NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
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550070 |
2lri   |
18374 | cing | 1-original | 2 | XPLOR/CNS | distance | NOE | ambi |
assign (segid " C" and resid 41 and name HB1) (segid " C" and resid 41 and name HA) 2.212 0.611 0.611 weight 1.000 ! spec=13C_...nD2O, no=1, id=327, vol=5.115617e+08
assign (segid " C" and resid 34 and name HD1) (segid " C" and resid 34 and name HB1) 2.765 0.956 0.956 weight 1.000 ! spec=13C_...nD2O, no=2, id=795, vol=2.433336e+08
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 34 and name HB1)
assign (segid " C" and resid 34 and name HD1) (segid " C" and resid 34 and name HB2) 2.890 1.044 1.044 weight 1.000 ! spec=13C_...nD2O, no=3, id=796, vol=1.778679e+08
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 34 and name HB2)
assign (segid " C" and resid 34 and name HD1) (segid " C" and resid 34 and name HA) 3.886 1.888 1.888 weight 1.000 ! spec=13C_...nD2O, no=4, id=797, vol=5.761466e+07
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 34 and name HA)
assign (segid " C" and resid 40 and name HB2) (segid " C" and resid 40 and name HB1) 1.967 0.484 0.484 weight 1.000 ! spec=13C_...nD2O, no=7, id=330, vol=4.978527e+08
assign (segid " C" and resid 40 and name HE2) (segid " C" and resid 40 and name HZ) 2.652 0.879 0.879 weight 1.000 ! spec=13C_...nD2O, no=9, id=798, vol=3.288243e+08
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 40 and name HZ)
assign (segid " C" and resid 40 and name HA) (segid " C" and resid 40 and name HD2) 3.821 1.825 1.825 weight 1.000 ! spec=13C_...nD2O, no=11, id=799, vol=4.171105e+07
or (segid " C" and resid 40 and name HA) (segid " C" and resid 40 and name HD1)
assign (segid " C" and resid 34 and name HA) (segid " C" and resid 34 and name HB1) 2.538 0.805 0.805 weight 1.000 ! spec=13C_...nD2O, no=15, id=338, vol=2.031878e+08
assign (segid " C" and resid 34 and name HA) (segid " C" and resid 34 and name HB2) 2.576 0.830 0.830 weight 1.000 ! spec=13C_...nD2O, no=16, id=339, vol=1.794490e+08
assign (segid " C" and resid 40 and name HA) (segid " C" and resid 40 and name HB2) 2.978 1.109 1.109 weight 1.000 ! spec=13C_...nD2O, no=19, id=342, vol=7.035312e+07
assign (segid " C" and resid 40 and name HA) (segid " C" and resid 40 and name HB1) 3.172 1.258 1.258 weight 1.000 ! spec=13C_...nD2O, no=20, id=343, vol=1.117505e+08
assign (segid " C" and resid 40 and name HD2) (segid " C" and resid 40 and name HB1) 3.152 1.242 1.242 weight 1.000 ! spec=13C_...nD2O, no=21, id=344, vol=1.394113e+08
or (segid " C" and resid 40 and name HD1) (segid " C" and resid 40 and name HB1)
assign (segid " C" and resid 15 and name HB2) (segid " C" and resid 35 and name HE1) 3.423 1.465 1.465 weight 1.000 ! spec=13C_...nD2O, no=25, id=805, vol=5.237316e+07
assign (segid " C" and resid 35 and name HA) (segid " C" and resid 35 and name HB2) 2.834 1.004 1.004 weight 1.000 ! spec=13C_...nD2O, no=29, id=350, vol=9.397457e+07
assign (segid " C" and resid 39 and name HE1) (segid " C" and resid 53 and name HB1) 2.611 0.852 0.852 weight 1.000 ! spec=13C_...nD2O, no=30, id=806, vol=2.034609e+08
assign (segid " C" and resid 39 and name HE1) (segid " C" and resid 53 and name HA) 3.888 1.889 1.889 weight 1.000 ! spec=13C_...nD2O, no=31, id=807, vol=3.878680e+07
assign (segid " C" and resid 40 and name HE2) (segid " C" and resid 39 and name HB2) 3.673 1.686 1.686 weight 1.000 ! spec=13C_...nD2O, no=33, id=354, vol=4.750437e+07
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 39 and name HB2)
assign (segid " C" and resid 39 and name HD2) (segid " C" and resid 39 and name HB2) 3.405 1.449 1.449 weight 1.000 ! spec=13C_...nD2O, no=34, id=355, vol=9.424712e+07
assign (segid " C" and resid 40 and name HD2) (segid " C" and resid 39 and name HB2) 3.819 1.823 1.823 weight 1.000 ! spec=13C_...nD2O, no=35, id=356, vol=4.112099e+07
or (segid " C" and resid 40 and name HD1) (segid " C" and resid 39 and name HB2)
assign (segid " C" and resid 29 and name HB1) (segid " C" and resid 29 and name HD2) 4.216 2.222 2.222 weight 1.000 ! spec=13C_...nD2O, no=36, id=810, vol=2.384472e+07
assign (segid " C" and resid 39 and name HB1) (segid " C" and resid 39 and name HB2) 2.017 0.508 0.508 weight 1.000 ! spec=13C_...nD2O, no=38, id=359, vol=4.526158e+08
assign (segid " C" and resid 29 and name HB2) (segid " C" and resid 29 and name HD2) 3.459 1.496 1.496 weight 1.000 ! spec=13C_...nD2O, no=39, id=812, vol=2.674351e+07
assign (segid " C" and resid 53 and name HA) (segid " C" and resid 34 and name HD1) 4.012 2.012 2.012 weight 1.000 ! spec=13C_...nD2O, no=40, id=813, vol=4.048160e+07
or (segid " C" and resid 53 and name HA) (segid " C" and resid 34 and name HD2)
assign (segid " C" and resid 53 and name HB1) (segid " C" and resid 34 and name HD1) 4.091 2.092 2.092 weight 1.000 ! spec=13C_...nD2O, no=41, id=814, vol=2.635624e+07
or (segid " C" and resid 53 and name HB1) (segid " C" and resid 34 and name HD2)
assign (segid " C" and resid 41 and name HB2) (segid " C" and resid 41 and name HB1) 1.668 0.348 0.348 weight 1.000 ! spec=13C_...nD2O, no=45, id=364, vol=1.332451e+09
assign (segid " C" and resid 34 and name HB1) (segid " C" and resid 34 and name HE2) 4.013 2.013 2.013 weight 1.000 ! spec=13C_...nD2O, no=48, id=818, vol=3.423575e+07
or (segid " C" and resid 34 and name HB1) (segid " C" and resid 34 and name HE1)
assign (segid " C" and resid 36 and name HA) (segid " C" and resid 36 and name HD1) 3.360 1.411 1.411 weight 1.000 ! spec=13C_...nD2O, no=59, id=823, vol=8.265463e+07
assign (segid " C" and resid 36 and name HH2) (segid " C" and resid 36 and name HZ3) 2.669 0.891 0.891 weight 1.000 ! spec=13C_...nD2O, no=63, id=826, vol=1.722774e+08
assign (segid " C" and resid 51 and name HA) (segid " C" and resid 36 and name HZ3) 3.885 1.886 1.886 weight 1.000 ! spec=13C_...nD2O, no=64, id=827, vol=3.043476e+07
assign (segid " C" and resid 36 and name HB1) (segid " C" and resid 36 and name HZ3) 4.260 2.268 2.268 weight 1.000 ! spec=13C_...nD2O, no=65, id=828, vol=3.270171e+07
assign (segid " C" and resid 36 and name HE3) (segid " C" and resid 36 and name HB1) 2.665 0.888 0.888 weight 1.000 ! spec=13C_...nD2O, no=70, id=830, vol=1.190615e+08
assign (segid " C" and resid 25 and name HB1) (segid " C" and resid 36 and name HE3) 2.996 1.122 3.004 weight 1.000 ! spec=13C_...nD2O, no=71, id=831, vol=1.038806e+08
assign (segid " C" and resid 39 and name HD2) (segid " C" and resid 34 and name HB1) 4.022 2.022 2.022 weight 1.000 ! spec=13C_...nD2O, no=72, id=832, vol=1.844933e+07
assign (segid " C" and resid 8 and name HB2) (segid " C" and resid 8 and name HA) 2.813 0.989 0.989 weight 1.000 ! spec=13C_...nD2O, no=73, id=375, vol=1.450935e+08
assign (segid " C" and resid 8 and name HB1) (segid " C" and resid 8 and name HA) 2.873 1.032 1.032 weight 1.000 ! spec=13C_...nD2O, no=74, id=376, vol=1.437886e+08
assign (segid " C" and resid 9 and name HA) (segid " C" and resid 9 and name HB2) 2.737 0.936 0.936 weight 1.000 ! spec=13C_...nD2O, no=78, id=378, vol=1.336178e+08
assign (segid " C" and resid 9 and name HA) (segid " C" and resid 9 and name HB1) 2.922 1.067 1.067 weight 1.000 ! spec=13C_...nD2O, no=79, id=379, vol=1.206425e+08
assign (segid " C" and resid 54 and name HG2) (segid " C" and resid 40 and name HE2) 4.619 2.667 2.667 weight 1.000 ! spec=13C_...nD2O, no=80, id=835, vol=2.281134e+07
or (segid " C" and resid 54 and name HG2) (segid " C" and resid 40 and name HE1)
assign (segid " C" and resid 9 and name HD23) (segid " C" and resid 9 and name HB1) 2.777 0.964 0.964 weight 1.000 ! spec=13C_...nD2O, no=81, id=381, vol=1.399134e+08
or (segid " C" and resid 9 and name HD22) (segid " C" and resid 9 and name HB1)
or (segid " C" and resid 9 and name HD21) (segid " C" and resid 9 and name HB1)
assign (segid " C" and resid 9 and name HD23) (segid " C" and resid 9 and name HA) 3.146 1.237 1.237 weight 1.000 ! spec=13C_...nD2O, no=83, id=383, vol=8.514500e+07
or (segid " C" and resid 9 and name HD22) (segid " C" and resid 9 and name HA)
or (segid " C" and resid 9 and name HD21) (segid " C" and resid 9 and name HA)
assign (segid " C" and resid 9 and name HD13) (segid " C" and resid 9 and name HA) 2.254 0.635 0.635 weight 1.000 ! spec=13C_...nD2O, no=85, id=385, vol=4.134082e+08
or (segid " C" and resid 9 and name HD12) (segid " C" and resid 9 and name HA)
or (segid " C" and resid 9 and name HD11) (segid " C" and resid 9 and name HA)
assign (segid " C" and resid 45 and name HA) (segid " C" and resid 36 and name HZ2) 3.639 1.655 1.655 weight 1.000 ! spec=13C_...nD2O, no=87, id=839, vol=4.246128e+07
assign (segid " C" and resid 11 and name HB1) (segid " C" and resid 11 and name HA) 2.378 0.707 0.707 weight 1.000 ! spec=13C_...nD2O, no=92, id=388, vol=3.956621e+08
assign (segid " C" and resid 21 and name HA2) (segid " C" and resid 14 and name HA) 2.761 0.953 0.953 weight 1.000 ! spec=13C_...nD2O, no=101, id=392, vol=1.535589e+08
assign (segid " C" and resid 10 and name HA) (segid " C" and resid 10 and name HB1) 1.933 0.467 0.467 weight 1.000 ! spec=13C_...nD2O, no=109, id=397, vol=7.993259e+08
or (segid " C" and resid 10 and name HA) (segid " C" and resid 10 and name HB3)
or (segid " C" and resid 10 and name HA) (segid " C" and resid 10 and name HB2)
assign (segid " C" and resid 10 and name HB1) (segid " C" and resid 11 and name HD2) 2.628 0.863 0.863 weight 1.000 ! spec=13C_...nD2O, no=110, id=398, vol=3.326054e+08
or (segid " C" and resid 10 and name HB3) (segid " C" and resid 11 and name HD2)
or (segid " C" and resid 10 and name HB2) (segid " C" and resid 11 and name HD2)
assign (segid " C" and resid 14 and name HB1) (segid " C" and resid 14 and name HA) 2.832 1.002 1.002 weight 1.000 ! spec=13C_...nD2O, no=115, id=401, vol=9.125494e+07
assign (segid " C" and resid 14 and name HB2) (segid " C" and resid 14 and name HA) 3.307 1.367 1.367 weight 1.000 ! spec=13C_...nD2O, no=116, id=402, vol=6.780986e+07
assign (segid " C" and resid 14 and name HG2) (segid " C" and resid 14 and name HA) 2.952 1.089 1.089 weight 1.000 ! spec=13C_...nD2O, no=129, id=408, vol=9.411305e+07
assign (segid " C" and resid 15 and name HB2) (segid " C" and resid 15 and name HA) 2.567 0.824 0.824 weight 1.000 ! spec=13C_...nD2O, no=132, id=410, vol=1.727850e+08
assign (segid " C" and resid 24 and name HG22) (segid " C" and resid 15 and name HA) 3.715 1.725 1.725 weight 1.000 ! spec=13C_...nD2O, no=134, id=411, vol=5.675518e+07
or (segid " C" and resid 24 and name HG23) (segid " C" and resid 15 and name HA)
or (segid " C" and resid 24 and name HG21) (segid " C" and resid 15 and name HA)
assign (segid " C" and resid 34 and name HA) (segid " C" and resid 15 and name HA) 2.630 0.865 0.865 weight 1.000 ! spec=13C_...nD2O, no=135, id=412, vol=1.679674e+08
assign (segid " C" and resid 15 and name HB1) (segid " C" and resid 15 and name HB2) 1.769 0.391 0.391 weight 1.000 ! spec=13C_...nD2O, no=137, id=414, vol=8.072757e+08
assign (segid " C" and resid 15 and name HB1) (segid " C" and resid 15 and name HA) 3.208 1.286 1.286 weight 1.000 ! spec=13C_...nD2O, no=138, id=415, vol=9.859233e+07
assign (segid " C" and resid 24 and name HG22) (segid " C" and resid 15 and name HB1) 3.571 1.594 1.594 weight 1.000 ! spec=13C_...nD2O, no=139, id=416, vol=6.854885e+07
or (segid " C" and resid 24 and name HG23) (segid " C" and resid 15 and name HB1)
or (segid " C" and resid 24 and name HG21) (segid " C" and resid 15 and name HB1)
assign (segid " C" and resid 24 and name HG22) (segid " C" and resid 15 and name HB2) 2.850 1.015 1.015 weight 1.000 ! spec=13C_...nD2O, no=140, id=417, vol=7.960280e+07
or (segid " C" and resid 24 and name HG23) (segid " C" and resid 15 and name HB2)
or (segid " C" and resid 24 and name HG21) (segid " C" and resid 15 and name HB2)
assign (segid " C" and resid 34 and name HA) (segid " C" and resid 15 and name HB2) 2.833 1.003 1.003 weight 1.000 ! spec=13C_...nD2O, no=141, id=418, vol=6.865052e+07
assign (segid " C" and resid 17 and name HB) (segid " C" and resid 17 and name HA) 2.747 0.943 0.943 weight 1.000 ! spec=13C_...nD2O, no=142, id=419, vol=1.407344e+08
assign (segid " C" and resid 18 and name HB1) (segid " C" and resid 18 and name HA) 2.374 0.705 0.705 weight 1.000 ! spec=13C_...nD2O, no=157, id=425, vol=4.562287e+08
assign (segid " C" and resid 18 and name HB2) (segid " C" and resid 18 and name HA) 2.251 0.634 0.634 weight 1.000 ! spec=13C_...nD2O, no=158, id=426, vol=5.910201e+08
assign (segid " C" and resid 17 and name HG13) (segid " C" and resid 18 and name HA) 2.996 1.122 1.122 weight 1.000 ! spec=13C_...nD2O, no=159, id=427, vol=1.374124e+08
or (segid " C" and resid 17 and name HG12) (segid " C" and resid 18 and name HA)
or (segid " C" and resid 17 and name HG11) (segid " C" and resid 18 and name HA)
assign (segid " C" and resid 17 and name HG13) (segid " C" and resid 18 and name HB2) 3.586 1.607 1.607 weight 1.000 ! spec=13C_...nD2O, no=166, id=430, vol=5.482248e+07
or (segid " C" and resid 17 and name HG12) (segid " C" and resid 18 and name HB2)
or (segid " C" and resid 17 and name HG11) (segid " C" and resid 18 and name HB2)
assign (segid " C" and resid 17 and name HG13) (segid " C" and resid 18 and name HB1) 3.904 1.905 1.905 weight 1.000 ! spec=13C_...nD2O, no=168, id=431, vol=3.735809e+07
or (segid " C" and resid 17 and name HG12) (segid " C" and resid 18 and name HB1)
or (segid " C" and resid 17 and name HG11) (segid " C" and resid 18 and name HB1)
assign (segid " C" and resid 19 and name HA1) (segid " C" and resid 19 and name HA2) 1.891 0.447 0.447 weight 1.000 ! spec=13C_...nD2O, no=171, id=433, vol=7.670522e+08
assign (segid " C" and resid 35 and name HE1) (segid " C" and resid 20 and name HA) 4.772 2.846 2.846 weight 1.000 ! spec=13C_...nD2O, no=176, id=436, vol=2.942565e+07
assign (segid " C" and resid 20 and name HB2) (segid " C" and resid 20 and name HA) 2.802 0.981 0.981 weight 1.000 ! spec=13C_...nD2O, no=178, id=437, vol=2.397913e+08
assign (segid " C" and resid 20 and name HB1) (segid " C" and resid 20 and name HA) 2.337 0.683 0.683 weight 1.000 ! spec=13C_...nD2O, no=179, id=438, vol=3.618224e+08
assign (segid " C" and resid 14 and name HG2) (segid " C" and resid 20 and name HA) 3.400 1.445 1.445 weight 1.000 ! spec=13C_...nD2O, no=180, id=439, vol=5.455494e+07
assign (segid " C" and resid 20 and name HB1) (segid " C" and resid 20 and name HB2) 1.818 0.413 0.413 weight 1.000 ! spec=13C_...nD2O, no=181, id=440, vol=8.583934e+08
assign (segid " C" and resid 35 and name HE1) (segid " C" and resid 20 and name HB1) 3.771 1.777 1.777 weight 1.000 ! spec=13C_...nD2O, no=185, id=444, vol=1.061206e+08
assign (segid " C" and resid 35 and name HE1) (segid " C" and resid 20 and name HB2) 2.450 0.750 0.750 weight 1.000 ! spec=13C_...nD2O, no=186, id=445, vol=2.243201e+08
assign (segid " C" and resid 21 and name HA2) (segid " C" and resid 21 and name HA1) 1.784 0.398 0.398 weight 1.000 ! spec=13C_...nD2O, no=188, id=446, vol=9.470554e+08
assign (segid " C" and resid 14 and name HB1) (segid " C" and resid 21 and name HA1) 3.459 1.496 1.496 weight 1.000 ! spec=13C_...nD2O, no=189, id=447, vol=7.947269e+07
assign (segid " C" and resid 24 and name HG13) (segid " C" and resid 21 and name HA1) 3.747 1.755 1.755 weight 1.000 ! spec=13C_...nD2O, no=190, id=448, vol=4.757518e+07
or (segid " C" and resid 24 and name HG12) (segid " C" and resid 21 and name HA1)
or (segid " C" and resid 24 and name HG11) (segid " C" and resid 21 and name HA1)
assign (segid " C" and resid 24 and name HG22) (segid " C" and resid 21 and name HA1) 3.789 1.794 1.794 weight 1.000 ! spec=13C_...nD2O, no=191, id=449, vol=9.773191e+07
or (segid " C" and resid 24 and name HG23) (segid " C" and resid 21 and name HA1)
or (segid " C" and resid 24 and name HG21) (segid " C" and resid 21 and name HA1)
assign (segid " C" and resid 22 and name HA) (segid " C" and resid 22 and name HB) 2.881 1.037 1.037 weight 1.000 ! spec=13C_...nD2O, no=197, id=453, vol=1.205742e+08
assign (segid " C" and resid 22 and name HG23) (segid " C" and resid 22 and name HB) 1.985 0.492 0.492 weight 1.000 ! spec=13C_...nD2O, no=200, id=455, vol=8.543059e+08
or (segid " C" and resid 22 and name HG21) (segid " C" and resid 22 and name HB)
or (segid " C" and resid 22 and name HG22) (segid " C" and resid 22 and name HB)
assign (segid " C" and resid 23 and name HB2) (segid " C" and resid 22 and name HG23) 3.930 1.931 1.931 weight 1.000 ! spec=13C_...nD2O, no=201, id=456, vol=6.747032e+07
or (segid " C" and resid 23 and name HB2) (segid " C" and resid 22 and name HG21)
or (segid " C" and resid 23 and name HB2) (segid " C" and resid 22 and name HG22)
assign (segid " C" and resid 23 and name HB1) (segid " C" and resid 23 and name HA) 2.855 1.019 1.019 weight 1.000 ! spec=13C_...nD2O, no=204, id=457, vol=2.479030e+08
assign (segid " C" and resid 23 and name HB1) (segid " C" and resid 23 and name HB2) 1.872 0.438 0.438 weight 1.000 ! spec=13C_...nD2O, no=205, id=458, vol=9.458920e+08
assign (segid " C" and resid 35 and name HA) (segid " C" and resid 24 and name HA) 3.799 1.804 1.804 weight 1.000 ! spec=13C_...nD2O, no=207, id=460, vol=8.349341e+07
assign (segid " C" and resid 24 and name HB) (segid " C" and resid 24 and name HA) 2.297 0.659 0.659 weight 1.000 ! spec=13C_...nD2O, no=208, id=461, vol=2.977579e+08
assign (segid " C" and resid 24 and name HB) (segid " C" and resid 24 and name HG13) 2.114 0.558 0.558 weight 1.000 ! spec=13C_...nD2O, no=213, id=465, vol=4.172089e+08
or (segid " C" and resid 24 and name HB) (segid " C" and resid 24 and name HG12)
or (segid " C" and resid 24 and name HB) (segid " C" and resid 24 and name HG11)
assign (segid " C" and resid 24 and name HG13) (segid " C" and resid 24 and name HA) 2.700 0.911 0.911 weight 1.000 ! spec=13C_...nD2O, no=218, id=466, vol=2.223704e+08
or (segid " C" and resid 24 and name HG12) (segid " C" and resid 24 and name HA)
or (segid " C" and resid 24 and name HG11) (segid " C" and resid 24 and name HA)
assign (segid " C" and resid 24 and name HG13) (segid " C" and resid 14 and name HA) 3.140 1.232 1.232 weight 1.000 ! spec=13C_...nD2O, no=219, id=467, vol=7.225454e+07
or (segid " C" and resid 24 and name HG12) (segid " C" and resid 14 and name HA)
or (segid " C" and resid 24 and name HG11) (segid " C" and resid 14 and name HA)
assign (segid " C" and resid 24 and name HG13) (segid " C" and resid 21 and name HA2) 2.974 1.105 1.105 weight 1.000 ! spec=13C_...nD2O, no=220, id=468, vol=1.107749e+08
or (segid " C" and resid 24 and name HG12) (segid " C" and resid 21 and name HA2)
or (segid " C" and resid 24 and name HG11) (segid " C" and resid 21 and name HA2)
assign (segid " C" and resid 33 and name HA) (segid " C" and resid 24 and name HG13) 3.586 1.608 1.608 weight 1.000 ! spec=13C_...nD2O, no=221, id=469, vol=3.384021e+07
or (segid " C" and resid 33 and name HA) (segid " C" and resid 24 and name HG12)
or (segid " C" and resid 33 and name HA) (segid " C" and resid 24 and name HG11)
assign (segid " C" and resid 33 and name HB3) (segid " C" and resid 24 and name HG22) 2.142 0.574 0.574 weight 1.000 ! spec=13C_...nD2O, no=223, id=471, vol=3.346520e+08
or (segid " C" and resid 33 and name HB3) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 33 and name HB3) (segid " C" and resid 24 and name HG21)
or (segid " C" and resid 33 and name HB2) (segid " C" and resid 24 and name HG22)
or (segid " C" and resid 33 and name HB2) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 33 and name HB2) (segid " C" and resid 24 and name HG21)
or (segid " C" and resid 33 and name HB1) (segid " C" and resid 24 and name HG22)
or (segid " C" and resid 33 and name HB1) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 33 and name HB1) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 24 and name HB) (segid " C" and resid 24 and name HG22) 2.001 0.501 0.501 weight 1.000 ! spec=13C_...nD2O, no=225, id=472, vol=5.900107e+08
or (segid " C" and resid 24 and name HB) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 24 and name HB) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 24 and name HG22) (segid " C" and resid 24 and name HA) 2.015 0.507 0.507 weight 1.000 ! spec=13C_...nD2O, no=227, id=473, vol=7.325583e+08
or (segid " C" and resid 24 and name HG23) (segid " C" and resid 24 and name HA)
or (segid " C" and resid 24 and name HG21) (segid " C" and resid 24 and name HA)
assign (segid " C" and resid 24 and name HG22) (segid " C" and resid 14 and name HA) 2.828 1.000 1.000 weight 1.000 ! spec=13C_...nD2O, no=229, id=475, vol=1.805959e+08
or (segid " C" and resid 24 and name HG23) (segid " C" and resid 14 and name HA)
or (segid " C" and resid 24 and name HG21) (segid " C" and resid 14 and name HA)
assign (segid " C" and resid 24 and name HG22) (segid " C" and resid 21 and name HA2) 2.228 0.621 0.621 weight 1.000 ! spec=13C_...nD2O, no=230, id=476, vol=3.156814e+08
or (segid " C" and resid 24 and name HG23) (segid " C" and resid 21 and name HA2)
or (segid " C" and resid 24 and name HG21) (segid " C" and resid 21 and name HA2)
assign (segid " C" and resid 34 and name HA) (segid " C" and resid 24 and name HG22) 3.256 1.325 1.325 weight 1.000 ! spec=13C_...nD2O, no=232, id=477, vol=5.357805e+07
