { 82}
(( segid A and resid 40 and name H5 ))
(( segid A and resid 39 and name H42 ))
3.080 0.950 0.950 peak 82 spectrum 1 weight 0.10000E+01 volume 0.19917E-02 ppm1 5.400 ppm2 8.358 CV 1
OR { 82}
(( segid A and resid 40 and name H1' ))
(( segid A and resid 39 and name H42 ))
ASSI { 84}
(( segid A and resid 45 and name H1' ))
(( segid A and resid 44 and name H1 ))
3.550 1.260 1.260 peak 84 spectrum 1 weight 0.11000E+01 volume 0.12040E-02 ppm1 5.411 ppm2 13.343 CV 1
ASSI { 85}
(( segid A and resid 19 and name H5 ))
(( segid A and resid 19 and name H42 ))
3.900 1.520 1.520 peak 85 spectrum 1 weight 0.11000E+01 volume 0.17235E-02 ppm1 5.414 ppm2 8.264 CV 1
ASSI { 86}
(( segid A and resid 19 and name H1' ))
(( segid A and resid 43 and name H1 ))
4.440 1.970 1.970 peak 86 spectrum 1 weight 0.10000E+01 volume 0.24274E-03 ppm1 5.417 ppm2 11.967 CV 1
OR { 86}
(( segid A and resid 19 and name H5 ))
(( segid A and resid 43 and name H1 ))
ASSI { 88}
(( segid A and resid 19 and name H5 ))
(( segid A and resid 19 and name H6 ))
2.070 0.430 0.430 peak 88 spectrum 1 weight 0.11000E+01 volume 0.12038E-01 ppm1 5.422 ppm2 7.681 CV 1
ASSI { 89}
(( segid A and resid 18 and name H1' ))
(( segid A and resid 17 and name H21 ))
2.520 0.640 0.640 peak 89 spectrum 1 weight 0.11000E+01 volume 0.53824E-02 ppm1 5.435 ppm2 6.208 CV 1
OR { 89}
(( segid A and resid 18 and name H1' ))
(( segid A and resid 17 and name H22 ))
ASSI { 90}
(( segid A and resid 23 and name H5 ))
(( segid A and resid 23 and name H6 ))
2.370 0.560 0.560 peak 90 spectrum 1 weight 0.11000E+01 volume 0.64162E-02 ppm1 5.452 ppm2 7.617 CV 1
ASSI { 91}
(( segid A and resid 39 and name H5 ))
(( segid A and resid 39 and name H6 ))
2.340 0.550 0.550 peak 91 spectrum 1 weight 0.11000E+01 volume 0.68497E-02 ppm1 5.534 ppm2 7.406 CV 1
ASSI { 92}
(( segid A and resid 39 and name H5 ))
(( segid A and resid 39 and name H42 ))
3.860 1.490 1.490 peak 92 spectrum 1 weight 0.11000E+01 volume 0.18528E-02 ppm1 5.546 ppm2 8.362 CV 1
ASSI { 94}
(( segid A and resid 41 and name H5 ))
(( segid A and resid 41 and name H41 ))
2.590 0.670 0.670 peak 94 spectrum 1 weight 0.11000E+01 volume 0.31197E-02 ppm1 5.593 ppm2 6.898 CV 1
ASSI { 95}
(( segid A and resid 41 and name H5 ))
(( segid A and resid 41 and name H6 ))
2.370 0.560 0.560 peak 95 spectrum 1 weight 0.11000E+01 volume 0.63548E-02 ppm1 5.595 ppm2 7.834 CV 1
ASSI { 98}
(( segid A and resid 31 and name H5 ))
(( segid A and resid 31 and name H6 ))
2.290 0.520 0.520 peak 98 spectrum 1 weight 0.11000E+01 volume 0.89735E-02 ppm1 5.610 ppm2 7.708 CV 1
ASSI { 100}
(( segid A and resid 26 and name H21 ))
(( segid A and resid 26 and name H1 ))
4.370 1.910 1.910 peak 100 spectrum 1 weight 0.11000E+01 volume 0.94490E-03 ppm1 5.762 ppm2 12.492 CV 1
ASSI { 101}
(( segid A and resid 23 and name H1' ))
(( segid A and resid 23 and name H6 ))
3.130 0.980 0.980 peak 101 spectrum 1 weight 0.11000E+01 volume 0.17820E-02 ppm1 5.778 ppm2 7.617 CV 1
ASSI { 103}
(( segid A and resid 28 and name H1' ))
(( segid A and resid 27 and name H2 ))
2.740 0.750 0.750 peak 103 spectrum 1 weight 0.11000E+01 volume 0.33177E-02 ppm1 5.812 ppm2 7.389 CV 1
ASSI { 107}
(( segid A and resid 21 and name H21 ))
(( segid A and resid 21 and name H1 ))
4.680 2.190 1.820 peak 107 spectrum 1 weight 0.11000E+01 volume 0.55281E-03 ppm1 5.876 ppm2 12.422 CV 1
ASSI { 108}
(( segid A and resid 25 and name H5 ))
(( segid A and resid 25 and name H6 ))
2.030 0.410 0.410 peak 108 spectrum 1 weight 0.11000E+01 volume 0.18912E-01 ppm1 5.894 ppm2 7.803 CV 1
ASSI { 113}
(( segid A and resid 33 and name H5 ))
(( segid A and resid 33 and name H41 ))
3.070 0.940 0.940 peak 113 spectrum 1 weight 0.11000E+01 volume 0.96751E-03 ppm1 6.048 ppm2 7.101 CV 1
ASSI { 115}
(( segid A and resid 17 and name H21 ))
(( segid A and resid 18 and name H6 ))
4.140 1.710 1.710 peak 115 spectrum 1 weight 0.11000E+01 volume 0.40270E-03 ppm1 6.199 ppm2 7.667 CV 1
OR { 115}
(( segid A and resid 17 and name H22 ))
(( segid A and resid 18 and name H6 ))
ASSI { 116}
(( segid A and resid 17 and name H21 ))
(( segid A and resid 46 and name H1' ))
2.520 0.640 0.640 peak 116 spectrum 1 weight 0.10000E+01 volume 0.55705E-02 ppm1 6.206 ppm2 5.831 CV 1
OR { 116}
(( segid A and resid 17 and name H22 ))
(( segid A and resid 46 and name H1' ))
ASSI { 117}
(( segid A and resid 17 and name H22 ))
(( segid A and resid 17 and name H1 ))
2.900 0.840 0.840 peak 117 spectrum 1 weight 0.11000E+01 volume 0.19480E-02 ppm1 6.206 ppm2 11.529 CV 1
OR { 117}
(( segid A and resid 17 and name H21 ))
(( segid A and resid 17 and name H1 ))
ASSI { 119}
(( segid A and resid 29 and name H41 ))
(( segid A and resid 29 and name H42 ))
2.200 0.490 0.490 peak 119 spectrum 1 weight 0.11000E+01 volume 0.51432E-02 ppm1 6.708 ppm2 8.395 CV 1
ASSI { 120}
(( segid A and resid 37 and name H41 ))
(( segid A and resid 37 and name H42 ))
2.210 0.490 0.490 peak 120 spectrum 1 weight 0.11000E+01 volume 0.43048E-02 ppm1 6.710 ppm2 8.825 CV 1
ASSI { 121}
(( segid A and resid 37 and name H41 ))
(( segid A and resid 28 and name H1 ))
5.000 2.500 1.500 peak 121 spectrum 1 weight 0.11000E+01 volume 0.74789E-03 ppm1 6.711 ppm2 13.565 CV 1
ASSI { 123}
(( segid A and resid 19 and name H41 ))
(( segid A and resid 43 and name H1 ))
3.980 1.590 1.590 peak 123 spectrum 1 weight 0.11000E+01 volume 0.10785E-02 ppm1 6.771 ppm2 11.968 CV 1
ASSI { 124}