or (segid " C" and resid 34 and name HA) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 34 and name HA) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 33 and name HA) (segid " C" and resid 24 and name HG22) 3.553 1.578 1.578 weight 1.000 ! spec=13C_...nD2O, no=233, id=478, vol=4.568253e+07
or (segid " C" and resid 33 and name HA) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 33 and name HA) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 24 and name HG13) (segid " C" and resid 24 and name HG22) 2.277 0.648 0.648 weight 1.000 ! spec=13C_...nD2O, no=237, id=481, vol=1.950651e+08
or (segid " C" and resid 24 and name HG13) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 24 and name HG13) (segid " C" and resid 24 and name HG21)
or (segid " C" and resid 24 and name HG12) (segid " C" and resid 24 and name HG22)
or (segid " C" and resid 24 and name HG12) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 24 and name HG12) (segid " C" and resid 24 and name HG21)
or (segid " C" and resid 24 and name HG11) (segid " C" and resid 24 and name HG22)
or (segid " C" and resid 24 and name HG11) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 24 and name HG11) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 25 and name HB1) (segid " C" and resid 25 and name HA) 2.618 0.857 0.857 weight 1.000 ! spec=13C_...nD2O, no=241, id=482, vol=3.342379e+08
assign (segid " C" and resid 25 and name HA) (segid " C" and resid 25 and name HG) 3.372 1.422 1.422 weight 1.000 ! spec=13C_...nD2O, no=246, id=486, vol=4.730702e+07
assign (segid " C" and resid 35 and name HA) (segid " C" and resid 25 and name HG) 3.586 1.608 1.608 weight 1.000 ! spec=13C_...nD2O, no=247, id=487, vol=2.970148e+07
assign (segid " C" and resid 34 and name HD1) (segid " C" and resid 26 and name HA) 4.256 2.264 2.264 weight 1.000 ! spec=13C_...nD2O, no=249, id=489, vol=2.391647e+07
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 26 and name HA)
assign (segid " C" and resid 33 and name HB3) (segid " C" and resid 26 and name HA) 4.129 2.131 2.131 weight 1.000 ! spec=13C_...nD2O, no=251, id=491, vol=3.892726e+07
or (segid " C" and resid 33 and name HB2) (segid " C" and resid 26 and name HA)
or (segid " C" and resid 33 and name HB1) (segid " C" and resid 26 and name HA)
assign (segid " C" and resid 27 and name HA) (segid " C" and resid 26 and name HB2) 3.917 1.918 1.918 weight 1.000 ! spec=13C_...nD2O, no=255, id=495, vol=3.021268e+07
assign (segid " C" and resid 26 and name HB2) (segid " C" and resid 26 and name HA) 3.008 1.131 1.131 weight 1.000 ! spec=13C_...nD2O, no=256, id=496, vol=9.266796e+07
assign (segid " C" and resid 26 and name HB1) (segid " C" and resid 26 and name HA) 2.872 1.031 1.031 weight 1.000 ! spec=13C_...nD2O, no=257, id=497, vol=9.832193e+07
assign (segid " C" and resid 27 and name HA) (segid " C" and resid 26 and name HB1) 4.016 2.016 2.016 weight 1.000 ! spec=13C_...nD2O, no=258, id=498, vol=2.777024e+07
assign (segid " C" and resid 26 and name HA) (segid " C" and resid 26 and name HG2) 3.330 1.386 1.386 weight 1.000 ! spec=13C_...nD2O, no=262, id=500, vol=9.001996e+07
assign (segid " C" and resid 26 and name HA) (segid " C" and resid 26 and name HG1) 3.220 1.296 1.296 weight 1.000 ! spec=13C_...nD2O, no=263, id=501, vol=7.000870e+07
assign (segid " C" and resid 52 and name HA) (segid " C" and resid 27 and name HA) 2.698 0.910 0.910 weight 1.000 ! spec=13C_...nD2O, no=265, id=502, vol=1.935503e+08
assign (segid " C" and resid 27 and name HB1) (segid " C" and resid 27 and name HA) 2.431 0.739 0.739 weight 1.000 ! spec=13C_...nD2O, no=267, id=504, vol=2.573528e+08
assign (segid " C" and resid 27 and name HB2) (segid " C" and resid 27 and name HA) 2.927 1.071 1.071 weight 1.000 ! spec=13C_...nD2O, no=271, id=506, vol=1.673019e+08
assign (segid " C" and resid 27 and name HB2) (segid " C" and resid 27 and name HB1) 1.836 0.421 0.421 weight 1.000 ! spec=13C_...nD2O, no=273, id=508, vol=7.653194e+08
assign (segid " C" and resid 32 and name HB1) (segid " C" and resid 27 and name HB2) 3.308 1.368 1.368 weight 1.000 ! spec=13C_...nD2O, no=276, id=511, vol=9.880632e+07
or (segid " C" and resid 32 and name HB2) (segid " C" and resid 27 and name HB2)
or (segid " C" and resid 32 and name HB3) (segid " C" and resid 27 and name HB2)
assign (segid " C" and resid 53 and name HB2) (segid " C" and resid 27 and name HB1) 2.450 0.750 0.750 weight 1.000 ! spec=13C_...nD2O, no=277, id=512, vol=1.517278e+08
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 27 and name HB2) 4.421 2.443 2.443 weight 1.000 ! spec=13C_...nD2O, no=280, id=514, vol=4.857849e+07
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 27 and name HB2)
assign (segid " C" and resid 34 and name HD1) (segid " C" and resid 27 and name HB2) 4.693 2.753 2.753 weight 1.000 ! spec=13C_...nD2O, no=282, id=515, vol=2.448697e+07
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 27 and name HB2)
assign (segid " C" and resid 52 and name HA) (segid " C" and resid 27 and name HB2) 4.395 2.415 2.415 weight 1.000 ! spec=13C_...nD2O, no=284, id=516, vol=1.795619e+07
assign (segid " C" and resid 28 and name HG23) (segid " C" and resid 28 and name HA) 2.242 0.629 0.629 weight 1.000 ! spec=13C_...nD2O, no=288, id=517, vol=5.940940e+08
or (segid " C" and resid 28 and name HG21) (segid " C" and resid 28 and name HA)
or (segid " C" and resid 28 and name HG22) (segid " C" and resid 28 and name HA)
assign (segid " C" and resid 28 and name HA) (segid " C" and resid 28 and name HB) 2.669 0.891 0.891 weight 1.000 ! spec=13C_...nD2O, no=289, id=518, vol=1.883707e+08
assign (segid " C" and resid 28 and name HG23) (segid " C" and resid 28 and name HB) 1.967 0.483 0.483 weight 1.000 ! spec=13C_...nD2O, no=295, id=522, vol=8.715750e+08
or (segid " C" and resid 28 and name HG21) (segid " C" and resid 28 and name HB)
or (segid " C" and resid 28 and name HG22) (segid " C" and resid 28 and name HB)
assign (segid " C" and resid 29 and name HA) (segid " C" and resid 29 and name HB2) 3.267 1.334 1.334 weight 1.000 ! spec=13C_...nD2O, no=296, id=523, vol=1.004249e+08
assign (segid " C" and resid 30 and name HB1) (segid " C" and resid 30 and name HA) 2.997 1.123 1.123 weight 1.000 ! spec=13C_...nD2O, no=303, id=525, vol=1.393304e+08
assign (segid " C" and resid 30 and name HB2) (segid " C" and resid 30 and name HB1) 2.072 0.537 0.537 weight 1.000 ! spec=13C_...nD2O, no=305, id=527, vol=4.201459e+08
assign (segid " C" and resid 31 and name HA) (segid " C" and resid 31 and name HB2) 1.930 0.466 0.466 weight 1.000 ! spec=13C_...nD2O, no=312, id=528, vol=8.876847e+08
or (segid " C" and resid 31 and name HA) (segid " C" and resid 31 and name HB1)
or (segid " C" and resid 31 and name HA) (segid " C" and resid 31 and name HB3)
assign (segid " C" and resid 33 and name HA) (segid " C" and resid 26 and name HA) 2.703 0.913 0.913 weight 1.000 ! spec=13C_...nD2O, no=317, id=531, vol=1.513637e+08
assign (segid " C" and resid 24 and name HB) (segid " C" and resid 33 and name HA) 3.620 1.638 1.638 weight 1.000 ! spec=13C_...nD2O, no=319, id=533, vol=2.921190e+07
assign (segid " C" and resid 32 and name HB1) (segid " C" and resid 33 and name HA) 3.241 1.313 1.313 weight 1.000 ! spec=13C_...nD2O, no=320, id=534, vol=7.143734e+07
or (segid " C" and resid 32 and name HB2) (segid " C" and resid 33 and name HA)
or (segid " C" and resid 32 and name HB3) (segid " C" and resid 33 and name HA)
assign (segid " C" and resid 13 and name HA) (segid " C" and resid 33 and name HB3) 2.710 0.918 0.918 weight 1.000 ! spec=13C_...nD2O, no=324, id=538, vol=1.478906e+08
or (segid " C" and resid 13 and name HA) (segid " C" and resid 33 and name HB2)
or (segid " C" and resid 13 and name HA) (segid " C" and resid 33 and name HB1)
assign (segid " C" and resid 15 and name HB1) (segid " C" and resid 34 and name HA) 5.297 3.507 3.507 weight 1.000 ! spec=13C_...nD2O, no=331, id=541, vol=2.457216e+07
assign (segid " C" and resid 33 and name HB3) (segid " C" and resid 34 and name HA) 3.771 1.778 1.778 weight 1.000 ! spec=13C_...nD2O, no=333, id=542, vol=2.646206e+07
or (segid " C" and resid 33 and name HB2) (segid " C" and resid 34 and name HA)
or (segid " C" and resid 33 and name HB1) (segid " C" and resid 34 and name HA)
assign (segid " C" and resid 15 and name HA) (segid " C" and resid 34 and name HB2) 3.986 1.986 1.986 weight 1.000 ! spec=13C_...nD2O, no=335, id=544, vol=2.034875e+07
assign (segid " C" and resid 35 and name HB1) (segid " C" and resid 35 and name HA) 2.790 0.973 0.973 weight 1.000 ! spec=13C_...nD2O, no=336, id=545, vol=2.627263e+08
assign (segid " C" and resid 35 and name HA) (segid " C" and resid 24 and name HG22) 4.571 2.611 2.611 weight 1.000 ! spec=13C_...nD2O, no=339, id=546, vol=1.568753e+07
or (segid " C" and resid 35 and name HA) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 35 and name HA) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 35 and name HB2) (segid " C" and resid 35 and name HB1) 1.830 0.419 0.419 weight 1.000 ! spec=13C_...nD2O, no=342, id=548, vol=7.166648e+08
assign (segid " C" and resid 40 and name HB1) (segid " C" and resid 36 and name HA) 3.232 1.306 1.306 weight 1.000 ! spec=13C_...nD2O, no=352, id=551, vol=5.940127e+07
assign (segid " C" and resid 44 and name HG22) (segid " C" and resid 44 and name HA) 2.245 0.630 0.630 weight 1.000 ! spec=13C_...nD2O, no=353, id=552, vol=5.275446e+08
or (segid " C" and resid 44 and name HG21) (segid " C" and resid 44 and name HA)
or (segid " C" and resid 44 and name HG23) (segid " C" and resid 44 and name HA)
assign (segid " C" and resid 40 and name HD2) (segid " C" and resid 36 and name HA) 3.318 1.376 1.376 weight 1.000 ! spec=13C_...nD2O, no=355, id=553, vol=1.228515e+08
or (segid " C" and resid 40 and name HD1) (segid " C" and resid 36 and name HA)
assign (segid " C" and resid 34 and name HD1) (segid " C" and resid 36 and name HA) 3.371 1.420 1.420 weight 1.000 ! spec=13C_...nD2O, no=356, id=554, vol=1.013909e+08
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 36 and name HA)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 36 and name HA) 2.917 1.064 1.064 weight 1.000 ! spec=13C_...nD2O, no=357, id=555, vol=2.073774e+08
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 36 and name HA)
assign (segid " C" and resid 36 and name HE3) (segid " C" and resid 36 and name HA) 2.736 0.935 0.935 weight 1.000 ! spec=13C_...nD2O, no=358, id=556, vol=1.722940e+08
assign (segid " C" and resid 35 and name HB2) (segid " C" and resid 37 and name HG1) 3.338 1.393 1.393 weight 1.000 ! spec=13C_...nD2O, no=369, id=564, vol=6.987806e+07
assign (segid " C" and resid 35 and name HB2) (segid " C" and resid 37 and name HG2) 4.527 2.562 2.562 weight 1.000 ! spec=13C_...nD2O, no=370, id=565, vol=3.347028e+07
assign (segid " C" and resid 38 and name HB1) (segid " C" and resid 38 and name HA) 2.957 1.093 1.093 weight 1.000 ! spec=13C_...nD2O, no=375, id=568, vol=1.587154e+08
assign (segid " C" and resid 38 and name HB2) (segid " C" and resid 38 and name HA) 2.407 0.724 0.724 weight 1.000 ! spec=13C_...nD2O, no=376, id=569, vol=2.649465e+08
assign (segid " C" and resid 38 and name HA) (segid " C" and resid 39 and name HB1) 4.379 2.396 2.396 weight 1.000 ! spec=13C_...nD2O, no=378, id=570, vol=3.421865e+07
assign (segid " C" and resid 39 and name HD2) (segid " C" and resid 38 and name HA) 4.549 2.587 2.587 weight 1.000 ! spec=13C_...nD2O, no=380, id=571, vol=1.996149e+07
assign (segid " C" and resid 39 and name HD2) (segid " C" and resid 38 and name HB1) 2.780 0.966 0.966 weight 1.000 ! spec=13C_...nD2O, no=382, id=572, vol=1.059333e+08
assign (segid " C" and resid 39 and name HD2) (segid " C" and resid 38 and name HB2) 3.280 1.345 1.345 weight 1.000 ! spec=13C_...nD2O, no=383, id=573, vol=7.983873e+07
assign (segid " C" and resid 35 and name HB2) (segid " C" and resid 38 and name HB1) 3.926 1.926 1.926 weight 1.000 ! spec=13C_...nD2O, no=387, id=577, vol=1.148508e+08
assign (segid " C" and resid 38 and name HB1) (segid " C" and resid 38 and name HB2) 1.846 0.426 0.426 weight 1.000 ! spec=13C_...nD2O, no=389, id=579, vol=5.150716e+08
assign (segid " C" and resid 38 and name HB1) (segid " C" and resid 17 and name HB) 3.476 1.510 1.510 weight 1.000 ! spec=13C_...nD2O, no=390, id=580, vol=1.494690e+08
assign (segid " C" and resid 38 and name HB2) (segid " C" and resid 17 and name HB) 2.075 0.538 0.538 weight 1.000 ! spec=13C_...nD2O, no=391, id=581, vol=3.152951e+08
assign (segid " C" and resid 54 and name HB2) (segid " C" and resid 39 and name HA) 3.785 1.791 1.791 weight 1.000 ! spec=13C_...nD2O, no=394, id=584, vol=4.117587e+07
assign (segid " C" and resid 39 and name HD2) (segid " C" and resid 39 and name HB1) 3.220 1.296 1.296 weight 1.000 ! spec=13C_...nD2O, no=399, id=587, vol=6.068323e+07
assign (segid " C" and resid 40 and name HE2) (segid " C" and resid 39 and name HB1) 4.430 2.453 2.453 weight 1.000 ! spec=13C_...nD2O, no=400, id=588, vol=3.375240e+07
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 39 and name HB1)
assign (segid " C" and resid 54 and name HB2) (segid " C" and resid 39 and name HB1) 3.972 1.972 1.972 weight 1.000 ! spec=13C_...nD2O, no=401, id=589, vol=8.978573e+07
assign (segid " C" and resid 54 and name HB2) (segid " C" and resid 39 and name HB2) 3.629 1.646 1.646 weight 1.000 ! spec=13C_...nD2O, no=404, id=590, vol=5.692406e+07
assign (segid " C" and resid 63 and name HA) (segid " C" and resid 64 and name HD2) 2.112 0.558 0.558 weight 1.000 ! spec=13C_...nD2O, no=410, id=593, vol=6.110390e+08
assign (segid " C" and resid 40 and name HB1) (segid " C" and resid 41 and name HD1) 4.872 2.967 2.967 weight 1.000 ! spec=13C_...nD2O, no=411, id=594, vol=2.988325e+07
assign (segid " C" and resid 40 and name HB1) (segid " C" and resid 41 and name HD2) 4.657 2.711 2.711 weight 1.000 ! spec=13C_...nD2O, no=412, id=595, vol=3.366162e+07
assign (segid " C" and resid 41 and name HD1) (segid " C" and resid 41 and name HB1) 3.606 1.625 1.625 weight 1.000 ! spec=13C_...nD2O, no=413, id=596, vol=3.984941e+07
assign (segid " C" and resid 40 and name HA) (segid " C" and resid 41 and name HD1) 2.376 0.706 0.706 weight 1.000 ! spec=13C_...nD2O, no=415, id=598, vol=2.922013e+08
assign (segid " C" and resid 40 and name HA) (segid " C" and resid 41 and name HD2) 2.590 0.838 0.838 weight 1.000 ! spec=13C_...nD2O, no=416, id=599, vol=2.198000e+08
assign (segid " C" and resid 41 and name HB2) (segid " C" and resid 42 and name HA) 4.299 2.311 2.311 weight 1.000 ! spec=13C_...nD2O, no=421, id=602, vol=2.263429e+07
assign (segid " C" and resid 42 and name HA) (segid " C" and resid 42 and name HB3) 1.942 0.472 0.472 weight 1.000 ! spec=13C_...nD2O, no=422, id=603, vol=1.115364e+09
or (segid " C" and resid 42 and name HA) (segid " C" and resid 42 and name HB1)
or (segid " C" and resid 42 and name HA) (segid " C" and resid 42 and name HB2)
assign (segid " C" and resid 45 and name HB1) (segid " C" and resid 44 and name HG22) 3.870 1.873 1.873 weight 1.000 ! spec=13C_...nD2O, no=425, id=605, vol=8.726729e+07
or (segid " C" and resid 45 and name HB1) (segid " C" and resid 44 and name HG21)
or (segid " C" and resid 45 and name HB1) (segid " C" and resid 44 and name HG23)
assign (segid " C" and resid 36 and name HZ2) (segid " C" and resid 44 and name HG22) 2.502 0.782 0.782 weight 1.000 ! spec=13C_...nD2O, no=426, id=606, vol=2.351503e+08
or (segid " C" and resid 36 and name HZ2) (segid " C" and resid 44 and name HG21)
or (segid " C" and resid 36 and name HZ2) (segid " C" and resid 44 and name HG23)
assign (segid " C" and resid 40 and name HD2) (segid " C" and resid 44 and name HG22) 3.513 1.542 1.542 weight 1.000 ! spec=13C_...nD2O, no=427, id=607, vol=8.788031e+07
or (segid " C" and resid 40 and name HD2) (segid " C" and resid 44 and name HG21)
or (segid " C" and resid 40 and name HD2) (segid " C" and resid 44 and name HG23)
or (segid " C" and resid 40 and name HD1) (segid " C" and resid 44 and name HG22)
or (segid " C" and resid 40 and name HD1) (segid " C" and resid 44 and name HG21)
or (segid " C" and resid 40 and name HD1) (segid " C" and resid 44 and name HG23)
assign (segid " C" and resid 36 and name HZ2) (segid " C" and resid 46 and name HA) 3.160 1.249 1.249 weight 1.000 ! spec=13C_...nD2O, no=433, id=610, vol=7.211176e+07
assign (segid " C" and resid 44 and name HG22) (segid " C" and resid 46 and name HA) 3.203 1.282 1.282 weight 1.000 ! spec=13C_...nD2O, no=438, id=614, vol=1.267471e+08
or (segid " C" and resid 44 and name HG21) (segid " C" and resid 46 and name HA)
or (segid " C" and resid 44 and name HG23) (segid " C" and resid 46 and name HA)
assign (segid " C" and resid 46 and name HB1) (segid " C" and resid 46 and name HA) 2.543 0.808 0.808 weight 1.000 ! spec=13C_...nD2O, no=439, id=615, vol=2.100708e+08
assign (segid " C" and resid 47 and name HD1) (segid " C" and resid 46 and name HB1) 4.361 2.377 2.377 weight 1.000 ! spec=13C_...nD2O, no=442, id=617, vol=3.226645e+07
assign (segid " C" and resid 47 and name HD1) (segid " C" and resid 46 and name HB2) 3.551 1.576 1.576 weight 1.000 ! spec=13C_...nD2O, no=443, id=618, vol=4.633848e+07
assign (segid " C" and resid 47 and name HD1) (segid " C" and resid 46 and name HA) 2.200 0.605 0.605 weight 1.000 ! spec=13C_...nD2O, no=462, id=624, vol=3.734764e+08
assign (segid " C" and resid 47 and name HD2) (segid " C" and resid 46 and name HA) 2.197 0.604 0.604 weight 1.000 ! spec=13C_...nD2O, no=463, id=625, vol=3.843819e+08
assign (segid " C" and resid 47 and name HA) (segid " C" and resid 47 and name HD1) 3.660 1.675 1.675 weight 1.000 ! spec=13C_...nD2O, no=464, id=626, vol=4.724940e+07
assign (segid " C" and resid 47 and name HA) (segid " C" and resid 47 and name HD2) 3.981 1.981 1.981 weight 1.000 ! spec=13C_...nD2O, no=465, id=627, vol=1.992825e+07
assign (segid " C" and resid 51 and name HD22) (segid " C" and resid 47 and name HD1) 2.318 0.671 0.671 weight 1.000 ! spec=13C_...nD2O, no=470, id=630, vol=2.477306e+08
or (segid " C" and resid 51 and name HD23) (segid " C" and resid 47 and name HD1)
or (segid " C" and resid 51 and name HD21) (segid " C" and resid 47 and name HD1)
assign (segid " C" and resid 36 and name HD1) (segid " C" and resid 47 and name HD1) 4.282 2.292 2.292 weight 1.000 ! spec=13C_...nD2O, no=474, id=632, vol=3.266120e+07
assign (segid " C" and resid 36 and name HZ3) (segid " C" and resid 47 and name HD2) 4.217 2.223 2.223 weight 1.000 ! spec=13C_...nD2O, no=475, id=633, vol=2.677840e+07
assign (segid " C" and resid 36 and name HH2) (segid " C" and resid 47 and name HD1) 3.399 1.445 1.445 weight 1.000 ! spec=13C_...nD2O, no=476, id=634, vol=6.692431e+07
assign (segid " C" and resid 36 and name HH2) (segid " C" and resid 47 and name HD2) 3.049 1.162 1.162 weight 1.000 ! spec=13C_...nD2O, no=477, id=635, vol=7.569232e+07
assign (segid " C" and resid 49 and name HG21) (segid " C" and resid 49 and name HA) 2.389 0.713 0.713 weight 1.000 ! spec=13C_...nD2O, no=485, id=637, vol=4.099680e+08
or (segid " C" and resid 49 and name HG22) (segid " C" and resid 49 and name HA)
or (segid " C" and resid 49 and name HG23) (segid " C" and resid 49 and name HA)
assign (segid " C" and resid 49 and name HB) (segid " C" and resid 49 and name HG21) 2.041 0.521 0.521 weight 1.000 ! spec=13C_...nD2O, no=496, id=639, vol=7.530415e+08
or (segid " C" and resid 49 and name HB) (segid " C" and resid 49 and name HG22)
or (segid " C" and resid 49 and name HB) (segid " C" and resid 49 and name HG23)
assign (segid " C" and resid 51 and name HA) (segid " C" and resid 51 and name HB2) 2.744 0.941 0.941 weight 1.000 ! spec=13C_...nD2O, no=505, id=641, vol=1.716799e+08
assign (segid " C" and resid 51 and name HA) (segid " C" and resid 51 and name HB1) 2.471 0.763 0.763 weight 1.000 ! spec=13C_...nD2O, no=506, id=642, vol=2.027145e+08
assign (segid " C" and resid 51 and name HD11) (segid " C" and resid 51 and name HA) 2.347 0.688 0.688 weight 1.000 ! spec=13C_...nD2O, no=518, id=649, vol=3.482883e+08
or (segid " C" and resid 51 and name HD13) (segid " C" and resid 51 and name HA)
or (segid " C" and resid 51 and name HD12) (segid " C" and resid 51 and name HA)
assign (segid " C" and resid 51 and name HD22) (segid " C" and resid 51 and name HA) 2.353 0.692 0.692 weight 1.000 ! spec=13C_...nD2O, no=519, id=650, vol=2.408614e+08
or (segid " C" and resid 51 and name HD23) (segid " C" and resid 51 and name HA)
or (segid " C" and resid 51 and name HD21) (segid " C" and resid 51 and name HA)
assign (segid " C" and resid 47 and name HD1) (segid " C" and resid 51 and name HD11) 2.975 1.106 1.106 weight 1.000 ! spec=13C_...nD2O, no=520, id=651, vol=1.131397e+08
or (segid " C" and resid 47 and name HD1) (segid " C" and resid 51 and name HD13)
or (segid " C" and resid 47 and name HD1) (segid " C" and resid 51 and name HD12)
assign (segid " C" and resid 51 and name HD22) (segid " C" and resid 51 and name HB1) 2.283 0.652 0.652 weight 1.000 ! spec=13C_...nD2O, no=524, id=653, vol=3.349247e+08
or (segid " C" and resid 51 and name HD23) (segid " C" and resid 51 and name HB1)
or (segid " C" and resid 51 and name HD21) (segid " C" and resid 51 and name HB1)
assign (segid " C" and resid 52 and name HG2) (segid " C" and resid 52 and name HA) 2.863 1.024 1.024 weight 1.000 ! spec=13C_...nD2O, no=529, id=657, vol=1.674266e+08
assign (segid " C" and resid 52 and name HA) (segid " C" and resid 52 and name HG1) 2.706 0.915 0.915 weight 1.000 ! spec=13C_...nD2O, no=547, id=671, vol=1.184882e+08
assign (segid " C" and resid 34 and name HZ) (segid " C" and resid 53 and name HA) 2.847 1.013 1.013 weight 1.000 ! spec=13C_...nD2O, no=548, id=672, vol=1.215843e+08
assign (segid " C" and resid 53 and name HB2) (segid " C" and resid 53 and name HA) 2.777 0.964 0.964 weight 1.000 ! spec=13C_...nD2O, no=552, id=674, vol=1.459421e+08
assign (segid " C" and resid 53 and name HB1) (segid " C" and resid 53 and name HB2) 1.944 0.472 0.472 weight 1.000 ! spec=13C_...nD2O, no=556, id=676, vol=4.905338e+08
assign (segid " C" and resid 53 and name HB1) (segid " C" and resid 53 and name HA) 2.436 0.742 0.742 weight 1.000 ! spec=13C_...nD2O, no=557, id=677, vol=2.697694e+08
assign (segid " C" and resid 39 and name HE1) (segid " C" and resid 53 and name HB2) 3.731 1.740 1.740 weight 1.000 ! spec=13C_...nD2O, no=560, id=678, vol=1.190064e+08
assign (segid " C" and resid 40 and name HE2) (segid " C" and resid 54 and name HA) 3.425 1.466 1.466 weight 1.000 ! spec=13C_...nD2O, no=566, id=680, vol=1.352749e+08
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 54 and name HA)
assign (segid " C" and resid 40 and name HZ) (segid " C" and resid 54 and name HA) 2.865 1.026 1.026 weight 1.000 ! spec=13C_...nD2O, no=567, id=681, vol=1.828412e+08
assign (segid " C" and resid 40 and name HD2) (segid " C" and resid 54 and name HA) 4.878 2.975 2.975 weight 1.000 ! spec=13C_...nD2O, no=568, id=682, vol=1.388765e+07
or (segid " C" and resid 40 and name HD1) (segid " C" and resid 54 and name HA)
assign (segid " C" and resid 54 and name HD1) (segid " C" and resid 54 and name HA) 3.912 1.913 1.913 weight 1.000 ! spec=13C_...nD2O, no=569, id=683, vol=4.766234e+07
assign (segid " C" and resid 54 and name HD2) (segid " C" and resid 54 and name HA) 3.721 1.731 1.731 weight 1.000 ! spec=13C_...nD2O, no=570, id=684, vol=2.197435e+07
assign (segid " C" and resid 54 and name HD2) (segid " C" and resid 54 and name HB1) 4.106 2.107 2.107 weight 1.000 ! spec=13C_...nD2O, no=576, id=687, vol=5.256506e+07
assign (segid " C" and resid 54 and name HD2) (segid " C" and resid 54 and name HB2) 3.818 1.822 1.822 weight 1.000 ! spec=13C_...nD2O, no=577, id=688, vol=5.938267e+07
assign (segid " C" and resid 54 and name HD1) (segid " C" and resid 54 and name HB1) 2.797 0.978 0.978 weight 1.000 ! spec=13C_...nD2O, no=578, id=689, vol=9.367002e+07
assign (segid " C" and resid 54 and name HB1) (segid " C" and resid 54 and name HA) 2.921 1.067 1.067 weight 1.000 ! spec=13C_...nD2O, no=580, id=690, vol=1.072801e+08
assign (segid " C" and resid 54 and name HB2) (segid " C" and resid 54 and name HA) 2.483 0.771 0.771 weight 1.000 ! spec=13C_...nD2O, no=581, id=691, vol=1.924121e+08
assign (segid " C" and resid 40 and name HE2) (segid " C" and resid 54 and name HB1) 5.215 3.400 3.400 weight 1.000 ! spec=13C_...nD2O, no=584, id=693, vol=1.540478e+07
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 54 and name HB1)
assign (segid " C" and resid 40 and name HE2) (segid " C" and resid 54 and name HB2) 4.284 2.294 2.294 weight 1.000 ! spec=13C_...nD2O, no=585, id=694, vol=2.599914e+07
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 54 and name HB2)
assign (segid " C" and resid 54 and name HD2) (segid " C" and resid 54 and name HD1) 1.741 0.379 0.379 weight 1.000 ! spec=13C_...nD2O, no=586, id=695, vol=8.404197e+08
assign (segid " C" and resid 54 and name HG2) (segid " C" and resid 54 and name HD2) 2.668 0.889 0.889 weight 1.000 ! spec=13C_...nD2O, no=593, id=699, vol=1.186118e+08
assign (segid " C" and resid 54 and name HG2) (segid " C" and resid 54 and name HD1) 2.968 1.101 1.101 weight 1.000 ! spec=13C_...nD2O, no=595, id=700, vol=1.152835e+08
assign (segid " C" and resid 56 and name HA) (segid " C" and resid 56 and name HB2) 2.686 0.902 0.902 weight 1.000 ! spec=13C_...nD2O, no=597, id=701, vol=2.721041e+08
assign (segid " C" and resid 56 and name HA) (segid " C" and resid 56 and name HB1) 2.917 1.063 1.063 weight 1.000 ! spec=13C_...nD2O, no=606, id=705, vol=1.081924e+08
assign (segid " C" and resid 52 and name HG1) (segid " C" and resid 56 and name HB1) 2.619 0.857 0.857 weight 1.000 ! spec=13C_...nD2O, no=611, id=707, vol=1.980730e+08
assign (segid " C" and resid 56 and name HB2) (segid " C" and resid 52 and name HG1) 2.832 1.002 1.002 weight 1.000 ! spec=13C_...nD2O, no=612, id=708, vol=1.603086e+08
assign (segid " C" and resid 52 and name HD1) (segid " C" and resid 57 and name HB1) 3.909 1.910 1.910 weight 1.000 ! spec=13C_...nD2O, no=620, id=713, vol=2.766397e+07
assign (segid " C" and resid 59 and name HB1) (segid " C" and resid 59 and name HA) 2.920 1.066 1.066 weight 1.000 ! spec=13C_...nD2O, no=627, id=717, vol=1.902938e+08
assign (segid " C" and resid 59 and name HB2) (segid " C" and resid 59 and name HA) 2.630 0.865 0.865 weight 1.000 ! spec=13C_...nD2O, no=628, id=718, vol=2.052159e+08
assign (segid " C" and resid 60 and name HA) (segid " C" and resid 60 and name HB) 2.727 0.930 0.930 weight 1.000 ! spec=13C_...nD2O, no=632, id=720, vol=1.489520e+08
assign (segid " C" and resid 60 and name HG23) (segid " C" and resid 60 and name HB) 2.095 0.549 0.549 weight 1.000 ! spec=13C_...nD2O, no=633, id=721, vol=5.530522e+08
or (segid " C" and resid 60 and name HG21) (segid " C" and resid 60 and name HB)
or (segid " C" and resid 60 and name HG22) (segid " C" and resid 60 and name HB)
assign (segid " C" and resid 60 and name HA) (segid " C" and resid 60 and name HG23) 2.432 0.740 0.740 weight 1.000 ! spec=13C_...nD2O, no=634, id=722, vol=3.134883e+08
or (segid " C" and resid 60 and name HA) (segid " C" and resid 60 and name HG21)
or (segid " C" and resid 60 and name HA) (segid " C" and resid 60 and name HG22)
assign (segid " C" and resid 61 and name HA) (segid " C" and resid 62 and name HD2) 2.248 0.632 0.632 weight 1.000 ! spec=13C_...nD2O, no=635, id=723, vol=4.362889e+08
assign (segid " C" and resid 62 and name HB2) (segid " C" and resid 61 and name HA) 4.552 2.590 2.590 weight 1.000 ! spec=13C_...nD2O, no=638, id=724, vol=3.924458e+07
assign (segid " C" and resid 61 and name HG21) (segid " C" and resid 61 and name HA) 2.650 0.878 0.878 weight 1.000 ! spec=13C_...nD2O, no=639, id=725, vol=2.189898e+08
or (segid " C" and resid 61 and name HG22) (segid " C" and resid 61 and name HA)
or (segid " C" and resid 61 and name HG23) (segid " C" and resid 61 and name HA)
assign (segid " C" and resid 61 and name HG21) (segid " C" and resid 61 and name HB) 2.348 0.689 0.689 weight 1.000 ! spec=13C_...nD2O, no=642, id=726, vol=3.095568e+08
or (segid " C" and resid 61 and name HG22) (segid " C" and resid 61 and name HB)
or (segid " C" and resid 61 and name HG23) (segid " C" and resid 61 and name HB)
assign (segid " C" and resid 62 and name HB1) (segid " C" and resid 62 and name HA) 2.273 0.646 0.646 weight 1.000 ! spec=13C_...nD2O, no=645, id=727, vol=5.807780e+08
assign (segid " C" and resid 62 and name HA) (segid " C" and resid 62 and name HB2) 2.317 0.671 0.671 weight 1.000 ! spec=13C_...nD2O, no=646, id=728, vol=3.888475e+08
assign (segid " C" and resid 61 and name HG21) (segid " C" and resid 62 and name HD2) 3.801 1.806 1.806 weight 1.000 ! spec=13C_...nD2O, no=652, id=731, vol=2.505422e+07
or (segid " C" and resid 61 and name HG22) (segid " C" and resid 62 and name HD2)
or (segid " C" and resid 61 and name HG23) (segid " C" and resid 62 and name HD2)
assign (segid " C" and resid 64 and name HA) (segid " C" and resid 64 and name HB2) 2.595 0.842 0.842 weight 1.000 ! spec=13C_...nD2O, no=661, id=733, vol=1.839114e+08
assign (segid " C" and resid 64 and name HA) (segid " C" and resid 64 and name HB1) 2.836 1.005 1.005 weight 1.000 ! spec=13C_...nD2O, no=662, id=734, vol=1.686425e+08
assign (segid " C" and resid 65 and name HB) (segid " C" and resid 65 and name HA) 2.892 1.046 1.046 weight 1.000 ! spec=13C_...nD2O, no=669, id=739, vol=1.046804e+08
assign (segid " C" and resid 65 and name HG21) (segid " C" and resid 65 and name HA) 3.012 1.134 1.134 weight 1.000 ! spec=13C_...nD2O, no=673, id=741, vol=1.019454e+08
or (segid " C" and resid 65 and name HG23) (segid " C" and resid 65 and name HA)
or (segid " C" and resid 65 and name HG22) (segid " C" and resid 65 and name HA)
assign (segid " C" and resid 65 and name HB) (segid " C" and resid 65 and name HG12) 2.805 0.984 0.984 weight 1.000 ! spec=13C_...nD2O, no=674, id=742, vol=9.501056e+07
or (segid " C" and resid 65 and name HB) (segid " C" and resid 65 and name HG13)
or (segid " C" and resid 65 and name HB) (segid " C" and resid 65 and name HG11)
assign (segid " C" and resid 51 and name HD11) (segid " C" and resid 51 and name HB2) 2.229 0.621 0.621 weight 1.000 ! spec=13C_...nD2O, no=679, id=743, vol=4.000343e+08
or (segid " C" and resid 51 and name HD13) (segid " C" and resid 51 and name HB2)
or (segid " C" and resid 51 and name HD12) (segid " C" and resid 51 and name HB2)
assign (segid " C" and resid 36 and name HZ3) (segid " C" and resid 51 and name HD22) 2.817 0.992 0.992 weight 1.000 ! spec=13C_...nD2O, no=683, id=744, vol=1.517230e+08
or (segid " C" and resid 36 and name HZ3) (segid " C" and resid 51 and name HD23)
or (segid " C" and resid 36 and name HZ3) (segid " C" and resid 51 and name HD21)
assign (segid " C" and resid 33 and name HB3) (segid " C" and resid 33 and name HA) 2.026 0.513 0.513 weight 1.000 ! spec=13C_...nD2O, no=686, id=745, vol=5.867589e+08
or (segid " C" and resid 33 and name HB2) (segid " C" and resid 33 and name HA)
or (segid " C" and resid 33 and name HB1) (segid " C" and resid 33 and name HA)
assign (segid " C" and resid 40 and name HZ) (segid " C" and resid 54 and name HB2) 3.978 1.978 1.978 weight 1.000 ! spec=13C_...nD2O, no=691, id=746, vol=2.483758e+07
assign (segid " C" and resid 35 and name HE1) (segid " C" and resid 15 and name HB1) 2.978 1.108 1.108 weight 1.000 ! spec=13C_...nD2O, no=692, id=747, vol=8.688112e+07
assign (segid " C" and resid 23 and name HA) (segid " C" and resid 23 and name HB2) 2.291 0.656 0.656 weight 1.000 ! spec=13C_...nD2O, no=695, id=748, vol=4.483231e+08
assign (segid " C" and resid 9 and name HA) (segid " C" and resid 9 and name HG) 3.340 1.395 1.395 weight 1.000 ! spec=13C_...nD2O, no=698, id=750, vol=5.542448e+07
assign (segid " C" and resid 40 and name HD2) (segid " C" and resid 41 and name HD2) 4.141 2.144 2.144 weight 1.000 ! spec=13C_...nD2O, no=702, id=751, vol=5.208830e+07
or (segid " C" and resid 40 and name HD1) (segid " C" and resid 41 and name HD2)
assign (segid " C" and resid 13 and name HB1) (segid " C" and resid 13 and name HA) 2.078 0.540 0.540 weight 1.000 ! spec=13C_...nD2O, no=704, id=752, vol=5.920161e+08
or (segid " C" and resid 13 and name HB3) (segid " C" and resid 13 and name HA)
or (segid " C" and resid 13 and name HB2) (segid " C" and resid 13 and name HA)
assign (segid " C" and resid 17 and name HG23) (segid " C" and resid 16 and name HA1) 4.168 2.172 2.172 weight 1.000 ! spec=13C_...nD2O, no=713, id=754, vol=2.789613e+07
or (segid " C" and resid 17 and name HG22) (segid " C" and resid 16 and name HA1)
or (segid " C" and resid 17 and name HG21) (segid " C" and resid 16 and name HA1)
assign (segid " C" and resid 39 and name HD2) (segid " C" and resid 17 and name HB) 3.911 1.912 1.912 weight 1.000 ! spec=13C_...nD2O, no=715, id=755, vol=3.532860e+07
assign (segid " C" and resid 33 and name HB3) (segid " C" and resid 24 and name HB) 2.877 1.035 1.035 weight 1.000 ! spec=13C_...nD2O, no=734, id=760, vol=7.924109e+07
or (segid " C" and resid 33 and name HB2) (segid " C" and resid 24 and name HB)
or (segid " C" and resid 33 and name HB1) (segid " C" and resid 24 and name HB)
assign (segid " C" and resid 32 and name HB1) (segid " C" and resid 32 and name HA) 2.009 0.504 0.504 weight 1.000 ! spec=13C_...nD2O, no=769, id=767, vol=7.537799e+08
or (segid " C" and resid 32 and name HB2) (segid " C" and resid 32 and name HA)
or (segid " C" and resid 32 and name HB3) (segid " C" and resid 32 and name HA)
assign (segid " C" and resid 32 and name HB1) (segid " C" and resid 27 and name HB1) 2.661 0.885 0.885 weight 1.000 ! spec=13C_...nD2O, no=771, id=768, vol=1.203021e+08
or (segid " C" and resid 32 and name HB2) (segid " C" and resid 27 and name HB1)
or (segid " C" and resid 32 and name HB3) (segid " C" and resid 27 and name HB1)
assign (segid " C" and resid 40 and name HD2) (segid " C" and resid 41 and name HD1) 4.640 2.691 2.691 weight 1.000 ! spec=13C_...nD2O, no=777, id=772, vol=3.673272e+07
or (segid " C" and resid 40 and name HD1) (segid " C" and resid 41 and name HD1)
assign (segid " C" and resid 52 and name HG2) (segid " C" and resid 52 and name HG1) 2.235 0.624 0.624 weight 1.000 ! spec=13C_...nD2O, no=791, id=775, vol=1.790843e+08
assign (segid " C" and resid 54 and name HG1) (segid " C" and resid 54 and name HD2) 2.897 1.049 1.049 weight 1.000 ! spec=13C_...nD2O, no=793, id=776, vol=8.996164e+07
assign (segid " C" and resid 54 and name HG1) (segid " C" and resid 54 and name HD1) 2.884 1.040 1.040 weight 1.000 ! spec=13C_...nD2O, no=794, id=777, vol=9.547133e+07
assign (segid " C" and resid 52 and name HA) (segid " C" and resid 57 and name HA) 4.702 2.763 2.763 weight 1.000 ! spec=13C_...nD2O, no=799, id=778, vol=2.188861e+07
assign (segid " C" and resid 22 and name HG23) (segid " C" and resid 23 and name HB1) 2.438 0.743 0.743 weight 1.000 ! spec=13C_...nD2O, no=804, id=779, vol=2.600579e+08
or (segid " C" and resid 22 and name HG21) (segid " C" and resid 23 and name HB1)
or (segid " C" and resid 22 and name HG22) (segid " C" and resid 23 and name HB1)
assign (segid " C" and resid 52 and name HA) (segid " C" and resid 56 and name HB2) 4.116 2.117 2.117 weight 1.000 ! spec=13C_...nD2O, no=808, id=780, vol=2.622474e+07
assign (segid " C" and resid 47 and name HA) (segid " C" and resid 47 and name HB1) 2.180 0.594 0.594 weight 1.000 ! spec=13C_...nD2O, no=809, id=781, vol=5.241615e+08
assign (segid " C" and resid 25 and name HA) (segid " C" and resid 25 and name HB2) 2.843 1.010 1.010 weight 1.000 ! spec=13C_...nD2O, no=811, id=782, vol=9.628637e+07
assign (segid " C" and resid 25 and name HG) (segid " C" and resid 25 and name HB2) 3.164 1.251 1.251 weight 1.000 ! spec=13C_...nD2O, no=813, id=784, vol=7.934822e+07
assign (segid " C" and resid 25 and name HG) (segid " C" and resid 25 and name HB1) 3.047 1.161 1.161 weight 1.000 ! spec=13C_...nD2O, no=814, id=785, vol=5.636453e+07
assign (segid " C" and resid 17 and name HG13) (segid " C" and resid 17 and name HB) 1.932 0.467 0.467 weight 1.000 ! spec=13C_...nD2O, no=832, id=790, vol=6.533618e+08
or (segid " C" and resid 17 and name HG12) (segid " C" and resid 17 and name HB)
or (segid " C" and resid 17 and name HG11) (segid " C" and resid 17 and name HB)
assign (segid " C" and resid 17 and name HG13) (segid " C" and resid 17 and name HA) 2.221 0.617 0.617 weight 1.000 ! spec=13C_...nD2O, no=835, id=792, vol=5.343146e+08
or (segid " C" and resid 17 and name HG12) (segid " C" and resid 17 and name HA)
or (segid " C" and resid 17 and name HG11) (segid " C" and resid 17 and name HA)
assign (segid " C" and resid 39 and name HD2) (segid " C" and resid 17 and name HG23) 2.604 0.848 0.848 weight 1.000 ! spec=13C_...nD2O, no=837, id=794, vol=1.906632e+08
or (segid " C" and resid 39 and name HD2) (segid " C" and resid 17 and name HG22)
or (segid " C" and resid 39 and name HD2) (segid " C" and resid 17 and name HG21)
assign (segid " C" and resid 25 and name HN) (segid " C" and resid 24 and name HG22) 2.828 1.000 1.000 weight 1.000 ! spec=13c_...O_lp, no=8, id=1012, vol=2.501560e+08
or (segid " C" and resid 25 and name HN) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 25 and name HN) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 51 and name HN) (segid " C" and resid 28 and name HG23) 2.829 1.001 1.001 weight 1.000 ! spec=13c_...O_lp, no=12, id=1013, vol=1.439921e+08
or (segid " C" and resid 51 and name HN) (segid " C" and resid 28 and name HG21)
or (segid " C" and resid 51 and name HN) (segid " C" and resid 28 and name HG22)
assign (segid " C" and resid 28 and name HN) (segid " C" and resid 28 and name HG23) 2.356 0.694 0.694 weight 1.000 ! spec=13c_...O_lp, no=13, id=1014, vol=5.479371e+08
or (segid " C" and resid 28 and name HN) (segid " C" and resid 28 and name HG21)
or (segid " C" and resid 28 and name HN) (segid " C" and resid 28 and name HG22)
assign (segid " C" and resid 52 and name HN) (segid " C" and resid 51 and name HD11) 2.962 1.097 1.097 weight 1.000 ! spec=13c_...O_lp, no=14, id=1015, vol=1.316244e+08
or (segid " C" and resid 52 and name HN) (segid " C" and resid 51 and name HD13)
or (segid " C" and resid 52 and name HN) (segid " C" and resid 51 and name HD12)
assign (segid " C" and resid 37 and name HN) (segid " C" and resid 36 and name HB2) 2.575 0.829 0.829 weight 1.000 ! spec=13c_...O_lp, no=16, id=1016, vol=4.635091e+08
assign (segid " C" and resid 27 and name HN) (segid " C" and resid 27 and name HB2) 2.506 0.785 0.785 weight 1.000 ! spec=13c_...O_lp, no=23, id=1018, vol=6.701125e+08
assign (segid " C" and resid 27 and name HN) (segid " C" and resid 27 and name HB1) 2.369 0.702 0.702 weight 1.000 ! spec=13c_...O_lp, no=26, id=1020, vol=5.495230e+08
assign (segid " C" and resid 28 and name HN) (segid " C" and resid 27 and name HB1) 3.521 1.549 1.549 weight 1.000 ! spec=13c_...O_lp, no=31, id=1021, vol=2.884493e+08
assign (segid " C" and resid 16 and name HN) (segid " C" and resid 15 and name HB2) 3.896 1.897 1.897 weight 1.000 ! spec=13c_...O_lp, no=33, id=1022, vol=2.161633e+08
assign (segid " C" and resid 25 and name HN) (segid " C" and resid 25 and name HB2) 3.650 1.665 1.665 weight 1.000 ! spec=13c_...O_lp, no=47, id=1027, vol=2.235664e+08
assign (segid " C" and resid 51 and name HN) (segid " C" and resid 51 and name HB1) 2.699 0.910 0.910 weight 1.000 ! spec=13c_...O_lp, no=51, id=1029, vol=1.983954e+08
assign (segid " C" and resid 34 and name HN) (segid " C" and resid 33 and name HA) 2.301 0.662 0.662 weight 1.000 ! spec=13c_...O_lp, no=72, id=1034, vol=6.667442e+08
assign (segid " C" and resid 13 and name HN) (segid " C" and resid 13 and name HA) 2.400 0.720 0.720 weight 1.000 ! spec=13c_...O_lp, no=92, id=1035, vol=6.535044e+08
assign (segid " C" and resid 27 and name HN) (segid " C" and resid 26 and name HA) 2.333 0.681 0.681 weight 1.000 ! spec=13c_...O_lp, no=93, id=1036, vol=5.512925e+08
assign (segid " C" and resid 32 and name HN) (segid " C" and resid 32 and name HA) 2.623 0.860 0.860 weight 1.000 ! spec=13c_...O_lp, no=104, id=1037, vol=3.643126e+08
assign (segid " C" and resid 33 and name HN) (segid " C" and resid 32 and name HA) 2.156 0.581 0.581 weight 1.000 ! spec=13c_...O_lp, no=106, id=1038, vol=1.077852e+09
assign (segid " C" and resid 21 and name HN) (segid " C" and resid 20 and name HA) 2.267 0.642 0.642 weight 1.000 ! spec=13c_...O_lp, no=109, id=1039, vol=8.600248e+08
assign (segid " C" and resid 53 and name HN) (segid " C" and resid 52 and name HA) 2.228 0.621 0.621 weight 1.000 ! spec=13c_...O_lp, no=112, id=1040, vol=8.813331e+08
assign (segid " C" and resid 31 and name HN) (segid " C" and resid 31 and name HA) 2.254 0.635 0.635 weight 1.000 ! spec=13c_...O_lp, no=115, id=1041, vol=9.298054e+08
assign (segid " C" and resid 25 and name HN) (segid " C" and resid 24 and name HA) 2.089 0.545 0.545 weight 1.000 ! spec=13c_...O_lp, no=121, id=1043, vol=1.024180e+09
assign (segid " C" and resid 66 and name HN) (segid " C" and resid 65 and name HA) 2.499 0.780 0.780 weight 1.000 ! spec=13c_...O_lp, no=130, id=1044, vol=5.157242e+08
assign (segid " C" and resid 33 and name HN) (segid " C" and resid 33 and name HB3) 2.580 0.832 0.832 weight 1.000 ! spec=13c_...O_lp, no=149, id=1048, vol=2.945037e+08
or (segid " C" and resid 33 and name HN) (segid " C" and resid 33 and name HB2)
or (segid " C" and resid 33 and name HN) (segid " C" and resid 33 and name HB1)
assign (segid " C" and resid 33 and name HN) (segid " C" and resid 32 and name HB1) 3.263 1.331 1.331 weight 1.000 ! spec=13c_...O_lp, no=152, id=1049, vol=2.529659e+08
or (segid " C" and resid 33 and name HN) (segid " C" and resid 32 and name HB2)
or (segid " C" and resid 33 and name HN) (segid " C" and resid 32 and name HB3)
assign (segid " C" and resid 54 and name HN) (segid " C" and resid 54 and name HA) 2.650 0.878 0.878 weight 1.000 ! spec=13c_...O_lp, no=161, id=1052, vol=3.294790e+08
assign (segid " C" and resid 55 and name HN) (segid " C" and resid 54 and name HA) 3.330 1.386 1.386 weight 1.000 ! spec=13c_...O_lp, no=164, id=1053, vol=1.369263e+08
assign (segid " C" and resid 55 and name HN) (segid " C" and resid 55 and name HA) 2.821 0.995 0.995 weight 1.000 ! spec=13c_...O_lp, no=165, id=1054, vol=3.208181e+08
assign (segid " C" and resid 57 and name HN) (segid " C" and resid 57 and name HA) 2.537 0.805 0.805 weight 1.000 ! spec=13c_...O_lp, no=169, id=1055, vol=6.587516e+08
assign (segid " C" and resid 56 and name HN) (segid " C" and resid 56 and name HA) 2.670 0.891 0.891 weight 1.000 ! spec=13c_...O_lp, no=171, id=1056, vol=4.537352e+08
assign (segid " C" and resid 28 and name HN) (segid " C" and resid 28 and name HA) 2.677 0.895 0.895 weight 1.000 ! spec=13c_...O_lp, no=179, id=1057, vol=3.904633e+08