(( segid A and resid 19 and name H41 ))
(( segid A and resid 19 and name H42 ))
2.160 0.470 0.470 peak 124 spectrum 1 weight 0.11000E+01 volume 0.55660E-02 ppm1 6.773 ppm2 8.267 CV 1
ASSI { 127}
(( segid A and resid 18 and name H41 ))
(( segid A and resid 44 and name H1 ))
3.870 1.500 1.500 peak 127 spectrum 1 weight 0.11000E+01 volume 0.13610E-02 ppm1 6.821 ppm2 13.342 CV 1
ASSI { 128}
(( segid A and resid 18 and name H41 ))
(( segid A and resid 18 and name H42 ))
2.110 0.440 0.440 peak 128 spectrum 1 weight 0.11000E+01 volume 0.66305E-02 ppm1 6.823 ppm2 8.356 CV 1
ASSI { 129}
(( segid A and resid 41 and name H41 ))
(( segid A and resid 41 and name H42 ))
2.110 0.440 0.440 peak 129 spectrum 1 weight 0.11000E+01 volume 0.56522E-02 ppm1 6.898 ppm2 8.224 CV 1
ASSI { 130}
(( segid A and resid 41 and name H41 ))
(( segid A and resid 21 and name H1 ))
4.810 2.310 1.690 peak 130 spectrum 1 weight 0.11000E+01 volume 0.92268E-03 ppm1 6.898 ppm2 12.421 CV 1
ASSI { 131}
(( segid A and resid 39 and name H41 ))
(( segid A and resid 39 and name H5 ))
2.630 0.690 0.690 peak 131 spectrum 1 weight 0.11000E+01 volume 0.28666E-02 ppm1 7.026 ppm2 5.539 CV 1
ASSI { 132}
(( segid A and resid 39 and name H41 ))
(( segid A and resid 39 and name H42 ))
2.170 0.470 0.470 peak 132 spectrum 1 weight 0.11000E+01 volume 0.56181E-02 ppm1 7.034 ppm2 8.365 CV 1
ASSI { 137}
(( segid A and resid 19 and name H6 ))
(( segid A and resid 19 and name H5 ))
2.080 0.430 0.430 peak 137 spectrum 1 weight 0.10000E+01 volume 0.12182E-01 ppm1 7.675 ppm2 5.415 CV 1
OR { 137}
(( segid A and resid 19 and name H6 ))
(( segid A and resid 19 and name H1' ))
ASSI { 139}
(( segid A and resid 42 and name H6 ))
(( segid A and resid 41 and name H2' ))
1.830 0.330 0.370 peak 139 spectrum 1 weight 0.10000E+01 volume 0.91964E-02 ppm1 7.726 ppm2 4.120 CV 1
ASSI { 141}
(( segid A and resid 34 and name H8 ))
(( segid A and resid 34 and name H1' ))
2.100 0.440 0.440 peak 141 spectrum 1 weight 0.11000E+01 volume 0.16408E-01 ppm1 7.801 ppm2 5.897 CV 1
ASSI { 143}
(( segid A and resid 27 and name H62 ))
(( segid A and resid 38 and name H3 ))
3.330 1.110 1.110 peak 143 spectrum 1 weight 0.11000E+01 volume 0.10271E-02 ppm1 7.997 ppm2 14.177 CV 1
OR { 143}
(( segid A and resid 27 and name H61 ))
(( segid A and resid 38 and name H3 ))
ASSI { 144}
(( segid A and resid 41 and name H42 ))
(( segid A and resid 41 and name H5 ))
3.630 1.320 1.320 peak 144 spectrum 1 weight 0.11000E+01 volume 0.24849E-02 ppm1 8.216 ppm2 5.599 CV 1
ASSI { 146}
(( segid A and resid 19 and name H42 ))
(( segid A and resid 43 and name H1 ))
2.890 0.830 0.830 peak 146 spectrum 1 weight 0.11000E+01 volume 0.17660E-02 ppm1 8.263 ppm2 11.968 CV 1
ASSI { 148}
(( segid A and resid 18 and name H42 ))
(( segid A and resid 44 and name H1 ))
2.830 0.800 0.800 peak 148 spectrum 1 weight 0.11000E+01 volume 0.19772E-02 ppm1 8.363 ppm2 13.342 CV 1
ASSI { 153}
(( segid A and resid 45 and name H3 ))
(( segid A and resid 44 and name H1 ))
5.180 2.680 1.320 peak 153 spectrum 1 weight 0.11000E+01 volume 0.73890E-04 ppm1 12.131 ppm2 13.342 CV 1
ASSI { 156}
(( segid A and resid 36 and name H1 ))
(( segid A and resid 29 and name H42 ))
3.050 0.930 0.930 peak 156 spectrum 1 weight 0.11000E+01 volume 0.11166E-02 ppm1 13.332 ppm2 8.394 CV 1
ASSI { 158}
(( segid A and resid 40 and name H3 ))
(( segid A and resid 22 and name H2 ))
3.280 1.080 1.080 peak 158 spectrum 1 weight 0.11000E+01 volume 0.12047E-02 ppm1 13.941 ppm2 7.057 CV 1
ASSI { 159}
(( segid A and resid 28 and name H3' ))
(( segid A and resid 28 and name H8 ))
2.780 0.780 0.780 peak 159 spectrum 1 weight 0.11000E+01 volume 0.26739E-02 ppm1 4.440 ppm2 7.532 CV 1
ASSI { 3}
(( segid A and resid 33 and name H5'#))
(( segid A and resid 33 and name H6 ))
4.850 2.350 1.650 peak 3 spectrum 1 weight 0.11000E+01 volume 0.25267E-03 ppm1 2.674 ppm2 7.628 CV 1
ASSI { 4}
(( segid A and resid 33 and name H5'#))
(( segid A and resid 33 and name H6 ))
3.820 1.460 1.460 peak 4 spectrum 1 weight 0.11000E+01 volume 0.32485E-03 ppm1 3.554 ppm2 7.626 CV 1
ASSI { 5}
(( segid A and resid 33 and name H4' ))
(( segid A and resid 33 and name H1' ))
3.340 1.120 1.120 peak 5 spectrum 1 weight 0.11000E+01 volume 0.79128E-03 ppm1 3.728 ppm2 5.874 CV 1
ASSI { 7}
(( segid A and resid 31 and name H2' ))
(( segid A and resid 31 and name H1' ))
2.760 0.760 0.760 peak 7 spectrum 1 weight 0.11000E+01 volume 0.28914E-02 ppm1 3.732 ppm2 5.612 CV 1
ASSI { 8}
(( segid A and resid 31 and name H2' ))
(( segid A and resid 33 and name H5 ))
2.690 0.720 0.720 peak 8 spectrum 1 weight 0.11000E+01 volume 0.25841E-02 ppm1 3.733 ppm2 6.055 CV 1
ASSI { 10}
(( segid A and resid 31 and name H2' ))
(( segid A and resid 32 and name H6 ))
4.420 1.950 1.950 peak 10 spectrum 1 weight 0.11000E+01 volume 0.28427E-03 ppm1 3.733 ppm2 7.955 CV 1
ASSI { 11}
(( segid A and resid 16 and name H5'#))
(( segid A and resid 16 and name H8 ))
3.880 1.500 1.500 peak 11 spectrum 1 weight 0.11000E+01 volume 0.97781E-03 ppm1 3.827 ppm2 7.988 CV 1
ASSI { 12}
(( segid A and resid 39 and name H3' ))
(( segid A and resid 39 and name H1' ))
3.350 1.120 1.120 peak 12 spectrum 1 weight 0.11000E+01 volume 0.14829E-02 ppm1 3.937 ppm2 5.200 CV 1
ASSI { 13}
(( segid A and resid 39 and name H3' ))
(( segid A and resid 40 and name H5 ))
3.000 0.900 0.900 peak 13 spectrum 1 weight 0.10000E+01 volume 0.25267E-02 ppm1 3.937 ppm2 5.407 CV 1