assign (segid " C" and resid 29 and name HN) (segid " C" and resid 28 and name HA) 3.141 1.233 1.233 weight 1.000 ! spec=13c_...O_lp, no=180, id=1058, vol=1.764794e+08
assign (segid " C" and resid 28 and name HN) (segid " C" and resid 28 and name HB) 3.388 1.435 1.435 weight 1.000 ! spec=13c_...O_lp, no=181, id=1059, vol=1.652316e+08
assign (segid " C" and resid 55 and name HN) (segid " C" and resid 55 and name HB1) 2.423 0.734 0.734 weight 1.000 ! spec=13c_...O_lp, no=184, id=1061, vol=6.961212e+08
assign (segid " C" and resid 39 and name HB2) (segid " C" and resid 40 and name HA) 3.907 1.908 1.908 weight 1.000 ! spec=2Dnoesy, no=4, id=841, vol=9.635700e+06
assign (segid " C" and resid 40 and name HE2) (segid " C" and resid 41 and name HD1) 4.691 2.750 2.750 weight 1.000 ! spec=2Dnoesy, no=10, id=844, vol=7.967437e+06
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 41 and name HD1)
assign (segid " C" and resid 40 and name HE2) (segid " C" and resid 40 and name HD2) 3.287 1.350 1.350 weight 1.000 ! spec=2Dnoesy, no=11, id=845, vol=6.383660e+07
or (segid " C" and resid 40 and name HE2) (segid " C" and resid 40 and name HD1)
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 40 and name HD2)
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 40 and name HD1)
assign (segid " C" and resid 40 and name HZ) (segid " C" and resid 40 and name HD2) 4.292 2.303 2.303 weight 1.000 ! spec=2Dnoesy, no=12, id=846, vol=1.053344e+07
or (segid " C" and resid 40 and name HZ) (segid " C" and resid 40 and name HD1)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 40 and name HD2) 3.411 1.454 1.454 weight 1.000 ! spec=2Dnoesy, no=14, id=847, vol=1.119661e+07
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 40 and name HD1)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 40 and name HD2)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 40 and name HD1)
assign (segid " C" and resid 40 and name HE2) (segid " C" and resid 36 and name HE3) 4.545 2.583 2.583 weight 1.000 ! spec=2Dnoesy, no=20, id=849, vol=7.386802e+06
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 36 and name HE3)
assign (segid " C" and resid 35 and name HD2) (segid " C" and resid 35 and name HA) 2.541 0.807 0.807 weight 1.000 ! spec=2Dnoesy, no=21, id=850, vol=5.785949e+07
assign (segid " C" and resid 34 and name HD1) (segid " C" and resid 40 and name HD2) 5.129 3.288 3.288 weight 1.000 ! spec=2Dnoesy, no=27, id=852, vol=6.054051e+06
or (segid " C" and resid 34 and name HD1) (segid " C" and resid 40 and name HD1)
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 40 and name HD2)
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 40 and name HD1)
assign (segid " C" and resid 36 and name HD1) (segid " C" and resid 40 and name HD2) 4.679 2.736 2.736 weight 1.000 ! spec=2Dnoesy, no=28, id=853, vol=8.198579e+06
or (segid " C" and resid 36 and name HD1) (segid " C" and resid 40 and name HD1)
assign (segid " C" and resid 36 and name HE3) (segid " C" and resid 40 and name HD2) 4.484 2.513 2.513 weight 1.000 ! spec=2Dnoesy, no=29, id=854, vol=6.933271e+06
or (segid " C" and resid 36 and name HE3) (segid " C" and resid 40 and name HD1)
assign (segid " C" and resid 40 and name HE2) (segid " C" and resid 40 and name HB2) 4.663 2.717 2.717 weight 1.000 ! spec=2Dnoesy, no=37, id=859, vol=6.182263e+06
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 40 and name HB2)
assign (segid " C" and resid 40 and name HE2) (segid " C" and resid 40 and name HB1) 4.104 2.106 2.106 weight 1.000 ! spec=2Dnoesy, no=38, id=860, vol=1.425762e+07
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 40 and name HB1)
assign (segid " C" and resid 46 and name HA) (segid " C" and resid 36 and name HD1) 4.322 2.335 2.335 weight 1.000 ! spec=2Dnoesy, no=43, id=864, vol=8.901892e+06
assign (segid " C" and resid 36 and name HD1) (segid " C" and resid 37 and name HG2) 3.168 1.255 1.255 weight 1.000 ! spec=2Dnoesy, no=46, id=867, vol=2.493790e+07
assign (segid " C" and resid 36 and name HD1) (segid " C" and resid 37 and name HG1) 3.560 1.584 1.584 weight 1.000 ! spec=2Dnoesy, no=48, id=868, vol=1.793559e+07
assign (segid " C" and resid 36 and name HD1) (segid " C" and resid 37 and name HB1) 4.520 2.554 2.554 weight 1.000 ! spec=2Dnoesy, no=49, id=869, vol=1.523849e+07
assign (segid " C" and resid 36 and name HD1) (segid " C" and resid 36 and name HB2) 2.304 0.664 0.664 weight 1.000 ! spec=2Dnoesy, no=50, id=870, vol=1.104936e+08
assign (segid " C" and resid 34 and name HD1) (segid " C" and resid 53 and name HB2) 4.349 2.364 2.364 weight 1.000 ! spec=2Dnoesy, no=68, id=884, vol=9.813789e+06
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 53 and name HB2)
assign (segid " C" and resid 34 and name HD1) (segid " C" and resid 32 and name HB1) 3.539 1.565 1.565 weight 1.000 ! spec=2Dnoesy, no=71, id=886, vol=1.303119e+07
or (segid " C" and resid 34 and name HD1) (segid " C" and resid 32 and name HB2)
or (segid " C" and resid 34 and name HD1) (segid " C" and resid 32 and name HB3)
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 32 and name HB1)
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 32 and name HB2)
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 32 and name HB3)
assign (segid " C" and resid 27 and name HB1) (segid " C" and resid 34 and name HE2) 3.493 1.525 1.525 weight 1.000 ! spec=2Dnoesy, no=76, id=888, vol=1.905256e+07
or (segid " C" and resid 27 and name HB1) (segid " C" and resid 34 and name HE1)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 39 and name HB1) 3.652 1.667 1.667 weight 1.000 ! spec=2Dnoesy, no=78, id=890, vol=1.726542e+07
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 39 and name HB1)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 53 and name HB2) 3.913 1.914 1.914 weight 1.000 ! spec=2Dnoesy, no=79, id=891, vol=8.768838e+06
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 53 and name HB2)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 32 and name HB1) 3.884 1.885 1.885 weight 1.000 ! spec=2Dnoesy, no=80, id=892, vol=9.792595e+06
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 32 and name HB2)
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 32 and name HB3)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 32 and name HB1)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 32 and name HB2)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 32 and name HB3)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 36 and name HE3) 2.992 1.119 1.119 weight 1.000 ! spec=2Dnoesy, no=83, id=893, vol=5.701377e+07
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 36 and name HE3)
assign (segid " C" and resid 36 and name HE3) (segid " C" and resid 36 and name HZ3) 2.658 0.883 0.883 weight 1.000 ! spec=2Dnoesy, no=86, id=895, vol=6.483669e+07
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 34 and name HD1) 2.869 1.029 1.029 weight 1.000 ! spec=2Dnoesy, no=88, id=897, vol=1.242705e+08
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 34 and name HD2)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 34 and name HD1)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 34 and name HD2)
assign (segid " C" and resid 40 and name HE2) (segid " C" and resid 34 and name HE2) 3.519 1.548 1.548 weight 1.000 ! spec=2Dnoesy, no=90, id=899, vol=2.919237e+07
or (segid " C" and resid 40 and name HE2) (segid " C" and resid 34 and name HE1)
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 34 and name HE2)
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 34 and name HE1)
assign (segid " C" and resid 36 and name HH2) (segid " C" and resid 36 and name HZ2) 2.427 0.737 0.737 weight 1.000 ! spec=2Dnoesy, no=91, id=900, vol=1.130627e+08
assign (segid " C" and resid 36 and name HZ2) (segid " C" and resid 36 and name HZ3) 3.949 1.949 1.949 weight 1.000 ! spec=2Dnoesy, no=94, id=903, vol=2.493657e+07
assign (segid " C" and resid 36 and name HH2) (segid " C" and resid 51 and name HA) 4.588 2.631 2.631 weight 1.000 ! spec=2Dnoesy, no=97, id=906, vol=7.553420e+06
assign (segid " C" and resid 36 and name HH2) (segid " C" and resid 46 and name HA) 4.353 2.369 2.369 weight 1.000 ! spec=2Dnoesy, no=99, id=908, vol=1.070667e+07
assign (segid " C" and resid 36 and name HZ2) (segid " C" and resid 47 and name HD2) 3.670 1.684 1.684 weight 1.000 ! spec=2Dnoesy, no=101, id=910, vol=7.431120e+06
assign (segid " C" and resid 36 and name HZ2) (segid " C" and resid 47 and name HD1) 4.565 2.605 2.605 weight 1.000 ! spec=2Dnoesy, no=103, id=912, vol=6.929764e+06
assign (segid " C" and resid 36 and name HH2) (segid " C" and resid 44 and name HG22) 3.813 1.818 1.818 weight 1.000 ! spec=2Dnoesy, no=105, id=914, vol=1.484059e+07
or (segid " C" and resid 36 and name HH2) (segid " C" and resid 44 and name HG21)
or (segid " C" and resid 36 and name HH2) (segid " C" and resid 44 and name HG23)
assign (segid " C" and resid 36 and name HZ2) (segid " C" and resid 51 and name HD11) 4.633 2.683 2.683 weight 1.000 ! spec=2Dnoesy, no=106, id=915, vol=6.689619e+06
or (segid " C" and resid 36 and name HZ2) (segid " C" and resid 51 and name HD13)
or (segid " C" and resid 36 and name HZ2) (segid " C" and resid 51 and name HD12)
assign (segid " C" and resid 36 and name HH2) (segid " C" and resid 51 and name HD11) 4.528 2.563 2.563 weight 1.000 ! spec=2Dnoesy, no=107, id=916, vol=8.922321e+06
or (segid " C" and resid 36 and name HH2) (segid " C" and resid 51 and name HD13)
or (segid " C" and resid 36 and name HH2) (segid " C" and resid 51 and name HD12)
assign (segid " C" and resid 39 and name HE1) (segid " C" and resid 39 and name HB2) 4.364 2.381 2.381 weight 1.000 ! spec=2Dnoesy, no=111, id=918, vol=1.436123e+07
assign (segid " C" and resid 39 and name HE1) (segid " C" and resid 32 and name HB1) 3.298 1.360 1.360 weight 1.000 ! spec=2Dnoesy, no=113, id=920, vol=1.486206e+07
or (segid " C" and resid 39 and name HE1) (segid " C" and resid 32 and name HB2)
or (segid " C" and resid 39 and name HE1) (segid " C" and resid 32 and name HB3)
assign (segid " C" and resid 35 and name HD2) (segid " C" and resid 35 and name HE1) 4.445 2.470 2.470 weight 1.000 ! spec=2Dnoesy, no=116, id=923, vol=7.430001e+06
assign (segid " C" and resid 35 and name HD2) (segid " C" and resid 35 and name HB2) 3.303 1.364 1.364 weight 1.000 ! spec=2Dnoesy, no=118, id=924, vol=2.113231e+07
assign (segid " C" and resid 35 and name HD2) (segid " C" and resid 24 and name HA) 2.401 0.721 0.721 weight 1.000 ! spec=2Dnoesy, no=119, id=925, vol=6.854174e+07
assign (segid " C" and resid 35 and name HD2) (segid " C" and resid 35 and name HB1) 3.185 1.268 1.268 weight 1.000 ! spec=2Dnoesy, no=120, id=926, vol=4.236687e+07
assign (segid " C" and resid 23 and name HB2) (segid " C" and resid 35 and name HD2) 3.707 1.718 2.293 weight 1.000 ! spec=2Dnoesy, no=123, id=929, vol=1.853489e+07
assign (segid " C" and resid 23 and name HB1) (segid " C" and resid 35 and name HD2) 3.604 1.623 2.396 weight 1.000 ! spec=2Dnoesy, no=125, id=931, vol=2.005657e+07
assign (segid " C" and resid 54 and name HN) (segid " C" and resid 39 and name HB1) 4.123 2.125 2.125 weight 1.000 ! spec=2dnoesy_H2O, no=9, id=945, vol=1.262720e+05
assign (segid " C" and resid 54 and name HN) (segid " C" and resid 54 and name HB1) 2.758 0.951 0.951 weight 1.000 ! spec=2dnoesy_H2O, no=11, id=946, vol=3.165230e+05
assign (segid " C" and resid 35 and name HE2) (segid " C" and resid 24 and name HG22) 2.804 0.983 0.983 weight 1.000 ! spec=2dnoesy_H2O, no=12, id=947, vol=1.983470e+05
or (segid " C" and resid 35 and name HE2) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 35 and name HE2) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 35 and name HE2) (segid " C" and resid 24 and name HG13) 4.193 2.198 2.198 weight 1.000 ! spec=2dnoesy_H2O, no=13, id=948, vol=6.466000e+04
or (segid " C" and resid 35 and name HE2) (segid " C" and resid 24 and name HG12)
or (segid " C" and resid 35 and name HE2) (segid " C" and resid 24 and name HG11)
assign (segid " C" and resid 35 and name HE2) (segid " C" and resid 35 and name HE1) 2.625 0.861 0.861 weight 1.000 ! spec=2dnoesy_H2O, no=15, id=950, vol=3.947530e+05
assign (segid " C" and resid 35 and name HE2) (segid " C" and resid 35 and name HD2) 2.455 0.753 0.753 weight 1.000 ! spec=2dnoesy_H2O, no=16, id=951, vol=5.734090e+05
assign (segid " C" and resid 35 and name HE2) (segid " C" and resid 24 and name HA) 3.485 1.518 1.518 weight 1.000 ! spec=2dnoesy_H2O, no=25, id=952, vol=7.694900e+04
assign (segid " C" and resid 35 and name HE2) (segid " C" and resid 20 and name HB2) 4.602 2.647 2.647 weight 1.000 ! spec=2dnoesy_H2O, no=26, id=953, vol=5.383500e+04
assign (segid " C" and resid 29 and name HN) (segid " C" and resid 28 and name HB) 3.859 1.862 1.862 weight 1.000 ! spec=2dnoesy_H2O, no=43, id=963, vol=7.774000e+04
assign (segid " C" and resid 36 and name HN) (segid " C" and resid 36 and name HD1) 4.392 2.411 2.411 weight 1.000 ! spec=2dnoesy_H2O, no=54, id=972, vol=8.590400e+04
assign (segid " C" and resid 52 and name HN) (segid " C" and resid 36 and name HZ3) 3.726 1.736 1.736 weight 1.000 ! spec=2dnoesy_H2O, no=57, id=975, vol=4.572200e+04
assign (segid " C" and resid 35 and name HD2) (segid " C" and resid 25 and name HN) 3.421 1.463 1.463 weight 1.000 ! spec=2dnoesy_H2O, no=62, id=977, vol=1.054570e+05
assign (segid " C" and resid 35 and name HD2) (segid " C" and resid 22 and name HN) 4.477 2.505 2.505 weight 1.000 ! spec=2dnoesy_H2O, no=63, id=978, vol=4.155800e+04
assign (segid " C" and resid 35 and name HD2) (segid " C" and resid 36 and name HN) 4.416 2.437 2.437 weight 1.000 ! spec=2dnoesy_H2O, no=64, id=979, vol=9.473400e+04
assign (segid " C" and resid 38 and name HN) (segid " C" and resid 36 and name HN) 3.847 1.850 1.850 weight 1.000 ! spec=2dnoesy_H2O, no=66, id=981, vol=7.920900e+04
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 34 and name HN) 3.178 1.262 1.262 weight 1.000 ! spec=2dnoesy_H2O, no=67, id=982, vol=2.599660e+05
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 34 and name HN)
assign (segid " C" and resid 36 and name HH2) (segid " C" and resid 36 and name HE1) 4.399 2.419 2.419 weight 1.000 ! spec=2dnoesy_H2O, no=69, id=983, vol=7.417600e+04
assign (segid " C" and resid 34 and name HD1) (segid " C" and resid 33 and name HA) 3.729 1.738 1.738 weight 1.000 ! spec=2dnoesy_H2O, no=72, id=985, vol=1.573010e+05
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 33 and name HA)
assign (segid " C" and resid 40 and name HD2) (segid " C" and resid 40 and name HB2) 2.795 0.976 0.976 weight 1.000 ! spec=2dnoesy_H2O, no=75, id=987, vol=5.171240e+05
or (segid " C" and resid 40 and name HD1) (segid " C" and resid 40 and name HB2)
assign (segid " C" and resid 40 and name HD2) (segid " C" and resid 39 and name HB1) 3.730 1.740 1.740 weight 1.000 ! spec=2dnoesy_H2O, no=76, id=988, vol=1.324820e+05
or (segid " C" and resid 40 and name HD1) (segid " C" and resid 39 and name HB1)
assign (segid " C" and resid 34 and name HN) (segid " C" and resid 24 and name HG22) 2.909 1.058 1.058 weight 1.000 ! spec=2dnoesy_H2O, no=77, id=989, vol=1.511080e+05
or (segid " C" and resid 34 and name HN) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 34 and name HN) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 34 and name HN) (segid " C" and resid 24 and name HG13) 3.764 1.771 1.771 weight 1.000 ! spec=2dnoesy_H2O, no=78, id=990, vol=1.031260e+05
or (segid " C" and resid 34 and name HN) (segid " C" and resid 24 and name HG12)
or (segid " C" and resid 34 and name HN) (segid " C" and resid 24 and name HG11)
assign (segid " C" and resid 22 and name HN) (segid " C" and resid 24 and name HG22) 3.578 1.600 1.600 weight 1.000 ! spec=2dnoesy_H2O, no=79, id=991, vol=8.124000e+04
or (segid " C" and resid 22 and name HN) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 22 and name HN) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 22 and name HN) (segid " C" and resid 24 and name HG13) 3.703 1.714 1.714 weight 1.000 ! spec=2dnoesy_H2O, no=80, id=992, vol=8.379400e+04
or (segid " C" and resid 22 and name HN) (segid " C" and resid 24 and name HG12)
or (segid " C" and resid 22 and name HN) (segid " C" and resid 24 and name HG11)
assign (segid " C" and resid 15 and name HN) (segid " C" and resid 24 and name HG22) 3.030 1.147 1.147 weight 1.000 ! spec=2dnoesy_H2O, no=83, id=994, vol=1.219290e+05
or (segid " C" and resid 15 and name HN) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 15 and name HN) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 35 and name HE1) (segid " C" and resid 24 and name HG22) 3.374 1.423 1.423 weight 1.000 ! spec=2dnoesy_H2O, no=84, id=995, vol=1.897000e+05
or (segid " C" and resid 35 and name HE1) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 35 and name HE1) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 15 and name HN) (segid " C" and resid 24 and name HG13) 3.907 1.908 1.908 weight 1.000 ! spec=2dnoesy_H2O, no=86, id=996, vol=5.305300e+04
or (segid " C" and resid 15 and name HN) (segid " C" and resid 24 and name HG12)
or (segid " C" and resid 15 and name HN) (segid " C" and resid 24 and name HG11)
assign (segid " C" and resid 24 and name HN) (segid " C" and resid 24 and name HG22) 3.147 1.238 1.238 weight 1.000 ! spec=2dnoesy_H2O, no=87, id=997, vol=1.734180e+05
or (segid " C" and resid 24 and name HN) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 24 and name HN) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 24 and name HN) (segid " C" and resid 24 and name HG13) 2.456 0.754 0.754 weight 1.000 ! spec=2dnoesy_H2O, no=88, id=998, vol=4.249100e+05
or (segid " C" and resid 24 and name HN) (segid " C" and resid 24 and name HG12)
or (segid " C" and resid 24 and name HN) (segid " C" and resid 24 and name HG11)
assign (segid " C" and resid 35 and name HD2) (segid " C" and resid 24 and name HG13) 4.006 2.006 2.006 weight 1.000 ! spec=2dnoesy_H2O, no=89, id=999, vol=1.367780e+05
or (segid " C" and resid 35 and name HD2) (segid " C" and resid 24 and name HG12)
or (segid " C" and resid 35 and name HD2) (segid " C" and resid 24 and name HG11)
assign (segid " C" and resid 35 and name HD2) (segid " C" and resid 24 and name HG22) 2.988 1.116 1.116 weight 1.000 ! spec=2dnoesy_H2O, no=90, id=1000, vol=2.488380e+05
or (segid " C" and resid 35 and name HD2) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 35 and name HD2) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 34 and name HD1) (segid " C" and resid 24 and name HG22) 4.992 3.115 3.115 weight 1.000 ! spec=2dnoesy_H2O, no=91, id=1001, vol=2.741400e+04
or (segid " C" and resid 34 and name HD1) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 34 and name HD1) (segid " C" and resid 24 and name HG21)
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 24 and name HG22)
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 34 and name HD2) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 53 and name HN) (segid " C" and resid 54 and name HN) 4.275 2.284 2.284 weight 1.000 ! spec=2dnoesy_H2O, no=95, id=1004, vol=5.463300e+04
assign (segid " C" and resid 22 and name HA) (segid " C" and resid 23 and name HN) 2.288 0.654 0.654 weight 1.000 ! spec=2dnoesy_H2O, no=97, id=1005, vol=7.902640e+05
assign (segid " C" and resid 23 and name HN) (segid " C" and resid 22 and name HG23) 2.917 1.064 1.064 weight 1.000 ! spec=2dnoesy_H2O, no=98, id=1006, vol=2.521420e+05
or (segid " C" and resid 23 and name HN) (segid " C" and resid 22 and name HG21)
or (segid " C" and resid 23 and name HN) (segid " C" and resid 22 and name HG22)
assign (segid " C" and resid 23 and name HN) (segid " C" and resid 23 and name HA) 2.334 0.681 0.681 weight 1.000 ! spec=2dnoesy_H2O, no=99, id=1007, vol=8.198990e+05
assign (segid " C" and resid 5 and name HN) (segid " C" and resid 5 and name HA1) 2.717 0.923 0.923 weight 1.000 ! spec=N_noesy, no=8, id=1, vol=3.005737e+08
assign (segid " C" and resid 5 and name HN) (segid " C" and resid 4 and name HA) 2.645 0.874 0.874 weight 1.000 ! spec=N_noesy, no=9, id=2, vol=2.573964e+08
assign (segid " C" and resid 4 and name HN) (segid " C" and resid 3 and name HA) 2.668 0.890 0.890 weight 1.000 ! spec=N_noesy, no=10, id=3, vol=2.332335e+08
assign (segid " C" and resid 6 and name HN) (segid " C" and resid 6 and name HA) 3.053 1.165 1.165 weight 1.000 ! spec=N_noesy, no=12, id=5, vol=1.153067e+08
assign (segid " C" and resid 7 and name HN) (segid " C" and resid 7 and name HA) 2.553 0.815 0.815 weight 1.000 ! spec=N_noesy, no=16, id=9, vol=4.297493e+08
assign (segid " C" and resid 7 and name HN) (segid " C" and resid 6 and name HN) 2.536 0.804 0.804 weight 1.000 ! spec=N_noesy, no=20, id=12, vol=2.518946e+08
assign (segid " C" and resid 8 and name HN) (segid " C" and resid 7 and name HA) 2.520 0.794 0.794 weight 1.000 ! spec=N_noesy, no=23, id=13, vol=2.716744e+08
assign (segid " C" and resid 9 and name HN) (segid " C" and resid 9 and name HA) 2.735 0.935 0.935 weight 1.000 ! spec=N_noesy, no=29, id=17, vol=1.900873e+08
assign (segid " C" and resid 9 and name HN) (segid " C" and resid 9 and name HB1) 2.195 0.602 0.602 weight 1.000 ! spec=N_noesy, no=31, id=18, vol=6.089324e+08
assign (segid " C" and resid 10 and name HN) (segid " C" and resid 9 and name HA) 2.183 0.596 0.596 weight 1.000 ! spec=N_noesy, no=34, id=21, vol=7.920663e+08