ASSI { 14}
(( segid A and resid 39 and name H3' ))
(( segid A and resid 39 and name H6 ))
2.830 0.800 0.800 peak 14 spectrum 1 weight 0.11000E+01 volume 0.23614E-02 ppm1 3.937 ppm2 7.410 CV 1
ASSI { 15}
(( segid A and resid 39 and name H3' ))
(( segid A and resid 40 and name H6 ))
2.680 0.720 0.720 peak 15 spectrum 1 weight 0.11000E+01 volume 0.27752E-02 ppm1 3.938 ppm2 7.939 CV 1
ASSI { 17}
(( segid A and resid 32 and name H5'#))
(( segid A and resid 32 and name H6 ))
3.130 0.980 0.980 peak 17 spectrum 1 weight 0.10000E+01 volume 0.18694E-02 ppm1 3.967 ppm2 7.954 CV 1
OR { 17}
(( segid A and resid 32 and name H3' ))
(( segid A and resid 32 and name H6 ))
ASSI { 19}
(( segid A and resid 32 and name H3' ))
(( segid A and resid 33 and name H6 ))
2.240 0.500 0.500 peak 19 spectrum 1 weight 0.10000E+01 volume 0.68166E-02 ppm1 3.968 ppm2 7.628 CV 1
OR { 19}
(( segid A and resid 32 and name H5'#))
(( segid A and resid 33 and name H6 ))
ASSI { 20}
(( segid A and resid 46 and name H2' ))
(( segid A and resid 46 and name H1' ))
2.350 0.550 0.550 peak 20 spectrum 1 weight 0.11000E+01 volume 0.83043E-02 ppm1 3.980 ppm2 5.831 CV 1
ASSI { 22}
(( segid A and resid 45 and name H2' ))
(( segid A and resid 45 and name H1' ))
2.440 0.590 0.590 peak 22 spectrum 1 weight 0.11000E+01 volume 0.53831E-02 ppm1 4.010 ppm2 5.413 CV 1
ASSI { 24}
(( segid A and resid 33 and name H2' ))
(( segid A and resid 33 and name H1' ))
2.990 0.890 0.890 peak 24 spectrum 1 weight 0.11000E+01 volume 0.17246E-02 ppm1 4.046 ppm2 5.874 CV 1
ASSI { 25}
(( segid A and resid 33 and name H2' ))
(( segid A and resid 33 and name H6 ))
2.260 0.510 1.010 peak 25 spectrum 1 weight 0.11000E+01 volume 0.79638E-02 ppm1 4.046 ppm2 7.628 CV 1
ASSI { 27}
(( segid A and resid 46 and name H4' ))
(( segid A and resid 46 and name H1' ))
2.780 0.770 0.770 peak 27 spectrum 1 weight 0.11000E+01 volume 0.31462E-02 ppm1 4.082 ppm2 5.830 CV 1
ASSI { 28}
(( segid A and resid 28 and name H5'#))
(( segid A and resid 28 and name H8 ))
3.440 1.190 1.190 peak 28 spectrum 1 weight 0.11000E+01 volume 0.13097E-02 ppm1 4.087 ppm2 7.535 CV 1
ASSI { 29}
(( segid A and resid 34 and name H5'#))
(( segid A and resid 34 and name H3' ))
2.850 0.810 0.810 peak 29 spectrum 1 weight 0.11000E+01 volume 0.20707E-02 ppm1 4.113 ppm2 5.553 CV 1
ASSI { 30}
(( segid A and resid 41 and name H2' ))
(( segid A and resid 41 and name H1' ))
2.320 0.540 0.540 peak 30 spectrum 1 weight 0.11000E+01 volume 0.57263E-02 ppm1 4.128 ppm2 5.384 CV 1
ASSI { 32}
(( segid A and resid 41 and name H2' ))
(( segid A and resid 41 and name H6 ))
3.170 1.000 1.000 peak 32 spectrum 1 weight 0.11000E+01 volume 0.13198E-02 ppm1 4.128 ppm2 7.834 CV 1
ASSI { 33}
(( segid A and resid 32 and name H5'#))
(( segid A and resid 32 and name H6 ))
3.670 1.350 1.350 peak 33 spectrum 1 weight 0.11000E+01 volume 0.56984E-03 ppm1 4.177 ppm2 7.954 CV 1
ASSI { 34}
(( segid A and resid 32 and name H5'#))
(( segid A and resid 33 and name H5 ))
4.820 2.320 1.680 peak 34 spectrum 1 weight 0.11000E+01 volume 0.66378E-03 ppm1 4.178 ppm2 6.054 CV 1
ASSI { 35}
(( segid A and resid 29 and name H3' ))
(( segid A and resid 29 and name H6 ))
2.580 0.670 0.670 peak 35 spectrum 1 weight 0.11000E+01 volume 0.38082E-02 ppm1 4.181 ppm2 7.382 CV 1
ASSI { 37}
(( segid A and resid 46 and name H3' ))
(( segid A and resid 46 and name H1' ))
3.280 1.080 1.080 peak 37 spectrum 1 weight 0.11000E+01 volume 0.18089E-02 ppm1 4.196 ppm2 5.829 CV 1
ASSI { 41}
(( segid A and resid 22 and name H2' ))
(( segid A and resid 22 and name H1' ))
2.520 0.640 0.640 peak 41 spectrum 1 weight 0.11000E+01 volume 0.55722E-02 ppm1 4.251 ppm2 5.886 CV 1
ASSI { 42}
(( segid A and resid 39 and name H5'#))
(( segid A and resid 39 and name H6 ))
3.250 1.050 1.050 peak 42 spectrum 1 weight 0.11000E+01 volume 0.18467E-02 ppm1 4.267 ppm2 7.411 CV 1
ASSI { 44}
(( segid A and resid 40 and name H2' ))
(( segid A and resid 40 and name H6 ))
3.180 1.010 1.010 peak 44 spectrum 1 weight 0.11000E+01 volume 0.12536E-02 ppm1 4.285 ppm2 7.938 CV 1
ASSI { 45}
(( segid A and resid 16 and name H4' ))
(( segid A and resid 16 and name H8 ))
4.190 1.760 1.760 peak 45 spectrum 1 weight 0.11000E+01 volume 0.50453E-03 ppm1 4.289 ppm2 7.983 CV 1
ASSI { 46}
(( segid A and resid 16 and name H4' ))
(( segid A and resid 16 and name H1' ))
3.410 1.170 1.170 peak 46 spectrum 1 weight 0.11000E+01 volume 0.10378E-02 ppm1 4.291 ppm2 5.684 CV 1
ASSI { 47}
(( segid A and resid 31 and name H4' ))
(( segid A and resid 32 and name H5 ))
2.990 0.900 1.400 peak 47 spectrum 1 weight 0.11000E+01 volume 0.19674E-02 ppm1 4.313 ppm2 5.801 CV 1
ASSI { 49}
(( segid A and resid 44 and name H3' ))
(( segid A and resid 45 and name H6 ))
2.240 0.500 0.500 peak 49 spectrum 1 weight 0.11000E+01 volume 0.69634E-02 ppm1 4.322 ppm2 7.707 CV 1
ASSI { 50}
(( segid A and resid 21 and name H3' ))
(( segid A and resid 21 and name H8 ))
3.200 1.020 1.020 peak 50 spectrum 1 weight 0.11000E+01 volume 0.11181E-02 ppm1 4.324 ppm2 6.927 CV 1
ASSI { 55}
(( segid A and resid 21 and name H2' ))
(( segid A and resid 22 and name H8 ))
2.150 0.460 0.460 peak 55 spectrum 1 weight 0.11000E+01 volume 0.12348E-01 ppm1 4.368 ppm2 7.670 CV 1
ASSI { 56}
(( segid A and resid 29 and name H2' ))
(( segid A and resid 29 and name H6 ))
2.940 0.870 0.870 peak 56 spectrum 1 weight 0.11000E+01 volume 0.15108E-02 ppm1 4.379 ppm2 7.383 CV 1
ASSI { 58}
(( segid A and resid 36 and name H5'#))
(( segid A and resid 36 and name H8 ))
2.590 0.670 0.670 peak 58 spectrum 1 weight 0.10000E+01 volume 0.43741E-02 ppm1 4.398 ppm2 8.230 CV 1
OR { 58}
(( segid A and resid 36 and name H1' ))
(( segid A and resid 36 and name H8 ))
ASSI { 59}
(( segid A and resid 37 and name H2' ))
(( segid A and resid 37 and name H1' ))
2.520 0.640 0.640 peak 59 spectrum 1 weight 0.10000E+01 volume 0.47400E-02 ppm1 4.404 ppm2 5.494 CV 1
OR { 59}
(( segid A and resid 37 and name H3' ))
(( segid A and resid 37 and name H1' ))
ASSI { 65}
(( segid A and resid 43 and name H4' ))
(( segid A and resid 43 and name H1' ))
2.960 0.880 0.880 peak 65 spectrum 1 weight 0.11000E+01 volume 0.20784E-02 ppm1 4.422 ppm2 5.718 CV 1
ASSI { 67}
(( segid A and resid 16 and name H3' ))
(( segid A and resid 17 and name H8 ))
2.700 0.730 0.730 peak 67 spectrum 1 weight 0.11000E+01 volume 0.46925E-02 ppm1 4.457 ppm2 7.436 CV 1
ASSI { 68}
(( segid A and resid 16 and name H3' ))
(( segid A and resid 16 and name H8 ))
3.080 0.950 0.950 peak 68 spectrum 1 weight 0.11000E+01 volume 0.18696E-02 ppm1 4.458 ppm2 7.988 CV 1
ASSI { 69}
(( segid A and resid 31 and name H3' ))
(( segid A and resid 33 and name H5 ))
3.790 1.440 1.440 peak 69 spectrum 1 weight 0.11000E+01 volume 0.53355E-03 ppm1 4.461 ppm2 6.054 CV 1
ASSI { 70}
(( segid A and resid 25 and name H4' ))
(( segid A and resid 25 and name H1' ))
2.910 0.850 0.850 peak 70 spectrum 1 weight 0.11000E+01 volume 0.25183E-02 ppm1 4.466 ppm2 5.946 CV 1
ASSI { 73}
(( segid A and resid 44 and name H5'#))
(( segid A and resid 44 and name H8 ))
2.930 0.860 0.860 peak 73 spectrum 1 weight 0.11000E+01 volume 0.21213E-02 ppm1 4.473 ppm2 7.138 CV 1
ASSI { 74}
(( segid A and resid 28 and name H2' ))
(( segid A and resid 29 and name H6 ))
2.130 0.450 0.450 peak 74 spectrum 1 weight 0.11000E+01 volume 0.92009E-02 ppm1 4.488 ppm2 7.383 CV 1
ASSI { 76}
(( segid A and resid 17 and name H3' ))
(( segid A and resid 17 and name H8 ))
2.510 0.630 0.630 peak 76 spectrum 1 weight 0.11000E+01 volume 0.50150E-02 ppm1 4.494 ppm2 7.435 CV 1
ASSI { 77}
(( segid A and resid 19 and name H2' ))
(( segid A and resid 20 and name H8 ))
2.210 0.490 0.490 peak 77 spectrum 1 weight 0.11000E+01 volume 0.82222E-02 ppm1 4.504 ppm2 7.854 CV 1
ASSI { 78}
(( segid A and resid 27 and name H4' ))
(( segid A and resid 27 and name H1' ))
2.860 0.820 0.820 peak 78 spectrum 1 weight 0.11000E+01 volume 0.25192E-02 ppm1 4.535 ppm2 5.969 CV 1
ASSI { 79}
(( segid A and resid 22 and name H3' ))
(( segid A and resid 22 and name H1' ))
3.100 0.960 0.960 peak 79 spectrum 1 weight 0.11000E+01 volume 0.26489E-02 ppm1 4.537 ppm2 5.884 CV 1
ASSI { 80}
(( segid A and resid 43 and name H2' ))
(( segid A and resid 43 and name H1' ))
2.350 0.550 0.550 peak 80 spectrum 1 weight 0.11000E+01 volume 0.78952E-02 ppm1 4.544 ppm2 5.719 CV 1
ASSI { 84}
(( segid A and resid 17 and name H2' ))
(( segid A and resid 17 and name H1' ))
2.260 0.510 0.510 peak 84 spectrum 1 weight 0.11000E+01 volume 0.96410E-02 ppm1 4.600 ppm2 5.827 CV 1
ASSI { 85}
(( segid A and resid 32 and name H2' ))
(( segid A and resid 32 and name H1' ))
2.690 0.720 0.720 peak 85 spectrum 1 weight 0.11000E+01 volume 0.35625E-02 ppm1 4.604 ppm2 6.026 CV 1
ASSI { 86}
(( segid A and resid 20 and name H2' ))
(( segid A and resid 20 and name H1' ))
2.260 0.510 0.510 peak 86 spectrum 1 weight 0.11000E+01 volume 0.83291E-02 ppm1 4.617 ppm2 5.849 CV 1
ASSI { 87}
(( segid A and resid 20 and name H2' ))
(( segid A and resid 21 and name H8 ))
2.350 0.550 0.550 peak 87 spectrum 1 weight 0.11000E+01 volume 0.45770E-02 ppm1 4.617 ppm2 6.928 CV 1
ASSI { 88}
(( segid A and resid 16 and name H2' ))
(( segid A and resid 17 and name H8 ))
2.200 0.480 0.480 peak 88 spectrum 1 weight 0.11000E+01 volume 0.91737E-02 ppm1 4.644 ppm2 7.436 CV 1
ASSI { 89}
(( segid A and resid 27 and name H2' ))
(( segid A and resid 28 and name H8 ))
2.210 0.490 0.490 peak 89 spectrum 1 weight 0.11000E+01 volume 0.83012E-02 ppm1 4.659 ppm2 7.534 CV 1
ASSI { 90}
(( segid A and resid 27 and name H2' ))
(( segid A and resid 27 and name H1' ))
2.310 0.530 0.530 peak 90 spectrum 1 weight 0.11000E+01 volume 0.76685E-02 ppm1 4.660 ppm2 5.969 CV 1
ASSI { 91}
(( segid A and resid 26 and name H2' ))
(( segid A and resid 26 and name H1' ))
2.430 0.590 0.590 peak 91 spectrum 1 weight 0.10000E+01 volume 0.75217E-02 ppm1 4.901 ppm2 5.831 CV 1
OR { 91}
(( segid A and resid 26 and name H3' ))
(( segid A and resid 26 and name H1' ))
ASSI { 95}
(( segid A and resid 42 and name H5 ))
(( segid A and resid 21 and name H1 ))
4.430 1.960 1.960 peak 95 spectrum 1 weight 0.11000E+01 volume 0.17907E-03 ppm1 5.096 ppm2 12.426 CV 1
ASSI { 96}
(( segid A and resid 42 and name H5 ))
(( segid A and resid 42 and name H3 ))
4.490 2.010 2.010 peak 96 spectrum 1 weight 0.11000E+01 volume 0.15060E-03 ppm1 5.098 ppm2 13.245 CV 1
ASSI { 97}
(( segid A and resid 29 and name H5 ))
(( segid A and resid 31 and name H5 ))
2.900 0.840 0.840 peak 97 spectrum 1 weight 0.11000E+01 volume 0.22475E-02 ppm1 5.130 ppm2 5.623 CV 1
ASSI { 98}
(( segid A and resid 29 and name H5 ))
(( segid A and resid 36 and name H1 ))
5.090 2.590 1.410 peak 98 spectrum 1 weight 0.11000E+01 volume 0.11172E-03 ppm1 5.132 ppm2 13.332 CV 1
ASSI { 100}
(( segid A and resid 29 and name H5 ))
(( segid A and resid 29 and name H42 ))