assign (segid " C" and resid 10 and name HN) (segid " C" and resid 10 and name HA) 2.603 0.847 0.847 weight 1.000 ! spec=N_noesy, no=35, id=22, vol=2.656656e+08
assign (segid " C" and resid 10 and name HN) (segid " C" and resid 10 and name HB1) 2.354 0.693 0.693 weight 1.000 ! spec=N_noesy, no=39, id=24, vol=4.768193e+08
or (segid " C" and resid 10 and name HN) (segid " C" and resid 10 and name HB3)
or (segid " C" and resid 10 and name HN) (segid " C" and resid 10 and name HB2)
assign (segid " C" and resid 12 and name HN) (segid " C" and resid 11 and name HA) 2.536 0.804 0.804 weight 1.000 ! spec=N_noesy, no=47, id=26, vol=3.196201e+08
assign (segid " C" and resid 12 and name HN) (segid " C" and resid 11 and name HB1) 4.294 2.305 2.305 weight 1.000 ! spec=N_noesy, no=52, id=27, vol=3.681756e+07
assign (segid " C" and resid 12 and name HN) (segid " C" and resid 10 and name HB1) 3.352 1.404 1.404 weight 1.000 ! spec=N_noesy, no=54, id=28, vol=2.881973e+07
or (segid " C" and resid 12 and name HN) (segid " C" and resid 10 and name HB3)
or (segid " C" and resid 12 and name HN) (segid " C" and resid 10 and name HB2)
assign (segid " C" and resid 13 and name HN) (segid " C" and resid 13 and name HB1) 2.237 0.626 0.626 weight 1.000 ! spec=N_noesy, no=57, id=31, vol=6.014098e+08
or (segid " C" and resid 13 and name HN) (segid " C" and resid 13 and name HB3)
or (segid " C" and resid 13 and name HN) (segid " C" and resid 13 and name HB2)
assign (segid " C" and resid 14 and name HN) (segid " C" and resid 13 and name HA) 2.344 0.687 0.687 weight 1.000 ! spec=N_noesy, no=64, id=32, vol=5.430711e+08
assign (segid " C" and resid 17 and name HN) (segid " C" and resid 17 and name HB) 2.228 0.620 0.620 weight 1.000 ! spec=N_noesy, no=81, id=36, vol=5.425911e+08
assign (segid " C" and resid 17 and name HN) (segid " C" and resid 17 and name HG23) 2.309 0.666 0.666 weight 1.000 ! spec=N_noesy, no=82, id=37, vol=6.113819e+08
or (segid " C" and resid 17 and name HN) (segid " C" and resid 17 and name HG22)
or (segid " C" and resid 17 and name HN) (segid " C" and resid 17 and name HG21)
assign (segid " C" and resid 17 and name HN) (segid " C" and resid 18 and name HN) 2.360 0.696 0.696 weight 1.000 ! spec=N_noesy, no=83, id=38, vol=4.461282e+08
assign (segid " C" and resid 17 and name HN) (segid " C" and resid 39 and name HD2) 4.164 2.167 2.167 weight 1.000 ! spec=N_noesy, no=86, id=39, vol=3.105959e+07
assign (segid " C" and resid 17 and name HN) (segid " C" and resid 15 and name HB1) 3.770 1.777 1.777 weight 1.000 ! spec=N_noesy, no=87, id=40, vol=4.565804e+07
assign (segid " C" and resid 17 and name HN) (segid " C" and resid 18 and name HB2) 4.140 2.143 2.143 weight 1.000 ! spec=N_noesy, no=89, id=41, vol=9.439666e+07
assign (segid " C" and resid 18 and name HN) (segid " C" and resid 18 and name HA) 3.189 1.271 1.271 weight 1.000 ! spec=N_noesy, no=90, id=42, vol=1.013541e+08
assign (segid " C" and resid 18 and name HN) (segid " C" and resid 17 and name HB) 2.244 0.630 0.630 weight 1.000 ! spec=N_noesy, no=92, id=43, vol=4.915355e+08
assign (segid " C" and resid 18 and name HN) (segid " C" and resid 17 and name HA) 3.206 1.285 1.285 weight 1.000 ! spec=N_noesy, no=93, id=44, vol=1.156452e+08
assign (segid " C" and resid 18 and name HN) (segid " C" and resid 18 and name HB2) 2.990 1.117 1.117 weight 1.000 ! spec=N_noesy, no=94, id=45, vol=2.172964e+08
assign (segid " C" and resid 18 and name HN) (segid " C" and resid 18 and name HB1) 3.076 1.182 1.182 weight 1.000 ! spec=N_noesy, no=96, id=46, vol=1.298738e+08
assign (segid " C" and resid 18 and name HN) (segid " C" and resid 19 and name HN) 2.301 0.662 0.662 weight 1.000 ! spec=N_noesy, no=99, id=48, vol=3.842233e+08
assign (segid " C" and resid 19 and name HN) (segid " C" and resid 19 and name HA1) 2.187 0.598 0.598 weight 1.000 ! spec=N_noesy, no=103, id=50, vol=5.521662e+08
assign (segid " C" and resid 19 and name HN) (segid " C" and resid 19 and name HA2) 2.768 0.958 0.958 weight 1.000 ! spec=N_noesy, no=104, id=51, vol=3.293723e+08
assign (segid " C" and resid 19 and name HN) (segid " C" and resid 18 and name HA) 3.838 1.842 1.842 weight 1.000 ! spec=N_noesy, no=105, id=52, vol=5.454465e+07
assign (segid " C" and resid 19 and name HN) (segid " C" and resid 15 and name HB1) 2.854 1.018 1.018 weight 1.000 ! spec=N_noesy, no=107, id=54, vol=1.092066e+08
assign (segid " C" and resid 19 and name HN) (segid " C" and resid 20 and name HN) 2.474 0.765 0.765 weight 1.000 ! spec=N_noesy, no=108, id=55, vol=2.652433e+08
assign (segid " C" and resid 19 and name HN) (segid " C" and resid 17 and name HB) 4.139 2.141 2.141 weight 1.000 ! spec=N_noesy, no=109, id=56, vol=8.181690e+07
assign (segid " C" and resid 20 and name HN) (segid " C" and resid 20 and name HA) 2.786 0.970 0.970 weight 1.000 ! spec=N_noesy, no=111, id=57, vol=2.033098e+08
assign (segid " C" and resid 20 and name HN) (segid " C" and resid 19 and name HA1) 3.202 1.282 1.282 weight 1.000 ! spec=N_noesy, no=114, id=60, vol=1.210196e+08
assign (segid " C" and resid 20 and name HN) (segid " C" and resid 19 and name HA2) 3.455 1.492 1.492 weight 1.000 ! spec=N_noesy, no=115, id=61, vol=1.065829e+08
assign (segid " C" and resid 20 and name HN) (segid " C" and resid 15 and name HB1) 2.816 0.991 0.991 weight 1.000 ! spec=N_noesy, no=116, id=62, vol=1.719275e+08
assign (segid " C" and resid 20 and name HN) (segid " C" and resid 20 and name HB2) 2.321 0.673 0.673 weight 1.000 ! spec=N_noesy, no=117, id=63, vol=4.385608e+08
assign (segid " C" and resid 20 and name HN) (segid " C" and resid 20 and name HB1) 3.029 1.147 1.147 weight 1.000 ! spec=N_noesy, no=118, id=64, vol=3.227409e+08
assign (segid " C" and resid 20 and name HN) (segid " C" and resid 15 and name HB2) 4.532 2.568 2.568 weight 1.000 ! spec=N_noesy, no=119, id=65, vol=5.925767e+07
assign (segid " C" and resid 20 and name HN) (segid " C" and resid 24 and name HG22) 4.563 2.602 2.602 weight 1.000 ! spec=N_noesy, no=121, id=66, vol=2.367656e+07
or (segid " C" and resid 20 and name HN) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 20 and name HN) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 21 and name HN) (segid " C" and resid 21 and name HA2) 2.987 1.115 1.115 weight 1.000 ! spec=N_noesy, no=123, id=67, vol=2.172949e+08
assign (segid " C" and resid 21 and name HN) (segid " C" and resid 20 and name HB1) 3.605 1.624 1.624 weight 1.000 ! spec=N_noesy, no=125, id=69, vol=5.282141e+07
assign (segid " C" and resid 21 and name HN) (segid " C" and resid 20 and name HB2) 3.871 1.873 1.873 weight 1.000 ! spec=N_noesy, no=126, id=70, vol=1.055232e+08
assign (segid " C" and resid 21 and name HN) (segid " C" and resid 14 and name HG2) 3.421 1.463 1.463 weight 1.000 ! spec=N_noesy, no=127, id=71, vol=1.114003e+08
assign (segid " C" and resid 21 and name HN) (segid " C" and resid 24 and name HG22) 4.260 2.268 2.268 weight 1.000 ! spec=N_noesy, no=128, id=72, vol=5.426303e+07
or (segid " C" and resid 21 and name HN) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 21 and name HN) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 22 and name HN) (segid " C" and resid 22 and name HA) 2.555 0.816 0.816 weight 1.000 ! spec=N_noesy, no=131, id=73, vol=3.493332e+08
assign (segid " C" and resid 22 and name HN) (segid " C" and resid 21 and name HA1) 3.079 1.185 1.185 weight 1.000 ! spec=N_noesy, no=132, id=74, vol=1.849062e+08
assign (segid " C" and resid 22 and name HN) (segid " C" and resid 20 and name HB1) 3.857 1.859 1.859 weight 1.000 ! spec=N_noesy, no=133, id=75, vol=2.545969e+07
assign (segid " C" and resid 22 and name HN) (segid " C" and resid 20 and name HB2) 4.807 2.888 2.888 weight 1.000 ! spec=N_noesy, no=134, id=76, vol=2.219388e+07
assign (segid " C" and resid 22 and name HN) (segid " C" and resid 22 and name HB) 2.456 0.754 0.754 weight 1.000 ! spec=N_noesy, no=135, id=77, vol=4.083789e+08
assign (segid " C" and resid 22 and name HN) (segid " C" and resid 22 and name HG23) 3.075 1.182 1.182 weight 1.000 ! spec=N_noesy, no=140, id=78, vol=1.181852e+08
or (segid " C" and resid 22 and name HN) (segid " C" and resid 22 and name HG21)
or (segid " C" and resid 22 and name HN) (segid " C" and resid 22 and name HG22)
assign (segid " C" and resid 23 and name HN) (segid " C" and resid 24 and name HN) 3.035 1.152 1.152 weight 1.000 ! spec=N_noesy, no=145, id=80, vol=1.506783e+08
assign (segid " C" and resid 23 and name HN) (segid " C" and resid 23 and name HB1) 3.337 1.392 1.392 weight 1.000 ! spec=N_noesy, no=147, id=82, vol=9.583107e+07
assign (segid " C" and resid 23 and name HN) (segid " C" and resid 23 and name HB2) 4.048 2.049 2.049 weight 1.000 ! spec=N_noesy, no=148, id=83, vol=7.681902e+07
assign (segid " C" and resid 24 and name HN) (segid " C" and resid 24 and name HA) 3.265 1.332 1.332 weight 1.000 ! spec=N_noesy, no=152, id=84, vol=6.856958e+07
assign (segid " C" and resid 24 and name HN) (segid " C" and resid 23 and name HA) 3.075 1.182 1.182 weight 1.000 ! spec=N_noesy, no=155, id=85, vol=1.190882e+08
assign (segid " C" and resid 24 and name HN) (segid " C" and resid 24 and name HB) 3.494 1.526 1.526 weight 1.000 ! spec=N_noesy, no=159, id=87, vol=4.595159e+07
assign (segid " C" and resid 25 and name HN) (segid " C" and resid 25 and name HA) 3.185 1.268 1.268 weight 1.000 ! spec=N_noesy, no=162, id=90, vol=8.155249e+07
assign (segid " C" and resid 25 and name HN) (segid " C" and resid 34 and name HN) 2.938 1.079 1.079 weight 1.000 ! spec=N_noesy, no=163, id=91, vol=1.292188e+08
assign (segid " C" and resid 25 and name HN) (segid " C" and resid 35 and name HB2) 4.404 2.424 2.424 weight 1.000 ! spec=N_noesy, no=167, id=93, vol=3.882731e+07
assign (segid " C" and resid 25 and name HN) (segid " C" and resid 25 and name HG) 2.418 0.731 0.731 weight 1.000 ! spec=N_noesy, no=168, id=94, vol=3.803068e+08
assign (segid " C" and resid 25 and name HN) (segid " C" and resid 25 and name HB1) 2.652 0.879 0.879 weight 1.000 ! spec=N_noesy, no=169, id=95, vol=1.731219e+08
assign (segid " C" and resid 26 and name HN) (segid " C" and resid 26 and name HA) 2.951 1.089 1.089 weight 1.000 ! spec=N_noesy, no=172, id=98, vol=1.350581e+08
assign (segid " C" and resid 26 and name HN) (segid " C" and resid 25 and name HA) 2.300 0.661 0.661 weight 1.000 ! spec=N_noesy, no=173, id=99, vol=5.613304e+08
assign (segid " C" and resid 26 and name HN) (segid " C" and resid 25 and name HB1) 3.084 1.189 1.189 weight 1.000 ! spec=N_noesy, no=175, id=101, vol=3.909794e+08
assign (segid " C" and resid 27 and name HN) (segid " C" and resid 27 and name HA) 3.059 1.170 1.170 weight 1.000 ! spec=N_noesy, no=184, id=103, vol=1.330915e+08
assign (segid " C" and resid 27 and name HN) (segid " C" and resid 32 and name HB1) 3.135 1.228 1.228 weight 1.000 ! spec=N_noesy, no=189, id=107, vol=1.356516e+08
or (segid " C" and resid 27 and name HN) (segid " C" and resid 32 and name HB2)
or (segid " C" and resid 27 and name HN) (segid " C" and resid 32 and name HB3)
assign (segid " C" and resid 27 and name HN) (segid " C" and resid 34 and name HE2) 3.660 1.674 1.674 weight 1.000 ! spec=N_noesy, no=191, id=108, vol=7.673758e+07
or (segid " C" and resid 27 and name HN) (segid " C" and resid 34 and name HE1)
assign (segid " C" and resid 28 and name HN) (segid " C" and resid 27 and name HA) 2.094 0.548 0.548 weight 1.000 ! spec=N_noesy, no=196, id=109, vol=9.365889e+08
assign (segid " C" and resid 28 and name HN) (segid " C" and resid 52 and name HA) 2.865 1.026 1.026 weight 1.000 ! spec=N_noesy, no=197, id=110, vol=1.630539e+08
assign (segid " C" and resid 28 and name HN) (segid " C" and resid 27 and name HB2) 4.032 2.032 2.032 weight 1.000 ! spec=N_noesy, no=200, id=111, vol=4.589749e+07
assign (segid " C" and resid 28 and name HN) (segid " C" and resid 29 and name HN) 2.521 0.794 0.794 weight 1.000 ! spec=N_noesy, no=206, id=113, vol=2.821986e+08
assign (segid " C" and resid 28 and name HN) (segid " C" and resid 51 and name HD22) 4.269 2.278 2.278 weight 1.000 ! spec=N_noesy, no=209, id=114, vol=4.616975e+07
or (segid " C" and resid 28 and name HN) (segid " C" and resid 51 and name HD23)
or (segid " C" and resid 28 and name HN) (segid " C" and resid 51 and name HD21)
assign (segid " C" and resid 29 and name HN) (segid " C" and resid 29 and name HA) 3.045 1.159 1.159 weight 1.000 ! spec=N_noesy, no=212, id=115, vol=1.364943e+08
assign (segid " C" and resid 29 and name HN) (segid " C" and resid 29 and name HB2) 2.402 0.721 0.721 weight 1.000 ! spec=N_noesy, no=215, id=117, vol=3.339445e+08
assign (segid " C" and resid 29 and name HN) (segid " C" and resid 29 and name HB1) 3.233 1.306 1.306 weight 1.000 ! spec=N_noesy, no=216, id=118, vol=3.771428e+08
assign (segid " C" and resid 29 and name HN) (segid " C" and resid 52 and name HA) 3.482 1.515 1.515 weight 1.000 ! spec=N_noesy, no=221, id=119, vol=5.719670e+07
assign (segid " C" and resid 29 and name HN) (segid " C" and resid 29 and name HD2) 2.979 1.109 1.109 weight 1.000 ! spec=N_noesy, no=222, id=120, vol=1.134568e+08
assign (segid " C" and resid 30 and name HN) (segid " C" and resid 29 and name HB1) 3.138 1.231 1.231 weight 1.000 ! spec=N_noesy, no=228, id=121, vol=2.654759e+08
assign (segid " C" and resid 30 and name HN) (segid " C" and resid 29 and name HB2) 2.545 0.810 0.810 weight 1.000 ! spec=N_noesy, no=229, id=122, vol=3.962885e+08
assign (segid " C" and resid 30 and name HN) (segid " C" and resid 30 and name HB1) 2.791 0.974 0.974 weight 1.000 ! spec=N_noesy, no=231, id=123, vol=1.901763e+08
assign (segid " C" and resid 30 and name HN) (segid " C" and resid 27 and name HB2) 2.687 0.903 0.903 weight 1.000 ! spec=N_noesy, no=232, id=124, vol=1.794630e+08
assign (segid " C" and resid 30 and name HN) (segid " C" and resid 28 and name HG23) 4.054 2.055 2.055 weight 1.000 ! spec=N_noesy, no=233, id=125, vol=9.002534e+07
or (segid " C" and resid 30 and name HN) (segid " C" and resid 28 and name HG21)
or (segid " C" and resid 30 and name HN) (segid " C" and resid 28 and name HG22)
assign (segid " C" and resid 30 and name HN) (segid " C" and resid 31 and name HN) 2.632 0.866 3.368 weight 1.000 ! spec=N_noesy, no=235, id=126, vol=5.733515e+08
assign (segid " C" and resid 30 and name HN) (segid " C" and resid 29 and name HN) 2.273 0.646 0.646 weight 1.000 ! spec=N_noesy, no=238, id=127, vol=5.348076e+08
assign (segid " C" and resid 31 and name HN) (segid " C" and resid 27 and name HB2) 2.965 1.099 1.099 weight 1.000 ! spec=N_noesy, no=240, id=129, vol=1.476976e+08
assign (segid " C" and resid 31 and name HN) (segid " C" and resid 31 and name HB2) 2.724 0.928 0.928 weight 1.000 ! spec=N_noesy, no=241, id=130, vol=1.952485e+08
or (segid " C" and resid 31 and name HN) (segid " C" and resid 31 and name HB1)
or (segid " C" and resid 31 and name HN) (segid " C" and resid 31 and name HB3)
assign (segid " C" and resid 31 and name HN) (segid " C" and resid 27 and name HB1) 3.943 1.944 1.944 weight 1.000 ! spec=N_noesy, no=242, id=131, vol=6.783035e+07
assign (segid " C" and resid 31 and name HN) (segid " C" and resid 30 and name HB1) 5.352 3.581 3.581 weight 1.000 ! spec=N_noesy, no=244, id=132, vol=3.188777e+07
assign (segid " C" and resid 31 and name HN) (segid " C" and resid 30 and name HA) 3.838 1.841 1.841 weight 1.000 ! spec=N_noesy, no=247, id=133, vol=4.248320e+07
assign (segid " C" and resid 31 and name HN) (segid " C" and resid 32 and name HN) 3.481 1.514 1.514 weight 1.000 ! spec=N_noesy, no=253, id=135, vol=1.288828e+08
assign (segid " C" and resid 32 and name HN) (segid " C" and resid 31 and name HA) 2.670 0.891 0.891 weight 1.000 ! spec=N_noesy, no=255, id=136, vol=2.098885e+08
assign (segid " C" and resid 32 and name HN) (segid " C" and resid 27 and name HB2) 2.875 1.033 1.033 weight 1.000 ! spec=N_noesy, no=256, id=137, vol=2.033714e+08
assign (segid " C" and resid 32 and name HN) (segid " C" and resid 27 and name HB1) 3.466 1.502 1.502 weight 1.000 ! spec=N_noesy, no=259, id=139, vol=8.433748e+07
assign (segid " C" and resid 32 and name HN) (segid " C" and resid 32 and name HB1) 2.495 0.778 0.778 weight 1.000 ! spec=N_noesy, no=260, id=140, vol=3.758306e+08
or (segid " C" and resid 32 and name HN) (segid " C" and resid 32 and name HB2)
or (segid " C" and resid 32 and name HN) (segid " C" and resid 32 and name HB3)
assign (segid " C" and resid 33 and name HN) (segid " C" and resid 33 and name HA) 3.320 1.378 1.378 weight 1.000 ! spec=N_noesy, no=264, id=141, vol=5.916105e+07
assign (segid " C" and resid 34 and name HN) (segid " C" and resid 34 and name HA) 3.016 1.137 1.137 weight 1.000 ! spec=N_noesy, no=273, id=145, vol=1.004483e+08
assign (segid " C" and resid 34 and name HN) (segid " C" and resid 34 and name HD1) 3.262 1.330 1.330 weight 1.000 ! spec=N_noesy, no=275, id=147, vol=1.532164e+08
or (segid " C" and resid 34 and name HN) (segid " C" and resid 34 and name HD2)
assign (segid " C" and resid 34 and name HN) (segid " C" and resid 33 and name HB3) 3.469 1.504 1.504 weight 1.000 ! spec=N_noesy, no=280, id=151, vol=1.426475e+08
or (segid " C" and resid 34 and name HN) (segid " C" and resid 33 and name HB2)
or (segid " C" and resid 34 and name HN) (segid " C" and resid 33 and name HB1)
assign (segid " C" and resid 34 and name HN) (segid " C" and resid 34 and name HB2) 3.002 1.127 1.127 weight 1.000 ! spec=N_noesy, no=281, id=152, vol=1.574946e+08
assign (segid " C" and resid 34 and name HN) (segid " C" and resid 34 and name HB1) 3.548 1.573 1.573 weight 1.000 ! spec=N_noesy, no=284, id=153, vol=5.592865e+07
assign (segid " C" and resid 34 and name HN) (segid " C" and resid 24 and name HA) 4.316 2.328 2.328 weight 1.000 ! spec=N_noesy, no=286, id=155, vol=2.943734e+07
assign (segid " C" and resid 35 and name HN) (segid " C" and resid 34 and name HB1) 3.689 1.701 1.701 weight 1.000 ! spec=N_noesy, no=295, id=156, vol=3.874456e+07
assign (segid " C" and resid 36 and name HN) (segid " C" and resid 25 and name HB1) 2.734 0.934 0.934 weight 1.000 ! spec=N_noesy, no=298, id=157, vol=1.994637e+08
assign (segid " C" and resid 36 and name HN) (segid " C" and resid 25 and name HG) 3.234 1.307 1.307 weight 1.000 ! spec=N_noesy, no=299, id=158, vol=8.241264e+07
assign (segid " C" and resid 36 and name HN) (segid " C" and resid 36 and name HA) 2.754 0.948 0.948 weight 1.000 ! spec=N_noesy, no=302, id=160, vol=2.150246e+08
assign (segid " C" and resid 36 and name HN) (segid " C" and resid 35 and name HA) 2.380 0.708 0.708 weight 1.000 ! spec=N_noesy, no=303, id=161, vol=3.665911e+08
assign (segid " C" and resid 36 and name HN) (segid " C" and resid 37 and name HN) 2.699 0.910 0.910 weight 1.000 ! spec=N_noesy, no=306, id=162, vol=1.873800e+08
assign (segid " C" and resid 37 and name HN) (segid " C" and resid 37 and name HA) 2.527 0.798 0.798 weight 1.000 ! spec=N_noesy, no=309, id=163, vol=3.799235e+08
assign (segid " C" and resid 37 and name HN) (segid " C" and resid 35 and name HA) 3.899 1.901 1.901 weight 1.000 ! spec=N_noesy, no=310, id=164, vol=5.146800e+07
assign (segid " C" and resid 37 and name HN) (segid " C" and resid 35 and name HB2) 2.950 1.088 1.088 weight 1.000 ! spec=N_noesy, no=311, id=165, vol=1.107570e+08
assign (segid " C" and resid 37 and name HN) (segid " C" and resid 38 and name HN) 2.477 0.767 0.767 weight 1.000 ! spec=N_noesy, no=316, id=167, vol=3.052213e+08
assign (segid " C" and resid 37 and name HN) (segid " C" and resid 39 and name HN) 3.766 1.773 1.773 weight 1.000 ! spec=N_noesy, no=317, id=168, vol=6.563750e+07
assign (segid " C" and resid 38 and name HN) (segid " C" and resid 38 and name HA) 3.100 1.201 1.201 weight 1.000 ! spec=N_noesy, no=327, id=169, vol=1.154714e+08
assign (segid " C" and resid 38 and name HN) (segid " C" and resid 35 and name HB2) 3.005 1.128 1.128 weight 1.000 ! spec=N_noesy, no=328, id=170, vol=1.711345e+08
assign (segid " C" and resid 38 and name HN) (segid " C" and resid 39 and name HB2) 5.547 3.846 3.846 weight 1.000 ! spec=N_noesy, no=333, id=171, vol=3.131097e+07
assign (segid " C" and resid 38 and name HN) (segid " C" and resid 35 and name HN) 4.257 2.265 2.265 weight 1.000 ! spec=N_noesy, no=338, id=174, vol=3.293818e+07
assign (segid " C" and resid 38 and name HN) (segid " C" and resid 40 and name HN) 4.079 2.079 2.079 weight 1.000 ! spec=N_noesy, no=339, id=175, vol=5.962231e+07
assign (segid " C" and resid 39 and name HN) (segid " C" and resid 39 and name HB2) 3.142 1.234 1.234 weight 1.000 ! spec=N_noesy, no=343, id=178, vol=4.572028e+08
assign (segid " C" and resid 39 and name HN) (segid " C" and resid 38 and name HB1) 2.672 0.893 0.893 weight 1.000 ! spec=N_noesy, no=344, id=179, vol=2.271996e+08
assign (segid " C" and resid 39 and name HN) (segid " C" and resid 39 and name HB1) 2.554 0.816 0.816 weight 1.000 ! spec=N_noesy, no=349, id=181, vol=2.188595e+08
assign (segid " C" and resid 38 and name HN) (segid " C" and resid 39 and name HN) 2.238 0.626 0.626 weight 1.000 ! spec=N_noesy, no=352, id=182, vol=5.524500e+08
assign (segid " C" and resid 39 and name HN) (segid " C" and resid 39 and name HD2) 2.801 0.981 0.981 weight 1.000 ! spec=N_noesy, no=353, id=183, vol=1.990074e+08
assign (segid " C" and resid 40 and name HN) (segid " C" and resid 37 and name HA) 2.707 0.916 0.916 weight 1.000 ! spec=N_noesy, no=356, id=186, vol=2.438214e+08