4.090 1.670 1.670 peak 100 spectrum 1 weight 0.11000E+01 volume 0.13328E-02 ppm1 5.134 ppm2 8.399 CV 1
ASSI { 102}
(( segid A and resid 37 and name H5 ))
(( segid A and resid 37 and name H41 ))
2.790 0.780 0.780 peak 102 spectrum 1 weight 0.11000E+01 volume 0.20169E-02 ppm1 5.156 ppm2 6.714 CV 1
ASSI { 103}
(( segid A and resid 37 and name H5 ))
(( segid A and resid 37 and name H6 ))
2.530 0.640 0.640 peak 103 spectrum 1 weight 0.11000E+01 volume 0.47162E-02 ppm1 5.161 ppm2 7.745 CV 1
ASSI { 104}
(( segid A and resid 37 and name H5 ))
(( segid A and resid 37 and name H42 ))
4.120 1.690 1.690 peak 104 spectrum 1 weight 0.11000E+01 volume 0.11872E-02 ppm1 5.161 ppm2 8.829 CV 1
ASSI { 107}
(( segid A and resid 39 and name H1' ))
(( segid A and resid 38 and name H3 ))
3.570 1.270 1.270 peak 107 spectrum 1 weight 0.11000E+01 volume 0.69893E-03 ppm1 5.199 ppm2 14.181 CV 1
ASSI { 108}
(( segid A and resid 45 and name H5 ))
(( segid A and resid 44 and name H8 ))
3.220 1.040 1.040 peak 108 spectrum 1 weight 0.11000E+01 volume 0.14440E-02 ppm1 5.274 ppm2 7.139 CV 1
ASSI { 109}
(( segid A and resid 45 and name H5 ))
(( segid A and resid 45 and name H6 ))
2.240 0.500 0.500 peak 109 spectrum 1 weight 0.11000E+01 volume 0.89511E-02 ppm1 5.274 ppm2 7.706 CV 1
ASSI { 110}
(( segid A and resid 42 and name H1' ))
(( segid A and resid 42 and name H6 ))
3.020 0.910 0.910 peak 110 spectrum 1 weight 0.11000E+01 volume 0.13535E-02 ppm1 5.352 ppm2 7.732 CV 1
ASSI { 111}
(( segid A and resid 42 and name H1' ))
(( segid A and resid 21 and name H1 ))
4.960 2.460 1.540 peak 111 spectrum 1 weight 0.11000E+01 volume 0.42335E-03 ppm1 5.352 ppm2 12.426 CV 1
ASSI { 112}
(( segid A and resid 42 and name H1' ))
(( segid A and resid 42 and name H3 ))
4.580 2.100 1.920 peak 112 spectrum 1 weight 0.11000E+01 volume 0.12538E-03 ppm1 5.352 ppm2 13.245 CV 1
ASSI { 113}
(( segid A and resid 42 and name H1' ))
(( segid A and resid 43 and name H8 ))
3.980 1.580 1.580 peak 113 spectrum 1 weight 0.11000E+01 volume 0.18630E-02 ppm1 5.353 ppm2 7.654 CV 1
ASSI { 115}
(( segid A and resid 18 and name H5 ))
(( segid A and resid 18 and name H41 ))
2.540 0.640 0.640 peak 115 spectrum 1 weight 0.11000E+01 volume 0.35756E-02 ppm1 5.399 ppm2 6.830 CV 1
ASSI { 117}
(( segid A and resid 18 and name H5 ))
(( segid A and resid 18 and name H42 ))
3.920 1.540 1.540 peak 117 spectrum 1 weight 0.11000E+01 volume 0.17295E-02 ppm1 5.399 ppm2 8.361 CV 1
ASSI { 119}
(( segid A and resid 38 and name H5 ))
(( segid A and resid 38 and name H3 ))
3.950 1.560 1.560 peak 119 spectrum 1 weight 0.11000E+01 volume 0.39822E-03 ppm1 5.400 ppm2 14.181 CV 1
ASSI { 121}
(( segid A and resid 40 and name H5 ))
(( segid A and resid 40 and name H6 ))
2.300 0.530 0.530 peak 121 spectrum 1 weight 0.10000E+01 volume 0.77398E-02 ppm1 5.406 ppm2 7.938 CV 1
OR { 121}
(( segid A and resid 40 and name H1' ))
(( segid A and resid 40 and name H6 ))
ASSI { 122}
(( segid A and resid 40 and name H1' ))
(( segid A and resid 26 and name H1 ))
3.620 1.310 1.310 peak 122 spectrum 1 weight 0.11000E+01 volume 0.14940E-02 ppm1 5.409 ppm2 12.497 CV 1
ASSI { 123}
(( segid A and resid 45 and name H1' ))
(( segid A and resid 17 and name H1 ))
4.410 1.940 1.940 peak 123 spectrum 1 weight 0.11000E+01 volume 0.22846E-03 ppm1 5.412 ppm2 11.534 CV 1
ASSI { 127}
(( segid A and resid 19 and name H5 ))
(( segid A and resid 19 and name H41 ))
2.510 0.630 0.630 peak 127 spectrum 1 weight 0.11000E+01 volume 0.37669E-02 ppm1 5.423 ppm2 6.777 CV 1
ASSI { 129}
(( segid A and resid 21 and name H1' ))
(( segid A and resid 20 and name H2 ))
2.470 0.610 0.610 peak 129 spectrum 1 weight 0.11000E+01 volume 0.44599E-02 ppm1 5.424 ppm2 6.810 CV 1
ASSI { 130}
(( segid A and resid 21 and name H1' ))
(( segid A and resid 21 and name H8 ))
3.190 1.020 1.020 peak 130 spectrum 1 weight 0.11000E+01 volume 0.12363E-02 ppm1 5.424 ppm2 6.924 CV 1
ASSI { 131}
(( segid A and resid 21 and name H1' ))
(( segid A and resid 42 and name H3 ))
4.970 2.470 1.530 peak 131 spectrum 1 weight 0.11000E+01 volume 0.17784E-03 ppm1 5.424 ppm2 13.245 CV 1
ASSI { 132}
(( segid A and resid 18 and name H1' ))
(( segid A and resid 17 and name H1 ))
4.180 1.750 1.750 peak 132 spectrum 1 weight 0.11000E+01 volume 0.53362E-03 ppm1 5.440 ppm2 11.531 CV 1
ASSI { 135}
(( segid A and resid 37 and name H1' ))
(( segid A and resid 37 and name H6 ))
3.030 0.920 0.920 peak 135 spectrum 1 weight 0.11000E+01 volume 0.18191E-02 ppm1 5.492 ppm2 7.744 CV 1
ASSI { 136}
(( segid A and resid 37 and name H1' ))
(( segid A and resid 36 and name H1 ))
3.290 1.080 2.080 peak 136 spectrum 1 weight 0.11000E+01 volume 0.27317E-03 ppm1 5.492 ppm2 13.332 CV 1
ASSI { 137}
(( segid A and resid 37 and name H1' ))
(( segid A and resid 38 and name H6 ))
4.320 1.870 1.870 peak 137 spectrum 1 weight 0.11000E+01 volume 0.11896E-02 ppm1 5.493 ppm2 7.856 CV 1
ASSI { 138}
(( segid A and resid 39 and name H5 ))
(( segid A and resid 26 and name H1 ))
4.730 2.240 1.770 peak 138 spectrum 1 weight 0.11000E+01 volume 0.26911E-03 ppm1 5.540 ppm2 12.499 CV 1
ASSI { 142}
(( segid A and resid 39 and name H5 ))
(( segid A and resid 38 and name H3 ))
4.320 1.860 1.860 peak 142 spectrum 1 weight 0.11000E+01 volume 0.23767E-03 ppm1 5.541 ppm2 14.180 CV 1
ASSI { 143}
(( segid A and resid 34 and name H3' ))
(( segid A and resid 36 and name H8 ))
3.280 1.080 1.080 peak 143 spectrum 1 weight 0.11000E+01 volume 0.10318E-02 ppm1 5.546 ppm2 8.230 CV 1