assign (segid " C" and resid 39 and name HN) (segid " C" and resid 40 and name HN) 2.214 0.613 0.613 weight 1.000 ! spec=N_noesy, no=358, id=187, vol=6.794564e+08
assign (segid " C" and resid 40 and name HN) (segid " C" and resid 40 and name HE2) 3.573 1.596 1.596 weight 1.000 ! spec=N_noesy, no=359, id=188, vol=1.349053e+08
or (segid " C" and resid 40 and name HN) (segid " C" and resid 40 and name HE1)
assign (segid " C" and resid 40 and name HN) (segid " C" and resid 40 and name HD2) 3.301 1.362 1.362 weight 1.000 ! spec=N_noesy, no=360, id=189, vol=1.916358e+08
or (segid " C" and resid 40 and name HN) (segid " C" and resid 40 and name HD1)
assign (segid " C" and resid 40 and name HN) (segid " C" and resid 40 and name HB1) 2.602 0.846 0.846 weight 1.000 ! spec=N_noesy, no=361, id=190, vol=3.262559e+08
assign (segid " C" and resid 40 and name HN) (segid " C" and resid 40 and name HB2) 3.104 1.204 1.204 weight 1.000 ! spec=N_noesy, no=363, id=191, vol=3.448734e+08
assign (segid " C" and resid 25 and name HN) (segid " C" and resid 33 and name HA) 3.968 1.968 1.968 weight 1.000 ! spec=N_noesy, no=364, id=192, vol=4.903418e+07
assign (segid " C" and resid 36 and name HE1) (segid " C" and resid 36 and name HD1) 2.262 0.640 0.640 weight 1.000 ! spec=N_noesy, no=365, id=193, vol=8.013431e+08
assign (segid " C" and resid 36 and name HE1) (segid " C" and resid 36 and name HZ2) 2.522 0.795 0.795 weight 1.000 ! spec=N_noesy, no=366, id=194, vol=3.934162e+08
assign (segid " C" and resid 42 and name HN) (segid " C" and resid 41 and name HA) 2.320 0.673 3.680 weight 1.000 ! spec=N_noesy, no=370, id=196, vol=6.866947e+08
assign (segid " C" and resid 42 and name HN) (segid " C" and resid 42 and name HB3) 2.215 0.613 0.613 weight 1.000 ! spec=N_noesy, no=371, id=197, vol=6.800729e+08
or (segid " C" and resid 42 and name HN) (segid " C" and resid 42 and name HB1)
or (segid " C" and resid 42 and name HN) (segid " C" and resid 42 and name HB2)
assign (segid " C" and resid 42 and name HN) (segid " C" and resid 41 and name HB1) 2.983 1.112 3.017 weight 1.000 ! spec=N_noesy, no=373, id=199, vol=1.373724e+08
assign (segid " C" and resid 44 and name HN) (segid " C" and resid 45 and name HA) 2.498 0.780 3.502 weight 1.000 ! spec=N_noesy, no=384, id=201, vol=4.758714e+08
assign (segid " C" and resid 44 and name HN) (segid " C" and resid 43 and name HA1) 3.106 1.206 1.206 weight 1.000 ! spec=N_noesy, no=386, id=202, vol=2.304368e+08
assign (segid " C" and resid 44 and name HN) (segid " C" and resid 44 and name HG22) 3.387 1.434 1.434 weight 1.000 ! spec=N_noesy, no=390, id=203, vol=1.815797e+08
or (segid " C" and resid 44 and name HN) (segid " C" and resid 44 and name HG21)
or (segid " C" and resid 44 and name HN) (segid " C" and resid 44 and name HG23)
assign (segid " C" and resid 44 and name HN) (segid " C" and resid 42 and name HN) 3.479 1.513 1.513 weight 1.000 ! spec=N_noesy, no=396, id=204, vol=2.078323e+08
assign (segid " C" and resid 44 and name HN) (segid " C" and resid 36 and name HE1) 4.067 2.067 2.067 weight 1.000 ! spec=N_noesy, no=397, id=205, vol=3.222981e+07
assign (segid " C" and resid 45 and name HN) (segid " C" and resid 44 and name HA) 2.243 0.629 0.629 weight 1.000 ! spec=N_noesy, no=401, id=206, vol=6.817724e+08
assign (segid " C" and resid 45 and name HN) (segid " C" and resid 44 and name HG22) 2.937 1.078 1.078 weight 1.000 ! spec=N_noesy, no=402, id=207, vol=1.175111e+08
or (segid " C" and resid 45 and name HN) (segid " C" and resid 44 and name HG21)
or (segid " C" and resid 45 and name HN) (segid " C" and resid 44 and name HG23)
assign (segid " C" and resid 45 and name HN) (segid " C" and resid 44 and name HN) 3.695 1.707 1.707 weight 1.000 ! spec=N_noesy, no=403, id=208, vol=1.027133e+08
assign (segid " C" and resid 46 and name HN) (segid " C" and resid 46 and name HA) 2.638 0.870 0.870 weight 1.000 ! spec=N_noesy, no=408, id=210, vol=2.464612e+08
assign (segid " C" and resid 46 and name HN) (segid " C" and resid 45 and name HA) 2.022 0.511 0.511 weight 1.000 ! spec=N_noesy, no=409, id=211, vol=1.107330e+09
assign (segid " C" and resid 46 and name HN) (segid " C" and resid 46 and name HB2) 2.676 0.895 0.895 weight 1.000 ! spec=N_noesy, no=413, id=214, vol=2.432693e+08
assign (segid " C" and resid 46 and name HN) (segid " C" and resid 46 and name HB1) 2.308 0.666 0.666 weight 1.000 ! spec=N_noesy, no=414, id=215, vol=5.140116e+08
assign (segid " C" and resid 48 and name HN) (segid " C" and resid 49 and name HN) 2.804 0.983 0.983 weight 1.000 ! spec=N_noesy, no=424, id=216, vol=1.556600e+08
assign (segid " C" and resid 50 and name HN) (segid " C" and resid 49 and name HA) 2.547 0.811 0.811 weight 1.000 ! spec=N_noesy, no=426, id=218, vol=3.662366e+08
assign (segid " C" and resid 51 and name HN) (segid " C" and resid 51 and name HA) 2.460 0.757 0.757 weight 1.000 ! spec=N_noesy, no=431, id=219, vol=3.480920e+08
assign (segid " C" and resid 51 and name HN) (segid " C" and resid 51 and name HD22) 3.604 1.623 1.623 weight 1.000 ! spec=N_noesy, no=438, id=222, vol=1.189084e+08
or (segid " C" and resid 51 and name HN) (segid " C" and resid 51 and name HD23)
or (segid " C" and resid 51 and name HN) (segid " C" and resid 51 and name HD21)
assign (segid " C" and resid 52 and name HN) (segid " C" and resid 52 and name HA) 2.874 1.032 1.032 weight 1.000 ! spec=N_noesy, no=441, id=223, vol=1.583577e+08
assign (segid " C" and resid 52 and name HN) (segid " C" and resid 51 and name HA) 2.066 0.533 0.533 weight 1.000 ! spec=N_noesy, no=442, id=224, vol=8.473241e+08
assign (segid " C" and resid 52 and name HN) (segid " C" and resid 51 and name HD22) 3.812 1.817 1.817 weight 1.000 ! spec=N_noesy, no=444, id=226, vol=6.598575e+07
or (segid " C" and resid 52 and name HN) (segid " C" and resid 51 and name HD23)
or (segid " C" and resid 52 and name HN) (segid " C" and resid 51 and name HD21)
assign (segid " C" and resid 53 and name HN) (segid " C" and resid 53 and name HA) 2.848 1.014 1.014 weight 1.000 ! spec=N_noesy, no=454, id=229, vol=1.670057e+08
assign (segid " C" and resid 53 and name HN) (segid " C" and resid 27 and name HA) 3.518 1.547 1.547 weight 1.000 ! spec=N_noesy, no=456, id=231, vol=7.161137e+07
assign (segid " C" and resid 53 and name HN) (segid " C" and resid 53 and name HB1) 2.980 1.110 1.110 weight 1.000 ! spec=N_noesy, no=457, id=232, vol=3.648223e+08
assign (segid " C" and resid 53 and name HN) (segid " C" and resid 53 and name HB2) 2.573 0.827 0.827 weight 1.000 ! spec=N_noesy, no=458, id=233, vol=2.305701e+08
assign (segid " C" and resid 54 and name HN) (segid " C" and resid 53 and name HA) 2.654 0.881 0.881 weight 1.000 ! spec=N_noesy, no=465, id=238, vol=2.193038e+08
assign (segid " C" and resid 54 and name HN) (segid " C" and resid 53 and name HB1) 2.327 0.677 0.677 weight 1.000 ! spec=N_noesy, no=466, id=239, vol=3.108419e+08
assign (segid " C" and resid 54 and name HN) (segid " C" and resid 53 and name HB2) 3.807 1.812 1.812 weight 1.000 ! spec=N_noesy, no=467, id=240, vol=1.848645e+08
assign (segid " C" and resid 54 and name HN) (segid " C" and resid 39 and name HB2) 3.849 1.852 1.852 weight 1.000 ! spec=N_noesy, no=468, id=241, vol=9.176276e+07
assign (segid " C" and resid 56 and name HN) (segid " C" and resid 56 and name HB2) 2.740 0.938 0.938 weight 1.000 ! spec=N_noesy, no=481, id=248, vol=2.200527e+08
assign (segid " C" and resid 57 and name HN) (segid " C" and resid 52 and name HA) 4.512 2.545 2.545 weight 1.000 ! spec=N_noesy, no=501, id=251, vol=3.462337e+07
assign (segid " C" and resid 58 and name HN) (segid " C" and resid 57 and name HA) 3.025 1.144 1.144 weight 1.000 ! spec=N_noesy, no=504, id=253, vol=1.539565e+08
assign (segid " C" and resid 59 and name HN) (segid " C" and resid 59 and name HA) 2.893 1.046 1.046 weight 1.000 ! spec=N_noesy, no=506, id=254, vol=1.999931e+08
assign (segid " C" and resid 60 and name HN) (segid " C" and resid 60 and name HA) 2.759 0.951 0.951 weight 1.000 ! spec=N_noesy, no=516, id=257, vol=2.296623e+08
assign (segid " C" and resid 60 and name HN) (segid " C" and resid 59 and name HA) 2.437 0.742 0.742 weight 1.000 ! spec=N_noesy, no=517, id=258, vol=4.654087e+08
assign (segid " C" and resid 60 and name HN) (segid " C" and resid 60 and name HB) 2.665 0.887 0.887 weight 1.000 ! spec=N_noesy, no=518, id=259, vol=2.603979e+08
assign (segid " C" and resid 60 and name HN) (segid " C" and resid 59 and name HB2) 3.455 1.492 1.492 weight 1.000 ! spec=N_noesy, no=519, id=260, vol=1.316047e+08
assign (segid " C" and resid 61 and name HN) (segid " C" and resid 61 and name HA) 2.814 0.990 0.990 weight 1.000 ! spec=N_noesy, no=525, id=262, vol=1.826796e+08
assign (segid " C" and resid 61 and name HN) (segid " C" and resid 60 and name HA) 2.143 0.574 0.574 weight 1.000 ! spec=N_noesy, no=526, id=263, vol=8.918801e+08
assign (segid " C" and resid 61 and name HN) (segid " C" and resid 60 and name HB) 3.358 1.410 1.410 weight 1.000 ! spec=N_noesy, no=527, id=264, vol=1.198396e+08
assign (segid " C" and resid 63 and name HN) (segid " C" and resid 62 and name HA) 2.176 0.592 0.592 weight 1.000 ! spec=N_noesy, no=544, id=266, vol=8.719887e+08
assign (segid " C" and resid 63 and name HN) (segid " C" and resid 62 and name HB2) 3.531 1.558 1.558 weight 1.000 ! spec=N_noesy, no=546, id=267, vol=1.155850e+08
assign (segid " C" and resid 63 and name HN) (segid " C" and resid 63 and name HB1) 2.592 0.840 0.840 weight 1.000 ! spec=N_noesy, no=547, id=268, vol=2.777725e+08
or (segid " C" and resid 63 and name HN) (segid " C" and resid 63 and name HB3)
or (segid " C" and resid 63 and name HN) (segid " C" and resid 63 and name HB2)
assign (segid " C" and resid 65 and name HN) (segid " C" and resid 65 and name HA) 3.154 1.243 1.243 weight 1.000 ! spec=N_noesy, no=554, id=269, vol=1.014819e+08
assign (segid " C" and resid 65 and name HN) (segid " C" and resid 64 and name HA) 2.280 0.650 0.650 weight 1.000 ! spec=N_noesy, no=555, id=270, vol=6.352283e+08
assign (segid " C" and resid 65 and name HN) (segid " C" and resid 64 and name HD2) 4.926 3.033 3.033 weight 1.000 ! spec=N_noesy, no=556, id=271, vol=2.378899e+07
assign (segid " C" and resid 65 and name HN) (segid " C" and resid 65 and name HB) 2.902 1.053 1.053 weight 1.000 ! spec=N_noesy, no=558, id=272, vol=1.591326e+08
assign (segid " C" and resid 65 and name HN) (segid " C" and resid 65 and name HG21) 3.033 1.150 1.150 weight 1.000 ! spec=N_noesy, no=560, id=273, vol=1.185482e+08
or (segid " C" and resid 65 and name HN) (segid " C" and resid 65 and name HG23)
or (segid " C" and resid 65 and name HN) (segid " C" and resid 65 and name HG22)
assign (segid " C" and resid 66 and name HN) (segid " C" and resid 66 and name HA) 2.510 0.787 0.787 weight 1.000 ! spec=N_noesy, no=566, id=274, vol=4.797844e+08
assign (segid " C" and resid 15 and name HN) (segid " C" and resid 14 and name HA) 2.719 0.924 0.924 weight 1.000 ! spec=N_noesy, no=588, id=277, vol=1.767186e+08
assign (segid " C" and resid 15 and name HN) (segid " C" and resid 15 and name HB1) 2.972 1.104 1.104 weight 1.000 ! spec=N_noesy, no=589, id=278, vol=1.167216e+08
assign (segid " C" and resid 15 and name HN) (segid " C" and resid 15 and name HB2) 3.086 1.190 1.190 weight 1.000 ! spec=N_noesy, no=591, id=279, vol=8.878531e+07
assign (segid " C" and resid 21 and name HN) (segid " C" and resid 21 and name HA1) 2.396 0.718 0.718 weight 1.000 ! spec=N_noesy, no=606, id=285, vol=3.820726e+08
assign (segid " C" and resid 21 and name HN) (segid " C" and resid 14 and name HA) 4.001 2.001 2.001 weight 1.000 ! spec=N_noesy, no=607, id=286, vol=6.340540e+07
assign (segid " C" and resid 26 and name HN) (segid " C" and resid 27 and name HN) 4.376 2.393 2.393 weight 1.000 ! spec=N_noesy, no=608, id=287, vol=3.809092e+07
assign (segid " C" and resid 29 and name HN) (segid " C" and resid 28 and name HG23) 3.379 1.427 1.427 weight 1.000 ! spec=N_noesy, no=609, id=288, vol=1.690510e+08
or (segid " C" and resid 29 and name HN) (segid " C" and resid 28 and name HG21)
or (segid " C" and resid 29 and name HN) (segid " C" and resid 28 and name HG22)
assign (segid " C" and resid 54 and name HN) (segid " C" and resid 39 and name HE1) 3.052 1.164 1.164 weight 1.000 ! spec=N_noesy, no=617, id=290, vol=1.136527e+08
assign (segid " C" and resid 55 and name HN) (segid " C" and resid 54 and name HN) 2.982 1.111 1.111 weight 1.000 ! spec=N_noesy, no=619, id=291, vol=1.087056e+08
assign (segid " C" and resid 22 and name HN) (segid " C" and resid 35 and name HE2) 3.130 1.224 1.224 weight 1.000 ! spec=N_noesy, no=682, id=297, vol=1.140761e+08
assign (segid " C" and resid 39 and name HN) (segid " C" and resid 54 and name HN) 5.108 3.262 3.262 weight 1.000 ! spec=N_noesy, no=685, id=298, vol=2.062716e+07
assign (segid " C" and resid 39 and name HN) (segid " C" and resid 36 and name HN) 4.750 2.821 2.821 weight 1.000 ! spec=N_noesy, no=687, id=299, vol=1.434167e+07
assign (segid " C" and resid 8 and name HN) (segid " C" and resid 8 and name HD22) 4.733 2.800 2.800 weight 1.000 ! spec=N_noesy, no=691, id=300, vol=4.175040e+07
assign (segid " C" and resid 36 and name HE1) (segid " C" and resid 40 and name HD2) 4.557 2.596 2.596 weight 1.000 ! spec=N_noesy, no=868, id=306, vol=3.414120e+07
or (segid " C" and resid 36 and name HE1) (segid " C" and resid 40 and name HD1)
assign (segid " C" and resid 36 and name HE1) (segid " C" and resid 45 and name HA) 2.931 1.074 1.074 weight 1.000 ! spec=N_noesy, no=872, id=307, vol=2.154293e+08
assign (segid " C" and resid 36 and name HE1) (segid " C" and resid 46 and name HA) 3.354 1.406 1.406 weight 1.000 ! spec=N_noesy, no=873, id=308, vol=6.483737e+07
assign (segid " C" and resid 36 and name HE1) (segid " C" and resid 40 and name HB2) 3.690 1.702 1.702 weight 1.000 ! spec=N_noesy, no=876, id=311, vol=9.667990e+07
assign (segid " C" and resid 36 and name HE1) (segid " C" and resid 46 and name HB2) 3.292 1.355 1.355 weight 1.000 ! spec=N_noesy, no=877, id=312, vol=1.090097e+08
assign (segid " C" and resid 61 and name HN) (segid " C" and resid 59 and name HB2) 4.676 2.733 2.733 weight 1.000 ! spec=N_noesy, no=895, id=313, vol=2.040289e+07
assign (segid " C" and resid 8 and name HD22) (segid " C" and resid 8 and name HD21) 1.570 0.308 0.308 weight 1.000 ! spec=N_noesy, no=903, id=315, vol=2.945904e+09
assign (segid " C" and resid 54 and name HE) (segid " C" and resid 54 and name HD1) 3.540 1.566 1.566 weight 1.000 ! spec=N_noesy, no=929, id=320, vol=4.637346e+07
assign (segid " C" and resid 54 and name HE) (segid " C" and resid 54 and name HD2) 3.520 1.548 1.548 weight 1.000 ! spec=N_noesy, no=930, id=321, vol=4.694709e+07
assign (segid " C" and resid 46 and name HN) (segid " C" and resid 46 and name HE) 4.940 3.050 3.050 weight 1.000 ! spec=N_noesy, no=934, id=324, vol=3.829845e+07
assign (segid " C" and resid 49 and name HN) (segid " C" and resid 49 and name HG21) 2.856 1.020 1.020 weight 1.000 ! spec=N_noesy, no=950, id=325, vol=1.720469e+08
or (segid " C" and resid 49 and name HN) (segid " C" and resid 49 and name HG22)
or (segid " C" and resid 49 and name HN) (segid " C" and resid 49 and name HG23)
assign (segid " C" and resid 49 and name HN) (segid " C" and resid 49 and name HA) 2.742 0.940 0.940 weight 1.000 ! spec=N_noesy, no=953, id=326, vol=2.714757e+08
assign (segid " C" and resid 64 and name HG2) (segid " C" and resid 64 and name HD2) 2.004 0.502 0.502 weight 1.000 ! spec=13C_...nD2O, no=6, id=329, vol=9.228475e+08
or (segid " C" and resid 41 and name HG2) (segid " C" and resid 41 and name HD2)
or (segid " C" and resid 64 and name HG1) (segid " C" and resid 64 and name HD2)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 39 and name HE1) 4.075 2.076 2.076 weight 1.000 ! spec=13C_...nD2O, no=35, id=809, vol=2.919824e+07
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 39 and name HE1)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 39 and name HE1)
assign (segid " C" and resid 54 and name HG2) (segid " C" and resid 39 and name HE1) 3.340 1.395 1.395 weight 1.000 ! spec=13C_...nD2O, no=38, id=811, vol=3.857115e+07
or (segid " C" and resid 54 and name HG1) (segid " C" and resid 39 and name HE1)
assign (segid " C" and resid 25 and name HB1) (segid " C" and resid 34 and name HD1) 3.898 1.900 1.900 weight 1.000 ! spec=13C_...nD2O, no=43, id=816, vol=3.047891e+07
or (segid " C" and resid 25 and name HB1) (segid " C" and resid 34 and name HD2)
or (segid " C" and resid 51 and name HD11) (segid " C" and resid 34 and name HD1)
or (segid " C" and resid 51 and name HD11) (segid " C" and resid 34 and name HD2)
or (segid " C" and resid 51 and name HD13) (segid " C" and resid 34 and name HD1)
or (segid " C" and resid 51 and name HD13) (segid " C" and resid 34 and name HD2)
or (segid " C" and resid 51 and name HD12) (segid " C" and resid 34 and name HD1)
or (segid " C" and resid 51 and name HD12) (segid " C" and resid 34 and name HD2)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 51 and name HB2) 3.436 1.476 1.476 weight 1.000 ! spec=13C_...nD2O, no=49, id=819, vol=6.973845e+07
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 51 and name HB2)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 51 and name HB2)
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 51 and name HG)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 51 and name HG)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 51 and name HG)
assign (segid " C" and resid 62 and name HG1) (segid " C" and resid 62 and name HD2) 2.433 0.740 0.740 weight 1.000 ! spec=13C_...nD2O, no=50, id=366, vol=3.045134e+08
or (segid " C" and resid 62 and name HG2) (segid " C" and resid 62 and name HD2)
assign (segid " C" and resid 25 and name HB2) (segid " C" and resid 34 and name HE2) 4.134 2.137 2.137 weight 1.000 ! spec=13C_...nD2O, no=52, id=820, vol=2.033842e+07
or (segid " C" and resid 25 and name HB2) (segid " C" and resid 34 and name HE1)
or (segid " C" and resid 25 and name HB2) (segid " C" and resid 34 and name HZ)
assign (segid " C" and resid 11 and name HG2) (segid " C" and resid 11 and name HD1) 2.140 0.573 0.573 weight 1.000 ! spec=13C_...nD2O, no=56, id=367, vol=6.779234e+08
or (segid " C" and resid 11 and name HG1) (segid " C" and resid 11 and name HD1)
or (segid " C" and resid 64 and name HG1) (segid " C" and resid 64 and name HD1)
assign (segid " C" and resid 63 and name HB1) (segid " C" and resid 64 and name HD2) 2.754 0.948 0.948 weight 1.000 ! spec=13C_...nD2O, no=57, id=368, vol=2.723373e+08
or (segid " C" and resid 63 and name HB3) (segid " C" and resid 64 and name HD2)
or (segid " C" and resid 63 and name HB2) (segid " C" and resid 64 and name HD2)
or (segid " C" and resid 10 and name HB1) (segid " C" and resid 11 and name HD2)
or (segid " C" and resid 10 and name HB3) (segid " C" and resid 11 and name HD2)
or (segid " C" and resid 10 and name HB2) (segid " C" and resid 11 and name HD2)
assign (segid " C" and resid 10 and name HB1) (segid " C" and resid 11 and name HD1) 3.319 1.377 1.377 weight 1.000 ! spec=13C_...nD2O, no=58, id=369, vol=1.371799e+08
or (segid " C" and resid 10 and name HB3) (segid " C" and resid 11 and name HD1)
or (segid " C" and resid 10 and name HB2) (segid " C" and resid 11 and name HD1)
or (segid " C" and resid 63 and name HB1) (segid " C" and resid 64 and name HD1)
or (segid " C" and resid 63 and name HB3) (segid " C" and resid 64 and name HD1)
or (segid " C" and resid 63 and name HB2) (segid " C" and resid 64 and name HD1)
assign (segid " C" and resid 6 and name HB2) (segid " C" and resid 6 and name HA) 2.260 0.638 0.638 weight 1.000 ! spec=13C_...nD2O, no=63, id=370, vol=5.696288e+08
or (segid " C" and resid 7 and name HB2) (segid " C" and resid 7 and name HA)
assign (segid " C" and resid 6 and name HA) (segid " C" and resid 6 and name HB1) 2.839 1.008 1.008 weight 1.000 ! spec=13C_...nD2O, no=68, id=372, vol=1.403831e+08
or (segid " C" and resid 7 and name HB2) (segid " C" and resid 7 and name HA)
or (segid " C" and resid 7 and name HA) (segid " C" and resid 7 and name HB1)
assign (segid " C" and resid 6 and name HA) (segid " C" and resid 6 and name HG2) 2.876 1.034 1.034 weight 1.000 ! spec=13C_...nD2O, no=71, id=373, vol=1.464250e+08
or (segid " C" and resid 6 and name HA) (segid " C" and resid 6 and name HG1)
assign (segid " C" and resid 8 and name HB1) (segid " C" and resid 8 and name HA) 2.495 0.778 0.778 weight 1.000 ! spec=13C_...nD2O, no=72, id=374, vol=3.140094e+08
or (segid " C" and resid 8 and name HB2) (segid " C" and resid 8 and name HA)
assign (segid " C" and resid 44 and name HG22) (segid " C" and resid 40 and name HZ) 3.971 1.971 1.971 weight 1.000 ! spec=13C_...nD2O, no=74, id=833, vol=2.194394e+07
or (segid " C" and resid 44 and name HG21) (segid " C" and resid 40 and name HZ)
or (segid " C" and resid 44 and name HG23) (segid " C" and resid 40 and name HZ)
or (segid " C" and resid 40 and name HZ) (segid " C" and resid 54 and name HB2)
assign (segid " C" and resid 40 and name HD2) (segid " C" and resid 41 and name HD2) 4.792 2.870 2.870 weight 1.000 ! spec=13C_...nD2O, no=82, id=837, vol=2.211357e+07
or (segid " C" and resid 40 and name HD1) (segid " C" and resid 41 and name HD2)
or (segid " C" and resid 40 and name HD2) (segid " C" and resid 41 and name HD1)