ASSI { 144}
(( segid A and resid 46 and name H5 ))
(( segid A and resid 45 and name H3 ))
4.930 2.430 1.570 peak 144 spectrum 1 weight 0.11000E+01 volume 0.11769E-03 ppm1 5.570 ppm2 12.137 CV 1
ASSI { 145}
(( segid A and resid 46 and name H5 ))
(( segid A and resid 46 and name H6 ))
2.230 0.500 0.500 peak 145 spectrum 1 weight 0.11000E+01 volume 0.87271E-02 ppm1 5.571 ppm2 7.727 CV 1
ASSI { 146}
(( segid A and resid 46 and name H5 ))
(( segid A and resid 17 and name H1 ))
5.120 2.620 1.380 peak 146 spectrum 1 weight 0.11000E+01 volume 0.96237E-04 ppm1 5.571 ppm2 11.531 CV 1
ASSI { 147}
(( segid A and resid 46 and name H5 ))
(( segid A and resid 46 and name H41 ))
2.640 0.700 0.700 peak 147 spectrum 1 weight 0.11000E+01 volume 0.27475E-02 ppm1 5.572 ppm2 6.803 CV 1
ASSI { 151}
(( segid A and resid 41 and name H5 ))
(( segid A and resid 40 and name H6 ))
3.320 1.100 1.100 peak 151 spectrum 1 weight 0.11000E+01 volume 0.95765E-03 ppm1 5.603 ppm2 7.939 CV 1
ASSI { 152}
(( segid A and resid 44 and name H1' ))
(( segid A and resid 43 and name H1 ))
3.960 1.570 1.570 peak 152 spectrum 1 weight 0.11000E+01 volume 0.75496E-03 ppm1 5.607 ppm2 11.970 CV 1
ASSI { 153}
(( segid A and resid 44 and name H1' ))
(( segid A and resid 44 and name H8 ))
3.140 0.990 0.990 peak 153 spectrum 1 weight 0.11000E+01 volume 0.15602E-02 ppm1 5.608 ppm2 7.138 CV 1
ASSI { 154}
(( segid A and resid 31 and name H1' ))
(( segid A and resid 36 and name H1 ))
3.980 1.580 1.580 peak 154 spectrum 1 weight 0.11000E+01 volume 0.51153E-03 ppm1 5.610 ppm2 13.333 CV 1
ASSI { 155}
(( segid A and resid 31 and name H5 ))
(( segid A and resid 29 and name H42 ))
4.040 1.630 1.630 peak 155 spectrum 1 weight 0.11000E+01 volume 0.31682E-03 ppm1 5.618 ppm2 8.397 CV 1
ASSI { 156}
(( segid A and resid 31 and name H5 ))
(( segid A and resid 31 and name H6 ))
2.280 0.520 0.520 peak 156 spectrum 1 weight 0.10000E+01 volume 0.96282E-02 ppm1 5.619 ppm2 7.708 CV 1
OR { 156}
(( segid A and resid 31 and name H1' ))
(( segid A and resid 31 and name H6 ))
ASSI { 157}
(( segid A and resid 31 and name H5 ))
(( segid A and resid 29 and name H6 ))
3.210 1.030 1.030 peak 157 spectrum 1 weight 0.10000E+01 volume 0.11513E-02 ppm1 5.620 ppm2 7.390 CV 1
ASSI { 158}
(( segid A and resid 38 and name H1' ))
(( segid A and resid 38 and name H3 ))
4.690 2.200 1.810 peak 158 spectrum 1 weight 0.11000E+01 volume 0.15272E-03 ppm1 5.621 ppm2 14.181 CV 1
ASSI { 159}
(( segid A and resid 38 and name H1' ))
(( segid A and resid 28 and name H1 ))
4.600 2.120 1.900 peak 159 spectrum 1 weight 0.11000E+01 volume 0.47190E-03 ppm1 5.624 ppm2 13.568 CV 1
ASSI { 160}
(( segid A and resid 16 and name H1' ))
(( segid A and resid 17 and name H8 ))
4.470 2.000 2.000 peak 160 spectrum 1 weight 0.11000E+01 volume 0.95617E-03 ppm1 5.682 ppm2 7.435 CV 1
ASSI { 161}
(( segid A and resid 16 and name H1' ))
(( segid A and resid 16 and name H8 ))
3.470 1.210 1.210 peak 161 spectrum 1 weight 0.11000E+01 volume 0.87781E-03 ppm1 5.682 ppm2 7.987 CV 1
ASSI { 162}
(( segid A and resid 43 and name H1' ))
(( segid A and resid 44 and name H8 ))
3.780 1.430 1.430 peak 162 spectrum 1 weight 0.11000E+01 volume 0.16183E-02 ppm1 5.716 ppm2 7.139 CV 1
ASSI { 163}
(( segid A and resid 43 and name H1' ))
(( segid A and resid 42 and name H3 ))
4.800 2.300 1.700 peak 163 spectrum 1 weight 0.11000E+01 volume 0.10667E-03 ppm1 5.716 ppm2 13.238 CV 1
ASSI { 164}
(( segid A and resid 43 and name H1' ))
(( segid A and resid 20 and name H2 ))
2.930 0.860 0.860 peak 164 spectrum 1 weight 0.11000E+01 volume 0.19518E-02 ppm1 5.717 ppm2 6.811 CV 1
ASSI { 165}
(( segid A and resid 43 and name H1' ))
(( segid A and resid 43 and name H1 ))
4.280 1.840 1.840 peak 165 spectrum 1 weight 0.11000E+01 volume 0.31006E-03 ppm1 5.718 ppm2 11.972 CV 1
ASSI { 168}
(( segid A and resid 23 and name H1' ))
(( segid A and resid 26 and name H8 ))
2.870 0.820 0.820 peak 168 spectrum 1 weight 0.11000E+01 volume 0.27491E-02 ppm1 5.778 ppm2 7.688 CV 1
ASSI { 169}
(( segid A and resid 32 and name H5 ))
(( segid A and resid 32 and name H6 ))
2.360 0.560 0.560 peak 169 spectrum 1 weight 0.11000E+01 volume 0.82267E-02 ppm1 5.802 ppm2 7.957 CV 1
ASSI { 171}
(( segid A and resid 28 and name H1' ))
(( segid A and resid 38 and name H3 ))
5.610 3.150 0.890 peak 171 spectrum 1 weight 0.11000E+01 volume 0.72408E-04 ppm1 5.816 ppm2 14.181 CV 1
ASSI { 172}
(( segid A and resid 28 and name H1' ))
(( segid A and resid 28 and name H8 ))
3.250 1.060 1.060 peak 172 spectrum 1 weight 0.11000E+01 volume 0.12405E-02 ppm1 5.817 ppm2 7.535 CV 1
ASSI { 173}
(( segid A and resid 17 and name H1' ))
(( segid A and resid 17 and name H8 ))
3.080 0.950 0.950 peak 173 spectrum 1 weight 0.11000E+01 volume 0.16302E-02 ppm1 5.825 ppm2 7.436 CV 1
ASSI { 174}
(( segid A and resid 26 and name H1' ))
(( segid A and resid 26 and name H8 ))
2.770 0.770 0.770 peak 174 spectrum 1 weight 0.11000E+01 volume 0.34222E-02 ppm1 5.828 ppm2 7.683 CV 1
ASSI { 177}
(( segid A and resid 20 and name H1' ))
(( segid A and resid 43 and name H1 ))
4.150 1.720 1.720 peak 177 spectrum 1 weight 0.11000E+01 volume 0.91251E-03 ppm1 5.850 ppm2 11.970 CV 1
ASSI { 180}
(( segid A and resid 25 and name H1' ))
(( segid A and resid 25 and name H6 ))
3.050 0.930 0.930 peak 180 spectrum 1 weight 0.11000E+01 volume 0.21112E-02 ppm1 5.946 ppm2 7.801 CV 1
ASSI { 181}