or (segid " C" and resid 40 and name HD1) (segid " C" and resid 41 and name HD1)
assign (segid " C" and resid 36 and name HH2) (segid " C" and resid 47 and name HG1) 3.914 1.915 1.915 weight 1.000 ! spec=13C_...nD2O, no=83, id=838, vol=2.188446e+07
or (segid " C" and resid 36 and name HH2) (segid " C" and resid 47 and name HG2)
assign (segid " C" and resid 9 and name HB2) (segid " C" and resid 9 and name HD13) 2.407 0.724 0.724 weight 1.000 ! spec=13C_...nD2O, no=84, id=384, vol=2.713127e+08
or (segid " C" and resid 9 and name HB2) (segid " C" and resid 9 and name HD12)
or (segid " C" and resid 9 and name HB2) (segid " C" and resid 9 and name HD11)
or (segid " C" and resid 9 and name HG) (segid " C" and resid 9 and name HD13)
or (segid " C" and resid 9 and name HG) (segid " C" and resid 9 and name HD12)
or (segid " C" and resid 9 and name HG) (segid " C" and resid 9 and name HD11)
assign (segid " C" and resid 11 and name HD1) (segid " C" and resid 10 and name HA) 1.937 0.469 0.469 weight 1.000 ! spec=13C_...nD2O, no=87, id=386, vol=9.667233e+08
or (segid " C" and resid 64 and name HD1) (segid " C" and resid 63 and name HA)
assign (segid " C" and resid 11 and name HG2) (segid " C" and resid 10 and name HA) 4.357 2.373 2.373 weight 1.000 ! spec=13C_...nD2O, no=89, id=387, vol=7.540477e+07
or (segid " C" and resid 11 and name HG1) (segid " C" and resid 10 and name HA)
assign (segid " C" and resid 11 and name HG1) (segid " C" and resid 11 and name HA) 2.579 0.831 0.831 weight 1.000 ! spec=13C_...nD2O, no=93, id=389, vol=2.679429e+08
or (segid " C" and resid 11 and name HB2) (segid " C" and resid 11 and name HA)
assign (segid " C" and resid 64 and name HA) (segid " C" and resid 64 and name HB1) 2.672 0.892 0.892 weight 1.000 ! spec=13C_...nD2O, no=96, id=390, vol=1.880569e+08
or (segid " C" and resid 62 and name HA) (segid " C" and resid 62 and name HB2)
or (segid " C" and resid 11 and name HB2) (segid " C" and resid 11 and name HA)
assign (segid " C" and resid 14 and name HD2) (segid " C" and resid 14 and name HA) 4.200 2.205 2.205 weight 1.000 ! spec=13C_...nD2O, no=103, id=393, vol=6.108037e+07
or (segid " C" and resid 14 and name HD1) (segid " C" and resid 14 and name HA)
assign (segid " C" and resid 14 and name HB1) (segid " C" and resid 14 and name HA) 2.324 0.675 0.675 weight 1.000 ! spec=13C_...nD2O, no=105, id=394, vol=3.811721e+08
or (segid " C" and resid 14 and name HG2) (segid " C" and resid 14 and name HA)
or (segid " C" and resid 14 and name HB2) (segid " C" and resid 14 and name HA)
assign (segid " C" and resid 14 and name HD2) (segid " C" and resid 14 and name HB1) 3.196 1.277 1.277 weight 1.000 ! spec=13C_...nD2O, no=113, id=399, vol=8.537812e+07
or (segid " C" and resid 14 and name HD1) (segid " C" and resid 14 and name HB1)
assign (segid " C" and resid 14 and name HD2) (segid " C" and resid 14 and name HB2) 3.016 1.137 1.137 weight 1.000 ! spec=13C_...nD2O, no=114, id=400, vol=8.529139e+07
or (segid " C" and resid 14 and name HD1) (segid " C" and resid 14 and name HB2)
assign (segid " C" and resid 33 and name HB3) (segid " C" and resid 26 and name HD1) 3.476 1.511 1.511 weight 1.000 ! spec=13C_...nD2O, no=122, id=405, vol=6.528586e+07
or (segid " C" and resid 33 and name HB2) (segid " C" and resid 26 and name HD1)
or (segid " C" and resid 33 and name HB1) (segid " C" and resid 26 and name HD1)
or (segid " C" and resid 33 and name HB3) (segid " C" and resid 26 and name HD2)
or (segid " C" and resid 33 and name HB2) (segid " C" and resid 26 and name HD2)
or (segid " C" and resid 33 and name HB1) (segid " C" and resid 26 and name HD2)
assign (segid " C" and resid 24 and name HG13) (segid " C" and resid 26 and name HD1) 3.265 1.333 1.333 weight 1.000 ! spec=13C_...nD2O, no=123, id=406, vol=4.782767e+07
or (segid " C" and resid 24 and name HG12) (segid " C" and resid 26 and name HD1)
or (segid " C" and resid 24 and name HG11) (segid " C" and resid 26 and name HD1)
or (segid " C" and resid 24 and name HG13) (segid " C" and resid 26 and name HD2)
or (segid " C" and resid 24 and name HG12) (segid " C" and resid 26 and name HD2)
or (segid " C" and resid 24 and name HG11) (segid " C" and resid 26 and name HD2)
assign (segid " C" and resid 14 and name HD1) (segid " C" and resid 14 and name HG2) 2.700 0.911 0.911 weight 1.000 ! spec=13C_...nD2O, no=126, id=407, vol=1.429460e+08
or (segid " C" and resid 14 and name HD2) (segid " C" and resid 14 and name HG2)
assign (segid " C" and resid 17 and name HG13) (segid " C" and resid 17 and name HA) 2.026 0.513 0.513 weight 1.000 ! spec=13C_...nD2O, no=143, id=420, vol=9.433998e+08
or (segid " C" and resid 17 and name HG12) (segid " C" and resid 17 and name HA)
or (segid " C" and resid 17 and name HG11) (segid " C" and resid 17 and name HA)
or (segid " C" and resid 17 and name HG23) (segid " C" and resid 17 and name HA)
or (segid " C" and resid 17 and name HG22) (segid " C" and resid 17 and name HA)
or (segid " C" and resid 17 and name HG21) (segid " C" and resid 17 and name HA)
assign (segid " C" and resid 17 and name HG23) (segid " C" and resid 17 and name HB) 1.938 0.470 0.470 weight 1.000 ! spec=13C_...nD2O, no=144, id=421, vol=6.333698e+08
or (segid " C" and resid 17 and name HG22) (segid " C" and resid 17 and name HB)
or (segid " C" and resid 17 and name HG21) (segid " C" and resid 17 and name HB)
or (segid " C" and resid 17 and name HG13) (segid " C" and resid 17 and name HB)
or (segid " C" and resid 17 and name HG12) (segid " C" and resid 17 and name HB)
or (segid " C" and resid 17 and name HG11) (segid " C" and resid 17 and name HB)
assign (segid " C" and resid 14 and name HB1) (segid " C" and resid 21 and name HA2) 3.241 1.313 1.313 weight 1.000 ! spec=13C_...nD2O, no=192, id=450, vol=6.698905e+07
or (segid " C" and resid 14 and name HG2) (segid " C" and resid 21 and name HA2)
assign (segid " C" and resid 26 and name HD1) (segid " C" and resid 24 and name HG22) 3.830 1.833 1.833 weight 1.000 ! spec=13C_...nD2O, no=228, id=474, vol=3.345252e+07
or (segid " C" and resid 26 and name HD1) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 26 and name HD1) (segid " C" and resid 24 and name HG21)
or (segid " C" and resid 26 and name HD2) (segid " C" and resid 24 and name HG22)
or (segid " C" and resid 26 and name HD2) (segid " C" and resid 24 and name HG23)
or (segid " C" and resid 26 and name HD2) (segid " C" and resid 24 and name HG21)
assign (segid " C" and resid 25 and name HG) (segid " C" and resid 25 and name HD23) 1.981 0.490 0.490 weight 1.000 ! spec=13C_...nD2O, no=243, id=484, vol=6.228289e+08
or (segid " C" and resid 25 and name HG) (segid " C" and resid 25 and name HD21)
or (segid " C" and resid 25 and name HG) (segid " C" and resid 25 and name HD22)
or (segid " C" and resid 25 and name HG) (segid " C" and resid 25 and name HD12)
or (segid " C" and resid 25 and name HG) (segid " C" and resid 25 and name HD11)
or (segid " C" and resid 25 and name HG) (segid " C" and resid 25 and name HD13)
assign (segid " C" and resid 25 and name HD12) (segid " C" and resid 25 and name HA) 2.031 0.516 0.516 weight 1.000 ! spec=13C_...nD2O, no=244, id=485, vol=8.125250e+08
or (segid " C" and resid 25 and name HD11) (segid " C" and resid 25 and name HA)
or (segid " C" and resid 25 and name HD13) (segid " C" and resid 25 and name HA)
or (segid " C" and resid 25 and name HD23) (segid " C" and resid 25 and name HA)
or (segid " C" and resid 25 and name HD21) (segid " C" and resid 25 and name HA)
or (segid " C" and resid 25 and name HD22) (segid " C" and resid 25 and name HA)
assign (segid " C" and resid 26 and name HA) (segid " C" and resid 26 and name HD2) 2.363 0.698 0.698 weight 1.000 ! spec=13C_...nD2O, no=250, id=490, vol=2.612496e+08
or (segid " C" and resid 26 and name HA) (segid " C" and resid 26 and name HD1)
assign (segid " C" and resid 26 and name HB1) (segid " C" and resid 26 and name HA) 2.349 0.690 0.690 weight 1.000 ! spec=13C_...nD2O, no=252, id=492, vol=3.615140e+08
or (segid " C" and resid 26 and name HB2) (segid " C" and resid 26 and name HA)
assign (segid " C" and resid 26 and name HD1) (segid " C" and resid 26 and name HB1) 3.026 1.145 1.145 weight 1.000 ! spec=13C_...nD2O, no=253, id=493, vol=8.986573e+07
or (segid " C" and resid 26 and name HD2) (segid " C" and resid 26 and name HB1)
assign (segid " C" and resid 26 and name HD1) (segid " C" and resid 26 and name HB2) 3.514 1.544 1.544 weight 1.000 ! spec=13C_...nD2O, no=254, id=494, vol=8.391109e+07
or (segid " C" and resid 26 and name HD2) (segid " C" and resid 26 and name HB2)
assign (segid " C" and resid 26 and name HD1) (segid " C" and resid 26 and name HG2) 2.392 0.715 0.715 weight 1.000 ! spec=13C_...nD2O, no=259, id=499, vol=2.879110e+08
or (segid " C" and resid 26 and name HD2) (segid " C" and resid 26 and name HG2)
assign (segid " C" and resid 27 and name HA) (segid " C" and resid 26 and name HB2) 3.503 1.534 1.534 weight 1.000 ! spec=13C_...nD2O, no=269, id=505, vol=6.595402e+07
or (segid " C" and resid 27 and name HA) (segid " C" and resid 26 and name HB1)
assign (segid " C" and resid 33 and name HA) (segid " C" and resid 26 and name HD2) 2.427 0.736 0.736 weight 1.000 ! spec=13C_...nD2O, no=318, id=532, vol=2.593223e+08
or (segid " C" and resid 33 and name HA) (segid " C" and resid 26 and name HD1)
assign (segid " C" and resid 36 and name HA) (segid " C" and resid 36 and name HB1) 2.346 0.688 0.688 weight 1.000 ! spec=13C_...nD2O, no=351, id=550, vol=3.946425e+08
or (segid " C" and resid 36 and name HA) (segid " C" and resid 36 and name HB2)
assign (segid " C" and resid 37 and name HB1) (segid " C" and resid 37 and name HA) 2.287 0.654 0.654 weight 1.000 ! spec=13C_...nD2O, no=360, id=558, vol=5.038596e+08
or (segid " C" and resid 37 and name HG2) (segid " C" and resid 37 and name HA)
or (segid " C" and resid 37 and name HB2) (segid " C" and resid 37 and name HA)
assign (segid " C" and resid 37 and name HD1) (segid " C" and resid 37 and name HB1) 2.732 0.933 0.933 weight 1.000 ! spec=13C_...nD2O, no=362, id=559, vol=1.701408e+08
or (segid " C" and resid 37 and name HD2) (segid " C" and resid 37 and name HB1)
assign (segid " C" and resid 37 and name HD2) (segid " C" and resid 37 and name HA) 3.364 1.414 1.414 weight 1.000 ! spec=13C_...nD2O, no=363, id=560, vol=2.077748e+08
or (segid " C" and resid 37 and name HD1) (segid " C" and resid 37 and name HA)
assign (segid " C" and resid 37 and name HD1) (segid " C" and resid 37 and name HB1) 2.089 0.545 0.545 weight 1.000 ! spec=13C_...nD2O, no=365, id=561, vol=7.720827e+08
or (segid " C" and resid 37 and name HG1) (segid " C" and resid 37 and name HD1)
or (segid " C" and resid 37 and name HG1) (segid " C" and resid 37 and name HD2)
or (segid " C" and resid 37 and name HG2) (segid " C" and resid 37 and name HD1)
or (segid " C" and resid 37 and name HG2) (segid " C" and resid 37 and name HD2)
assign (segid " C" and resid 37 and name HG2) (segid " C" and resid 37 and name HD1) 2.601 0.846 0.846 weight 1.000 ! spec=13C_...nD2O, no=367, id=562, vol=1.901114e+08
or (segid " C" and resid 37 and name HG2) (segid " C" and resid 37 and name HD2)
assign (segid " C" and resid 37 and name HG1) (segid " C" and resid 37 and name HD2) 2.446 0.748 0.748 weight 1.000 ! spec=13C_...nD2O, no=368, id=563, vol=2.817259e+08
or (segid " C" and resid 37 and name HG1) (segid " C" and resid 37 and name HD1)
assign (segid " C" and resid 56 and name HA) (segid " C" and resid 56 and name HB2) 2.422 0.733 0.733 weight 1.000 ! spec=13C_...nD2O, no=384, id=574, vol=3.302524e+08
or (segid " C" and resid 38 and name HB2) (segid " C" and resid 38 and name HA)
assign (segid " C" and resid 55 and name HB1) (segid " C" and resid 56 and name HB2) 3.978 1.978 1.978 weight 1.000 ! spec=13C_...nD2O, no=386, id=576, vol=1.333209e+08
or (segid " C" and resid 35 and name HB2) (segid " C" and resid 38 and name HB2)
or (segid " C" and resid 55 and name HB2) (segid " C" and resid 56 and name HB2)
assign (segid " C" and resid 17 and name HG23) (segid " C" and resid 38 and name HB2) 2.394 0.716 0.716 weight 1.000 ! spec=13C_...nD2O, no=392, id=582, vol=3.126193e+08
or (segid " C" and resid 17 and name HG22) (segid " C" and resid 38 and name HB2)
or (segid " C" and resid 17 and name HG21) (segid " C" and resid 38 and name HB2)
or (segid " C" and resid 17 and name HG13) (segid " C" and resid 38 and name HB2)
or (segid " C" and resid 17 and name HG12) (segid " C" and resid 38 and name HB2)
or (segid " C" and resid 17 and name HG11) (segid " C" and resid 38 and name HB2)
assign (segid " C" and resid 17 and name HG13) (segid " C" and resid 38 and name HB1) 3.468 1.504 1.504 weight 1.000 ! spec=13C_...nD2O, no=393, id=583, vol=1.579783e+08
or (segid " C" and resid 17 and name HG12) (segid " C" and resid 38 and name HB1)
or (segid " C" and resid 17 and name HG11) (segid " C" and resid 38 and name HB1)
or (segid " C" and resid 17 and name HG23) (segid " C" and resid 38 and name HB1)
or (segid " C" and resid 17 and name HG22) (segid " C" and resid 38 and name HB1)
or (segid " C" and resid 17 and name HG21) (segid " C" and resid 38 and name HB1)
assign (segid " C" and resid 17 and name HG23) (segid " C" and resid 39 and name HA) 3.223 1.299 1.299 weight 1.000 ! spec=13C_...nD2O, no=395, id=585, vol=7.857889e+07
or (segid " C" and resid 17 and name HG22) (segid " C" and resid 39 and name HA)
or (segid " C" and resid 17 and name HG21) (segid " C" and resid 39 and name HA)
or (segid " C" and resid 17 and name HG13) (segid " C" and resid 39 and name HA)
or (segid " C" and resid 17 and name HG12) (segid " C" and resid 39 and name HA)
or (segid " C" and resid 17 and name HG11) (segid " C" and resid 39 and name HA)
assign (segid " C" and resid 41 and name HD2) (segid " C" and resid 41 and name HB1) 3.405 1.449 1.449 weight 1.000 ! spec=13C_...nD2O, no=406, id=591, vol=7.048218e+07
or (segid " C" and resid 41 and name HD1) (segid " C" and resid 41 and name HB1)
assign (segid " C" and resid 41 and name HB2) (segid " C" and resid 41 and name HD2) 3.152 1.242 1.242 weight 1.000 ! spec=13C_...nD2O, no=407, id=592, vol=1.700389e+08
or (segid " C" and resid 41 and name HD1) (segid " C" and resid 41 and name HB2)
assign (segid " C" and resid 41 and name HG2) (segid " C" and resid 41 and name HD1) 2.394 0.716 0.716 weight 1.000 ! spec=13C_...nD2O, no=414, id=597, vol=3.370813e+08
or (segid " C" and resid 41 and name HG1) (segid " C" and resid 41 and name HD1)
assign (segid " C" and resid 40 and name HA) (segid " C" and resid 41 and name HG1) 4.970 3.087 3.087 weight 1.000 ! spec=13C_...nD2O, no=418, id=600, vol=3.139425e+07
or (segid " C" and resid 40 and name HA) (segid " C" and resid 41 and name HG2)
assign (segid " C" and resid 64 and name HA) (segid " C" and resid 64 and name HG1) 3.314 1.373 1.373 weight 1.000 ! spec=13C_...nD2O, no=419, id=601, vol=1.745103e+08
or (segid " C" and resid 64 and name HA) (segid " C" and resid 64 and name HG2)
or (segid " C" and resid 41 and name HG1) (segid " C" and resid 41 and name HA)
or (segid " C" and resid 41 and name HG2) (segid " C" and resid 41 and name HA)
assign (segid " C" and resid 44 and name HB) (segid " C" and resid 44 and name HG22) 2.098 0.550 0.550 weight 1.000 ! spec=13C_...nD2O, no=423, id=604, vol=5.824170e+08
or (segid " C" and resid 44 and name HB) (segid " C" and resid 44 and name HG21)
or (segid " C" and resid 44 and name HB) (segid " C" and resid 44 and name HG23)
or (segid " C" and resid 44 and name HG22) (segid " C" and resid 44 and name HA)
or (segid " C" and resid 44 and name HG21) (segid " C" and resid 44 and name HA)
or (segid " C" and resid 44 and name HG23) (segid " C" and resid 44 and name HA)
assign (segid " C" and resid 45 and name HB1) (segid " C" and resid 45 and name HA) 2.211 0.611 0.611 weight 1.000 ! spec=13C_...nD2O, no=428, id=608, vol=6.107397e+08
or (segid " C" and resid 45 and name HB2) (segid " C" and resid 45 and name HA)
assign (segid " C" and resid 47 and name HG2) (segid " C" and resid 46 and name HA) 4.533 2.569 2.569 weight 1.000 ! spec=13C_...nD2O, no=437, id=613, vol=4.791316e+07
or (segid " C" and resid 47 and name HG1) (segid " C" and resid 46 and name HA)
assign (segid " C" and resid 46 and name HD1) (segid " C" and resid 46 and name HB1) 2.874 1.033 1.033 weight 1.000 ! spec=13C_...nD2O, no=440, id=616, vol=1.185183e+08
or (segid " C" and resid 46 and name HD2) (segid " C" and resid 46 and name HB1)
assign (segid " C" and resid 46 and name HB2) (segid " C" and resid 46 and name HD2) 2.909 1.058 1.058 weight 1.000 ! spec=13C_...nD2O, no=451, id=620, vol=1.096275e+08
or (segid " C" and resid 46 and name HB2) (segid " C" and resid 46 and name HD1)
assign (segid " C" and resid 46 and name HA) (segid " C" and resid 46 and name HG1) 3.014 1.135 1.135 weight 1.000 ! spec=13C_...nD2O, no=453, id=621, vol=8.409197e+07
or (segid " C" and resid 46 and name HA) (segid " C" and resid 46 and name HG2)
assign (segid " C" and resid 46 and name HD2) (segid " C" and resid 46 and name HG1) 2.630 0.865 0.865 weight 1.000 ! spec=13C_...nD2O, no=454, id=622, vol=1.660072e+08
or (segid " C" and resid 46 and name HD2) (segid " C" and resid 46 and name HG2)
or (segid " C" and resid 46 and name HD1) (segid " C" and resid 46 and name HG1)
or (segid " C" and resid 46 and name HD1) (segid " C" and resid 46 and name HG2)
assign (segid " C" and resid 47 and name HG2) (segid " C" and resid 47 and name HD2) 2.201 0.605 0.605 weight 1.000 ! spec=13C_...nD2O, no=468, id=628, vol=4.780055e+08
or (segid " C" and resid 47 and name HG1) (segid " C" and resid 47 and name HD2)
assign (segid " C" and resid 47 and name HG1) (segid " C" and resid 47 and name HD1) 2.197 0.604 0.604 weight 1.000 ! spec=13C_...nD2O, no=469, id=629, vol=4.403700e+08
or (segid " C" and resid 47 and name HG2) (segid " C" and resid 47 and name HD1)
assign (segid " C" and resid 46 and name HG1) (segid " C" and resid 47 and name HD2) 3.725 1.734 1.734 weight 1.000 ! spec=13C_...nD2O, no=471, id=631, vol=1.175154e+08
or (segid " C" and resid 46 and name HG2) (segid " C" and resid 47 and name HD2)
assign (segid " C" and resid 47 and name HA) (segid " C" and resid 47 and name HG2) 3.202 1.282 1.282 weight 1.000 ! spec=13C_...nD2O, no=478, id=636, vol=1.443252e+08
or (segid " C" and resid 47 and name HA) (segid " C" and resid 47 and name HG1)
assign (segid " C" and resid 50 and name HA1) (segid " C" and resid 28 and name HG23) 2.795 0.976 0.976 weight 1.000 ! spec=13C_...nD2O, no=499, id=640, vol=2.011207e+08
or (segid " C" and resid 50 and name HA1) (segid " C" and resid 28 and name HG21)
or (segid " C" and resid 50 and name HA1) (segid " C" and resid 28 and name HG22)
or (segid " C" and resid 50 and name HA2) (segid " C" and resid 28 and name HG23)
or (segid " C" and resid 50 and name HA2) (segid " C" and resid 28 and name HG21)
or (segid " C" and resid 50 and name HA2) (segid " C" and resid 28 and name HG22)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 51 and name HB2) 3.584 1.606 1.606 weight 1.000 ! spec=13C_...nD2O, no=513, id=645, vol=4.783241e+07
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 51 and name HB2)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 51 and name HB2)
assign (segid " C" and resid 34 and name HZ) (segid " C" and resid 51 and name HB1) 4.237 2.244 2.244 weight 1.000 ! spec=13C_...nD2O, no=514, id=646, vol=4.497800e+07
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 51 and name HB1)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 51 and name HB1)
assign (segid " C" and resid 51 and name HD11) (segid " C" and resid 51 and name HG) 2.770 0.959 0.959 weight 1.000 ! spec=13C_...nD2O, no=515, id=647, vol=8.611789e+07
or (segid " C" and resid 51 and name HD13) (segid " C" and resid 51 and name HG)
or (segid " C" and resid 51 and name HD12) (segid " C" and resid 51 and name HG)
or (segid " C" and resid 51 and name HD22) (segid " C" and resid 51 and name HG)
or (segid " C" and resid 51 and name HD23) (segid " C" and resid 51 and name HG)
or (segid " C" and resid 51 and name HD21) (segid " C" and resid 51 and name HG)
assign (segid " C" and resid 51 and name HA) (segid " C" and resid 52 and name HA) 2.854 1.018 1.018 weight 1.000 ! spec=13C_...nD2O, no=525, id=654, vol=1.721000e+08
or (segid " C" and resid 52 and name HA) (segid " C" and resid 27 and name HA)
assign (segid " C" and resid 52 and name HD1) (segid " C" and resid 52 and name HA) 3.730 1.739 1.739 weight 1.000 ! spec=13C_...nD2O, no=526, id=655, vol=1.083331e+08
or (segid " C" and resid 52 and name HD2) (segid " C" and resid 52 and name HA)
assign (segid " C" and resid 52 and name HB2) (segid " C" and resid 52 and name HA) 2.215 0.613 0.613 weight 1.000 ! spec=13C_...nD2O, no=528, id=656, vol=5.329426e+08
or (segid " C" and resid 52 and name HB1) (segid " C" and resid 52 and name HA)
assign (segid " C" and resid 52 and name HG2) (segid " C" and resid 52 and name HB2) 2.679 0.897 0.897 weight 1.000 ! spec=13C_...nD2O, no=531, id=659, vol=1.694421e+08
or (segid " C" and resid 52 and name HG2) (segid " C" and resid 52 and name HB1)
assign (segid " C" and resid 56 and name HB1) (segid " C" and resid 52 and name HB1) 3.315 1.374 1.374 weight 1.000 ! spec=13C_...nD2O, no=532, id=660, vol=7.502270e+07
or (segid " C" and resid 56 and name HB1) (segid " C" and resid 52 and name HB2)