(( segid A and resid 27 and name H1' ))
(( segid A and resid 26 and name H1 ))
4.640 2.160 1.860 peak 181 spectrum 1 weight 0.11000E+01 volume 0.66436E-03 ppm1 5.970 ppm2 12.497 CV 1
ASSI { 182}
(( segid A and resid 27 and name H1' ))
(( segid A and resid 28 and name H8 ))
4.170 1.740 1.740 peak 182 spectrum 1 weight 0.11000E+01 volume 0.12423E-02 ppm1 5.971 ppm2 7.535 CV 1
ASSI { 183}
(( segid A and resid 27 and name H1' ))
(( segid A and resid 27 and name H8 ))
3.180 1.010 1.010 peak 183 spectrum 1 weight 0.11000E+01 volume 0.14171E-02 ppm1 5.971 ppm2 7.713 CV 1
ASSI { 184}
(( segid A and resid 27 and name H1' ))
(( segid A and resid 27 and name H2 ))
3.880 1.500 1.500 peak 184 spectrum 1 weight 0.11000E+01 volume 0.49588E-03 ppm1 5.972 ppm2 7.394 CV 1
ASSI { 185}
(( segid A and resid 27 and name H1' ))
(( segid A and resid 26 and name H22 ))
5.070 2.570 1.430 peak 185 spectrum 1 weight 0.11000E+01 volume 0.30342E-03 ppm1 5.972 ppm2 7.978 CV 1
ASSI { 186}
(( segid A and resid 32 and name H1' ))
(( segid A and resid 32 and name H6 ))
3.270 1.070 1.070 peak 186 spectrum 1 weight 0.11000E+01 volume 0.13002E-02 ppm1 6.024 ppm2 7.954 CV 1
ASSI { 187}
(( segid A and resid 33 and name H5 ))
(( segid A and resid 33 and name H6 ))
2.420 0.580 0.580 peak 187 spectrum 1 weight 0.11000E+01 volume 0.48692E-02 ppm1 6.054 ppm2 7.626 CV 1
ASSI { 188}
(( segid A and resid 33 and name H5 ))
(( segid A and resid 31 and name H6 ))
3.230 1.050 2.050 peak 188 spectrum 1 weight 0.11000E+01 volume 0.30458E-03 ppm1 6.054 ppm2 7.707 CV 1
ASSI { 189}
(( segid A and resid 33 and name H5 ))
(( segid A and resid 33 and name H1' ))
3.530 1.250 2.250 peak 189 spectrum 1 weight 0.11000E+01 volume 0.10871E-02 ppm1 6.056 ppm2 5.874 CV 1
ASSI { 191}
(( segid A and resid 17 and name H22 ))
(( segid A and resid 45 and name H3 ))
6.410 4.110 0.090 peak 191 spectrum 1 weight 0.11000E+01 volume 0.11121E-03 ppm1 6.207 ppm2 12.141 CV 1
OR { 191}
(( segid A and resid 17 and name H21 ))
(( segid A and resid 45 and name H3 ))
ASSI { 192}
(( segid A and resid 17 and name H22 ))
(( segid A and resid 44 and name H1 ))
4.380 1.920 1.920 peak 192 spectrum 1 weight 0.11000E+01 volume 0.28187E-03 ppm1 6.210 ppm2 13.345 CV 1
OR { 192}
(( segid A and resid 17 and name H21 ))
(( segid A and resid 44 and name H1 ))
ASSI { 195}
(( segid A and resid 17 and name H22 ))
(( segid A and resid 46 and name H6 ))
4.150 1.720 1.720 peak 195 spectrum 1 weight 0.11000E+01 volume 0.36242E-03 ppm1 6.213 ppm2 7.726 CV 1
OR { 195}
(( segid A and resid 17 and name H21 ))
(( segid A and resid 46 and name H6 ))
ASSI { 196}
(( segid A and resid 29 and name H41 ))
(( segid A and resid 29 and name H6 ))
4.770 2.270 1.730 peak 196 spectrum 1 weight 0.11000E+01 volume 0.41332E-03 ppm1 6.707 ppm2 7.384 CV 1
ASSI { 198}
(( segid A and resid 29 and name H41 ))
(( segid A and resid 36 and name H1 ))
4.020 1.620 1.620 peak 198 spectrum 1 weight 0.10000E+01 volume 0.67184E-03 ppm1 6.712 ppm2 13.334 CV 1
ASSI { 203}
(( segid A and resid 19 and name H41 ))
(( segid A and resid 19 and name H6 ))
4.020 1.620 1.620 peak 203 spectrum 1 weight 0.11000E+01 volume 0.99056E-03 ppm1 6.772 ppm2 7.678 CV 1
ASSI { 205}
(( segid A and resid 18 and name H41 ))
(( segid A and resid 45 and name H3 ))
5.370 2.890 1.130 peak 205 spectrum 1 weight 0.11000E+01 volume 0.12099E-03 ppm1 6.802 ppm2 12.142 CV 1
ASSI { 207}
(( segid A and resid 20 and name H2 ))
(( segid A and resid 21 and name H1 ))
4.620 2.130 1.880 peak 207 spectrum 1 weight 0.11000E+01 volume 0.17100E-03 ppm1 6.810 ppm2 12.418 CV 1
ASSI { 208}
(( segid A and resid 20 and name H2 ))
(( segid A and resid 42 and name H3 ))
2.520 0.640 0.640 peak 208 spectrum 1 weight 0.11000E+01 volume 0.36752E-02 ppm1 6.811 ppm2 13.245 CV 1
ASSI { 209}
(( segid A and resid 18 and name H41 ))
(( segid A and resid 18 and name H6 ))
4.160 1.730 1.730 peak 209 spectrum 1 weight 0.11000E+01 volume 0.92068E-03 ppm1 6.822 ppm2 7.670 CV 1
ASSI { 212}
(( segid A and resid 41 and name H41 ))
(( segid A and resid 41 and name H6 ))
4.720 2.230 1.780 peak 212 spectrum 1 weight 0.11000E+01 volume 0.43747E-03 ppm1 6.902 ppm2 7.835 CV 1
ASSI { 215}
(( segid A and resid 39 and name H41 ))
(( segid A and resid 40 and name H3 ))
5.340 2.850 1.160 peak 215 spectrum 1 weight 0.11000E+01 volume 0.15176E-03 ppm1 7.033 ppm2 13.938 CV 1
ASSI { 216}
(( segid A and resid 39 and name H41 ))
(( segid A and resid 26 and name H1 ))
4.270 1.820 1.820 peak 216 spectrum 1 weight 0.11000E+01 volume 0.10636E-02 ppm1 7.038 ppm2 12.498 CV 1
ASSI { 218}
(( segid A and resid 22 and name H2 ))
(( segid A and resid 26 and name H22 ))
4.520 2.040 1.980 peak 218 spectrum 1 weight 0.11000E+01 volume 0.25448E-03 ppm1 7.050 ppm2 7.989 CV 1
ASSI { 220}
(( segid A and resid 22 and name H2 ))
(( segid A and resid 21 and name H1 ))
4.340 1.880 1.880 peak 220 spectrum 1 weight 0.11000E+01 volume 0.28507E-03 ppm1 7.062 ppm2 12.426 CV 1
ASSI { 221}
(( segid A and resid 44 and name H8 ))
(( segid A and resid 45 and name H6 ))
3.960 1.570 1.570 peak 221 spectrum 1 weight 0.11000E+01 volume 0.87209E-03 ppm1 7.142 ppm2 7.703 CV 1
ASSI { 223}
(( segid A and resid 27 and name H2 ))
(( segid A and resid 28 and name H1 ))
4.070 1.660 1.660 peak 223 spectrum 1 weight 0.11000E+01 volume 0.39667E-03 ppm1 7.395 ppm2 13.564 CV 1
ASSI { 224}
(( segid A and resid 27 and name H2 ))
(( segid A and resid 38 and name H3 ))
2.670 0.710 0.710 peak 224 spectrum 1 weight 0.11000E+01 volume 0.39833E-02 ppm1 7.396 ppm2 14.181 CV 1
ASSI { 225}
(( segid A and resid 27 and name H2 ))
(( segid A and resid 26 and name H1 ))
4.710 2.220 1.790 peak 225 spectrum 1 weight 0.11000E+01 volume 0.18855E-03 ppm1 7.397 ppm2 12.498 CV 1
ASSI { 226}
(( segid A and resid 43 and name H8 ))
(( segid A and resid 43 and name H1' ))
3.000 0.900 0.900 peak 226 spectrum 1 weight 0.11000E+01 volume 0.17328E-02 ppm1 7.647 ppm2 5.719 CV 1
ASSI { 227}
(( segid A and resid 43 and name H8 ))
(( segid A and resid 42 and name H3 ))
4.280 1.830 1.830 peak 227 spectrum 1 weight 0.11000E+01 volume 0.13460E-03 ppm1 7.649 ppm2 13.247 CV 1
ASSI { 230}
(( segid A and resid 21 and name H22 ))
(( segid A and resid 42 and name H3 ))
4.670 2.180 1.830 peak 230 spectrum 1 weight 0.11000E+01 volume 0.11015E-03 ppm1 7.732 ppm2 13.249 CV 1
ASSI { 231}
(( segid A and resid 21 and name H22 ))
(( segid A and resid 21 and name H1 ))
3.400 1.150 1.150 peak 231 spectrum 1 weight 0.11000E+01 volume 0.48117E-03 ppm1 7.734 ppm2 12.426 CV 1
ASSI { 233}
(( segid A and resid 40 and name H6 ))
(( segid A and resid 39 and name H6 ))
3.850 1.480 1.480 peak 233 spectrum 1 weight 0.11000E+01 volume 0.71753E-03 ppm1 7.936 ppm2 7.403 CV 1
ASSI { 234}
(( segid A and resid 26 and name H22 ))
(( segid A and resid 26 and name H1 ))
2.990 0.890 0.890 peak 234 spectrum 1 weight 0.11000E+01 volume 0.11688E-02 ppm1 7.982 ppm2 12.497 CV 1
ASSI { 235}
(( segid A and resid 27 and name H62 ))
(( segid A and resid 27 and name H2 ))
3.990 1.590 1.590 peak 235 spectrum 1 weight 0.11000E+01 volume 0.55736E-03 ppm1 7.995 ppm2 7.396 CV 1
OR { 235}
(( segid A and resid 27 and name H61 ))
(( segid A and resid 27 and name H2 ))
ASSI { 236}
(( segid A and resid 27 and name H62 ))
(( segid A and resid 37 and name H42 ))
4.330 1.870 1.870 peak 236 spectrum 1 weight 0.11000E+01 volume 0.20814E-03 ppm1 8.000 ppm2 8.832 CV 1
OR { 236}
(( segid A and resid 27 and name H61 ))
(( segid A and resid 37 and name H42 ))
ASSI { 237}
(( segid A and resid 27 and name H62 ))
(( segid A and resid 39 and name H42 ))
3.780 1.430 1.430 peak 237 spectrum 1 weight 0.11000E+01 volume 0.48827E-03 ppm1 8.002 ppm2 8.366 CV 1
OR { 237}
(( segid A and resid 27 and name H61 ))
(( segid A and resid 39 and name H42 ))
ASSI { 239}
(( segid A and resid 41 and name H42 ))
(( segid A and resid 21 and name H1 ))
2.830 0.800 0.800 peak 239 spectrum 1 weight 0.11000E+01 volume 0.13392E-02 ppm1 8.229 ppm2 12.427 CV 1
ASSI { 241}
(( segid A and resid 19 and name H42 ))
(( segid A and resid 44 and name H1 ))
3.860 1.490 1.490 peak 241 spectrum 1 weight 0.11000E+01 volume 0.43127E-03 ppm1 8.269 ppm2 13.345 CV 1
ASSI { 242}
(( segid A and resid 46 and name H42 ))
(( segid A and resid 46 and name H41 ))
2.380 0.570 0.570 peak 242 spectrum 1 weight 0.11000E+01 volume 0.32360E-02 ppm1 8.307 ppm2 6.805 CV 1
ASSI { 244}
(( segid A and resid 39 and name H42 ))
(( segid A and resid 26 and name H1 ))
2.920 0.850 0.850 peak 244 spectrum 1 weight 0.11000E+01 volume 0.15820E-02 ppm1 8.368 ppm2 12.498 CV 1
ASSI { 246}
(( segid A and resid 37 and name H42 ))
(( segid A and resid 28 and name H1 ))
2.900 0.840 0.840 peak 246 spectrum 1 weight 0.10000E+01 volume 0.11404E-02 ppm1 8.829 ppm2 13.569 CV 1
ASSI { 247}
(( segid A and resid 37 and name H42 ))
(( segid A and resid 38 and name H3 ))
5.020 2.520 1.480 peak 247 spectrum 1 weight 0.11000E+01 volume 0.13251E-03 ppm1 8.829 ppm2 14.177 CV 1
ASSI { 249}
(( segid A and resid 17 and name H1 ))
(( segid A and resid 45 and name H3 ))
3.860 1.490 1.490 peak 249 spectrum 1 weight 0.11000E+01 volume 0.36297E-03 ppm1 11.533 ppm2 12.138 CV 1
ASSI { 251}
(( segid A and resid 17 and name H1 ))
(( segid A and resid 44 and name H1 ))
4.260 1.820 1.820 peak 251 spectrum 1 weight 0.11000E+01 volume 0.23057E-03 ppm1 11.536 ppm2 13.347 CV 1
ASSI { 252}
(( segid A and resid 43 and name H1 ))
(( segid A and resid 44 and name H1 ))
4.250 1.800 1.800 peak 252 spectrum 1 weight 0.11000E+01 volume 0.23367E-03 ppm1 11.974 ppm2 13.343 CV 1
ASSI { 254}
(( segid A and resid 21 and name H1 ))
(( segid A and resid 42 and name H3 ))
4.070 1.660 1.660 peak 254 spectrum 1 weight 0.11000E+01 volume 0.23491E-03 ppm1 12.425 ppm2 13.244 CV 1
ASSI { 255}
(( segid A and resid 26 and name H1 ))
(( segid A and resid 38 and name H3 ))
5.200 2.700 1.300 peak 255 spectrum 1 weight 0.11000E+01 volume 0.83897E-04 ppm1 12.488 ppm2 14.181 CV 1
ASSI { 258}
(( segid A and resid 36 and name H1 ))
(( segid A and resid 28 and name H1 ))
3.840 1.470 1.470 peak 258 spectrum 1 weight 0.11000E+01 volume 0.37958E-03 ppm1 13.329 ppm2 13.569 CV 1
ASSI { 260}
(( segid A and resid 36 and name H1 ))
(( segid A and resid 31 and name H5 ))
3.420 1.170 1.170 peak 260 spectrum 1 weight 0.10000E+01 volume 0.89132E-03 ppm1 13.336 ppm2 5.615 CV 1
OR { 260}
(( segid A and resid 36 and name H1 ))
(( segid A and resid 31 and name H1' ))
ASSI { 262}
(( segid A and resid 44 and name H1 ))
(( segid A and resid 19 and name H6 ))
4.030 1.620 1.620 peak 262 spectrum 1 weight 0.11000E+01 volume 0.39109E-03 ppm1 13.349 ppm2 7.681 CV 1
ASSI { 263}
(( segid A and resid 28 and name H1 ))
(( segid A and resid 38 and name H3 ))
3.740 1.400 1.400 peak 263 spectrum 1 weight 0.11000E+01 volume 0.45770E-03 ppm1 13.569 ppm2 14.181 CV 1
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