assign (segid " C" and resid 52 and name HD1) (segid " C" and resid 52 and name HB2) 2.349 0.690 0.690 weight 1.000 ! spec=13C_...nD2O, no=533, id=661, vol=3.512714e+08
or (segid " C" and resid 52 and name HD1) (segid " C" and resid 52 and name HB1)
or (segid " C" and resid 56 and name HB2) (segid " C" and resid 52 and name HB2)
or (segid " C" and resid 52 and name HD2) (segid " C" and resid 52 and name HB1)
assign (segid " C" and resid 57 and name HB1) (segid " C" and resid 52 and name HB2) 3.175 1.260 1.260 weight 1.000 ! spec=13C_...nD2O, no=534, id=662, vol=6.911673e+07
or (segid " C" and resid 57 and name HB1) (segid " C" and resid 52 and name HB1)
or (segid " C" and resid 57 and name HB2) (segid " C" and resid 52 and name HB2)
assign (segid " C" and resid 57 and name HA) (segid " C" and resid 52 and name HB2) 3.408 1.452 1.452 weight 1.000 ! spec=13C_...nD2O, no=535, id=663, vol=8.838616e+07
or (segid " C" and resid 57 and name HA) (segid " C" and resid 52 and name HB1)
or (segid " C" and resid 51 and name HA) (segid " C" and resid 52 and name HB1)
assign (segid " C" and resid 52 and name HD1) (segid " C" and resid 52 and name HB2) 2.056 0.528 0.528 weight 1.000 ! spec=13C_...nD2O, no=537, id=665, vol=7.685023e+08
or (segid " C" and resid 52 and name HG1) (segid " C" and resid 52 and name HD2)
or (segid " C" and resid 52 and name HG1) (segid " C" and resid 52 and name HD1)
or (segid " C" and resid 52 and name HD1) (segid " C" and resid 52 and name HB1)
assign (segid " C" and resid 57 and name HA) (segid " C" and resid 52 and name HD1) 2.809 0.987 0.987 weight 1.000 ! spec=13C_...nD2O, no=540, id=667, vol=1.580629e+08
or (segid " C" and resid 57 and name HA) (segid " C" and resid 52 and name HD2)
assign (segid " C" and resid 52 and name HD1) (segid " C" and resid 52 and name HG2) 2.602 0.846 0.846 weight 1.000 ! spec=13C_...nD2O, no=544, id=668, vol=2.193391e+08
or (segid " C" and resid 52 and name HD2) (segid " C" and resid 52 and name HG2)
assign (segid " C" and resid 52 and name HG1) (segid " C" and resid 52 and name HD2) 2.504 0.784 0.784 weight 1.000 ! spec=13C_...nD2O, no=545, id=669, vol=2.180990e+08
or (segid " C" and resid 52 and name HG1) (segid " C" and resid 52 and name HD1)
assign (segid " C" and resid 54 and name HB1) (segid " C" and resid 54 and name HA) 2.291 0.656 0.656 weight 1.000 ! spec=13C_...nD2O, no=573, id=685, vol=4.133101e+08
or (segid " C" and resid 54 and name HB2) (segid " C" and resid 54 and name HA)
assign (segid " C" and resid 54 and name HG1) (segid " C" and resid 54 and name HD1) 2.346 0.688 0.688 weight 1.000 ! spec=13C_...nD2O, no=588, id=697, vol=3.843582e+08
or (segid " C" and resid 54 and name HG2) (segid " C" and resid 54 and name HD1)
assign (segid " C" and resid 54 and name HG1) (segid " C" and resid 54 and name HD2) 2.315 0.670 0.670 weight 1.000 ! spec=13C_...nD2O, no=589, id=698, vol=3.088400e+08
or (segid " C" and resid 54 and name HG2) (segid " C" and resid 54 and name HD2)
assign (segid " C" and resid 55 and name HB1) (segid " C" and resid 55 and name HA) 2.299 0.661 0.661 weight 1.000 ! spec=13C_...nD2O, no=598, id=702, vol=5.370499e+08
or (segid " C" and resid 55 and name HB2) (segid " C" and resid 55 and name HA)
assign (segid " C" and resid 54 and name HG2) (segid " C" and resid 55 and name HA) 3.449 1.487 1.487 weight 1.000 ! spec=13C_...nD2O, no=599, id=703, vol=5.511352e+07
or (segid " C" and resid 54 and name HG1) (segid " C" and resid 55 and name HA)
assign (segid " C" and resid 55 and name HB1) (segid " C" and resid 56 and name HB1) 4.437 2.461 2.461 weight 1.000 ! spec=13C_...nD2O, no=607, id=706, vol=4.289916e+07
or (segid " C" and resid 55 and name HB2) (segid " C" and resid 56 and name HB1)
assign (segid " C" and resid 57 and name HA) (segid " C" and resid 52 and name HD2) 2.738 0.937 0.937 weight 1.000 ! spec=13C_...nD2O, no=615, id=709, vol=1.967161e+08
or (segid " C" and resid 57 and name HA) (segid " C" and resid 52 and name HD1)
or (segid " C" and resid 56 and name HB2) (segid " C" and resid 57 and name HA)
assign (segid " C" and resid 57 and name HA) (segid " C" and resid 52 and name HB1) 2.758 0.951 0.951 weight 1.000 ! spec=13C_...nD2O, no=616, id=710, vol=2.194013e+08
or (segid " C" and resid 57 and name HA) (segid " C" and resid 52 and name HB2)
assign (segid " C" and resid 57 and name HA) (segid " C" and resid 57 and name HB1) 2.540 0.807 0.807 weight 1.000 ! spec=13C_...nD2O, no=617, id=711, vol=2.760421e+08
or (segid " C" and resid 57 and name HA) (segid " C" and resid 57 and name HB2)
assign (segid " C" and resid 57 and name HB2) (segid " C" and resid 52 and name HB1) 2.968 1.101 1.101 weight 1.000 ! spec=13C_...nD2O, no=618, id=712, vol=1.095706e+08
or (segid " C" and resid 57 and name HB1) (segid " C" and resid 52 and name HB1)
or (segid " C" and resid 57 and name HB2) (segid " C" and resid 52 and name HB2)
or (segid " C" and resid 57 and name HB1) (segid " C" and resid 52 and name HB2)
assign (segid " C" and resid 40 and name HE2) (segid " C" and resid 57 and name HB2) 3.900 1.901 1.901 weight 1.000 ! spec=13C_...nD2O, no=621, id=714, vol=7.767977e+07
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 57 and name HB2)
or (segid " C" and resid 40 and name HE2) (segid " C" and resid 57 and name HB1)
or (segid " C" and resid 40 and name HE1) (segid " C" and resid 57 and name HB1)
assign (segid " C" and resid 40 and name HZ) (segid " C" and resid 57 and name HB2) 3.235 1.308 1.308 weight 1.000 ! spec=13C_...nD2O, no=622, id=715, vol=9.278282e+07
or (segid " C" and resid 40 and name HZ) (segid " C" and resid 57 and name HB1)
assign (segid " C" and resid 59 and name HB2) (segid " C" and resid 59 and name HA) 2.406 0.724 0.724 weight 1.000 ! spec=13C_...nD2O, no=623, id=716, vol=4.265936e+08
or (segid " C" and resid 59 and name HB1) (segid " C" and resid 59 and name HA)
assign (segid " C" and resid 60 and name HG11) (segid " C" and resid 60 and name HB) 2.156 0.581 0.581 weight 1.000 ! spec=13C_...nD2O, no=631, id=719, vol=4.641503e+08
or (segid " C" and resid 60 and name HG13) (segid " C" and resid 60 and name HB)
or (segid " C" and resid 60 and name HG12) (segid " C" and resid 60 and name HB)
or (segid " C" and resid 60 and name HG23) (segid " C" and resid 60 and name HB)
or (segid " C" and resid 60 and name HG21) (segid " C" and resid 60 and name HB)
or (segid " C" and resid 60 and name HG22) (segid " C" and resid 60 and name HB)
assign (segid " C" and resid 64 and name HA) (segid " C" and resid 64 and name HB2) 2.232 0.623 0.623 weight 1.000 ! spec=13C_...nD2O, no=650, id=730, vol=5.420634e+08
or (segid " C" and resid 11 and name HB1) (segid " C" and resid 11 and name HA)
or (segid " C" and resid 62 and name HB1) (segid " C" and resid 62 and name HA)
assign (segid " C" and resid 10 and name HA) (segid " C" and resid 10 and name HB1) 2.111 0.557 0.557 weight 1.000 ! spec=13C_...nD2O, no=658, id=732, vol=4.876107e+08
or (segid " C" and resid 10 and name HA) (segid " C" and resid 10 and name HB3)
or (segid " C" and resid 10 and name HA) (segid " C" and resid 10 and name HB2)
or (segid " C" and resid 63 and name HB1) (segid " C" and resid 63 and name HA)
or (segid " C" and resid 63 and name HB3) (segid " C" and resid 63 and name HA)
or (segid " C" and resid 63 and name HB2) (segid " C" and resid 63 and name HA)
assign (segid " C" and resid 11 and name HB1) (segid " C" and resid 11 and name HB2) 1.607 0.323 0.323 weight 1.000 ! spec=13C_...nD2O, no=663, id=735, vol=1.807527e+09
or (segid " C" and resid 64 and name HB2) (segid " C" and resid 64 and name HB1)
or (segid " C" and resid 62 and name HB1) (segid " C" and resid 62 and name HB2)
assign (segid " C" and resid 11 and name HD2) (segid " C" and resid 11 and name HB1) 3.231 1.305 1.305 weight 1.000 ! spec=13C_...nD2O, no=664, id=736, vol=1.119877e+08
or (segid " C" and resid 64 and name HD1) (segid " C" and resid 64 and name HB2)
or (segid " C" and resid 64 and name HD2) (segid " C" and resid 64 and name HB2)
or (segid " C" and resid 62 and name HD2) (segid " C" and resid 62 and name HB1)
or (segid " C" and resid 62 and name HD1) (segid " C" and resid 62 and name HB1)
assign (segid " C" and resid 62 and name HD1) (segid " C" and resid 62 and name HB2) 3.153 1.242 1.242 weight 1.000 ! spec=13C_...nD2O, no=666, id=737, vol=1.412526e+08
or (segid " C" and resid 64 and name HD2) (segid " C" and resid 64 and name HB1)
or (segid " C" and resid 11 and name HD2) (segid " C" and resid 11 and name HB2)
assign (segid " C" and resid 11 and name HD1) (segid " C" and resid 11 and name HB1) 3.937 1.938 1.938 weight 1.000 ! spec=13C_...nD2O, no=668, id=738, vol=3.933854e+07
or (segid " C" and resid 64 and name HD1) (segid " C" and resid 64 and name HB2)
assign (segid " C" and resid 65 and name HG12) (segid " C" and resid 65 and name HA) 2.913 1.060 1.060 weight 1.000 ! spec=13C_...nD2O, no=670, id=740, vol=1.175399e+08
or (segid " C" and resid 65 and name HG13) (segid " C" and resid 65 and name HA)
or (segid " C" and resid 65 and name HG11) (segid " C" and resid 65 and name HA)
or (segid " C" and resid 65 and name HG21) (segid " C" and resid 65 and name HA)
or (segid " C" and resid 65 and name HG23) (segid " C" and resid 65 and name HA)
or (segid " C" and resid 65 and name HG22) (segid " C" and resid 65 and name HA)
assign (segid " C" and resid 7 and name HG1) (segid " C" and resid 7 and name HA) 3.194 1.275 1.275 weight 1.000 ! spec=13C_...nD2O, no=696, id=749, vol=7.425690e+07
or (segid " C" and resid 7 and name HG2) (segid " C" and resid 7 and name HA)
assign (segid " C" and resid 19 and name HA2) (segid " C" and resid 14 and name HD1) 4.092 2.093 2.093 weight 1.000 ! spec=13C_...nD2O, no=711, id=753, vol=5.049751e+07
or (segid " C" and resid 19 and name HA2) (segid " C" and resid 14 and name HD2)
assign (segid " C" and resid 52 and name HG2) (segid " C" and resid 50 and name HA2) 3.664 1.678 1.678 weight 1.000 ! spec=13C_...nD2O, no=790, id=774, vol=2.859238e+07
or (segid " C" and resid 52 and name HG2) (segid " C" and resid 50 and name HA1)
assign (segid " C" and resid 49 and name HG21) (segid " C" and resid 48 and name HA2) 3.292 1.354 1.354 weight 1.000 ! spec=13C_...nD2O, no=819, id=787, vol=6.636912e+07
or (segid " C" and resid 49 and name HG22) (segid " C" and resid 48 and name HA2)
or (segid " C" and resid 49 and name HG23) (segid " C" and resid 48 and name HA2)
or (segid " C" and resid 49 and name HG21) (segid " C" and resid 48 and name HA1)
or (segid " C" and resid 49 and name HG22) (segid " C" and resid 48 and name HA1)
or (segid " C" and resid 49 and name HG23) (segid " C" and resid 48 and name HA1)
assign (segid " C" and resid 33 and name HB3) (segid " C" and resid 34 and name HA) 3.593 1.614 1.614 weight 1.000 ! spec=13C_...nD2O, no=820, id=788, vol=5.648835e+07
or (segid " C" and resid 33 and name HB2) (segid " C" and resid 34 and name HA)
or (segid " C" and resid 33 and name HB1) (segid " C" and resid 34 and name HA)
or (segid " C" and resid 33 and name HB3) (segid " C" and resid 26 and name HA)
or (segid " C" and resid 33 and name HB2) (segid " C" and resid 26 and name HA)
or (segid " C" and resid 33 and name HB1) (segid " C" and resid 26 and name HA)
assign (segid " C" and resid 17 and name HG13) (segid " C" and resid 18 and name HB1) 3.636 1.653 1.653 weight 1.000 ! spec=13C_...nD2O, no=834, id=791, vol=1.355738e+08
or (segid " C" and resid 17 and name HG12) (segid " C" and resid 18 and name HB1)
or (segid " C" and resid 17 and name HG11) (segid " C" and resid 18 and name HB1)
or (segid " C" and resid 17 and name HG13) (segid " C" and resid 38 and name HB1)
or (segid " C" and resid 17 and name HG12) (segid " C" and resid 38 and name HB1)
or (segid " C" and resid 17 and name HG11) (segid " C" and resid 38 and name HB1)
assign (segid " C" and resid 32 and name HN) (segid " C" and resid 32 and name HB1) 2.467 0.761 0.761 weight 1.000 ! spec=13c_...O_lp, no=6, id=1010, vol=5.616015e+08
or (segid " C" and resid 32 and name HN) (segid " C" and resid 32 and name HB2)
or (segid " C" and resid 32 and name HN) (segid " C" and resid 32 and name HB3)
or (segid " C" and resid 27 and name HN) (segid " C" and resid 32 and name HB1)
or (segid " C" and resid 27 and name HN) (segid " C" and resid 32 and name HB2)
or (segid " C" and resid 27 and name HN) (segid " C" and resid 32 and name HB3)
assign (segid " C" and resid 16 and name HN) (segid " C" and resid 16 and name HA1) 2.633 0.866 0.866 weight 1.000 ! spec=13c_...O_lp, no=70, id=1033, vol=4.547798e+08
or (segid " C" and resid 16 and name HN) (segid " C" and resid 16 and name HA2)
assign (segid " C" and resid 56 and name HN) (segid " C" and resid 55 and name HB1) 2.581 0.833 0.833 weight 1.000 ! spec=13c_...O_lp, no=185, id=1062, vol=4.459845e+08
or (segid " C" and resid 56 and name HN) (segid " C" and resid 55 and name HB2)
assign (segid " C" and resid 28 and name HN) (segid " C" and resid 52 and name HG2) 4.056 2.057 2.057 weight 1.000 ! spec=13c_...O_lp, no=186, id=1063, vol=1.414644e+08
or (segid " C" and resid 53 and name HN) (segid " C" and resid 52 and name HG2)
assign (segid " C" and resid 36 and name HD1) (segid " C" and resid 37 and name HD2) 4.237 2.244 2.244 weight 1.000 ! spec=2Dnoesy, no=51, id=871, vol=1.419388e+07
or (segid " C" and resid 36 and name HD1) (segid " C" and resid 37 and name HD1)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 27 and name HA) 2.846 1.012 1.012 weight 1.000 ! spec=2Dnoesy, no=55, id=874, vol=5.680094e+07
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 27 and name HA)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 27 and name HA)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 51 and name HD22) 3.309 1.369 1.369 weight 1.000 ! spec=2Dnoesy, no=58, id=877, vol=3.295923e+07
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 51 and name HD23)
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 51 and name HD21)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 51 and name HD22)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 51 and name HD23)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 51 and name HD21)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 51 and name HD22)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 51 and name HD23)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 51 and name HD21)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 51 and name HD11) 2.660 0.885 0.885 weight 1.000 ! spec=2Dnoesy, no=59, id=878, vol=3.593011e+07
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 51 and name HD13)
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 51 and name HD12)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 51 and name HD11)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 51 and name HD13)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 51 and name HD12)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 51 and name HD11)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 51 and name HD13)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 51 and name HD12)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 25 and name HB1) 3.081 1.187 1.187 weight 1.000 ! spec=2Dnoesy, no=60, id=879, vol=3.488215e+07
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 25 and name HB1)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 25 and name HB1)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 25 and name HD12) 3.948 1.949 1.949 weight 1.000 ! spec=2Dnoesy, no=63, id=880, vol=1.027824e+07
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 25 and name HD11)
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 25 and name HD13)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 25 and name HD12)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 25 and name HD11)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 25 and name HD13)
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 25 and name HD23)
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 25 and name HD21)
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 25 and name HD22)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 25 and name HD23)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 25 and name HD21)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 25 and name HD22)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 25 and name HD12)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 25 and name HD11)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 25 and name HD13)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 51 and name HG) 3.361 1.412 1.412 weight 1.000 ! spec=2Dnoesy, no=77, id=889, vol=2.958226e+07
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 51 and name HG)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 51 and name HG)
assign (segid " C" and resid 36 and name HZ3) (segid " C" and resid 34 and name HE2) 3.408 1.452 1.452 weight 1.000 ! spec=2Dnoesy, no=93, id=902, vol=2.773594e+07
or (segid " C" and resid 36 and name HZ3) (segid " C" and resid 34 and name HE1)
or (segid " C" and resid 36 and name HZ3) (segid " C" and resid 34 and name HZ)
assign (segid " C" and resid 45 and name HA) (segid " C" and resid 36 and name HZ2) 4.152 2.155 2.155 weight 1.000 ! spec=2Dnoesy, no=131, id=936, vol=1.195798e+07
or (segid " C" and resid 47 and name HA) (segid " C" and resid 36 and name HZ2)
assign (segid " C" and resid 34 and name HZ) (segid " C" and resid 53 and name HB1) 4.540 2.576 2.576 weight 1.000 ! spec=2Dnoesy, no=134, id=937, vol=8.358939e+06
or (segid " C" and resid 34 and name HE2) (segid " C" and resid 53 and name HB1)
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 53 and name HB1)
assign (segid " C" and resid 36 and name HE1) (segid " C" and resid 36 and name HB1) 4.410 2.431 2.431 weight 1.000 ! spec=2dnoesy_H2O, no=45, id=964, vol=5.289700e+04
or (segid " C" and resid 36 and name HE1) (segid " C" and resid 36 and name HB2)
assign (segid " C" and resid 34 and name HE2) (segid " C" and resid 52 and name HA) 3.745 1.753 1.753 weight 1.000 ! spec=2dnoesy_H2O, no=71, id=984, vol=7.875300e+04
or (segid " C" and resid 34 and name HE1) (segid " C" and resid 52 and name HA)
or (segid " C" and resid 34 and name HZ) (segid " C" and resid 52 and name HA)
assign (segid " C" and resid 4 and name HN) (segid " C" and resid 4 and name HB2) 2.828 1.000 1.000 weight 1.000 ! spec=N_noesy, no=2, id=0, vol=2.028885e+08
or (segid " C" and resid 4 and name HN) (segid " C" and resid 4 and name HB1)
assign (segid " C" and resid 5 and name HN) (segid " C" and resid 4 and name HB2) 3.620 1.638 1.638 weight 1.000 ! spec=N_noesy, no=11, id=4, vol=8.284487e+07
or (segid " C" and resid 5 and name HN) (segid " C" and resid 4 and name HB1)
assign (segid " C" and resid 6 and name HN) (segid " C" and resid 5 and name HA1) 2.650 0.878 0.878 weight 1.000 ! spec=N_noesy, no=13, id=6, vol=2.765261e+08
or (segid " C" and resid 6 and name HN) (segid " C" and resid 5 and name HA2)
assign (segid " C" and resid 6 and name HN) (segid " C" and resid 6 and name HG1) 3.086 1.190 1.190 weight 1.000 ! spec=N_noesy, no=14, id=7, vol=1.109318e+08
or (segid " C" and resid 6 and name HN) (segid " C" and resid 6 and name HG2)
assign (segid " C" and resid 6 and name HN) (segid " C" and resid 7 and name HB1) 3.464 1.500 1.500 weight 1.000 ! spec=N_noesy, no=15, id=8, vol=2.061299e+08
or (segid " C" and resid 6 and name HN) (segid " C" and resid 7 and name HB2)
assign (segid " C" and resid 7 and name HN) (segid " C" and resid 7 and name HG1) 3.069 1.177 1.177 weight 1.000 ! spec=N_noesy, no=17, id=10, vol=1.205152e+08
or (segid " C" and resid 7 and name HN) (segid " C" and resid 7 and name HG2)
assign (segid " C" and resid 7 and name HN) (segid " C" and resid 7 and name HB2) 2.603 0.847 0.847 weight 1.000 ! spec=N_noesy, no=18, id=11, vol=2.834996e+08
or (segid " C" and resid 7 and name HN) (segid " C" and resid 7 and name HB1)
assign (segid " C" and resid 8 and name HN) (segid " C" and resid 8 and name HB2) 2.910 1.059 1.059 weight 1.000 ! spec=N_noesy, no=24, id=14, vol=1.602126e+08
or (segid " C" and resid 8 and name HN) (segid " C" and resid 8 and name HB1)
assign (segid " C" and resid 8 and name HN) (segid " C" and resid 7 and name HG1) 3.588 1.609 1.609 weight 1.000 ! spec=N_noesy, no=25, id=15, vol=5.497987e+07
or (segid " C" and resid 8 and name HN) (segid " C" and resid 7 and name HG2)
assign (segid " C" and resid 8 and name HN) (segid " C" and resid 7 and name HB1) 3.284 1.348 1.348 weight 1.000 ! spec=N_noesy, no=26, id=16, vol=9.702541e+07
or (segid " C" and resid 8 and name HN) (segid " C" and resid 7 and name HB2)
assign (segid " C" and resid 9 and name HN) (segid " C" and resid 8 and name HB1) 3.458 1.495 1.495 weight 1.000 ! spec=N_noesy, no=32, id=19, vol=9.505527e+07
or (segid " C" and resid 9 and name HN) (segid " C" and resid 8 and name HB2)
assign (segid " C" and resid 9 and name HN) (segid " C" and resid 9 and name HD13) 3.523 1.552 1.552 weight 1.000 ! spec=N_noesy, no=33, id=20, vol=9.172388e+07
or (segid " C" and resid 9 and name HN) (segid " C" and resid 9 and name HD12)
or (segid " C" and resid 9 and name HN) (segid " C" and resid 9 and name HD11)
or (segid " C" and resid 9 and name HN) (segid " C" and resid 9 and name HD23)
or (segid " C" and resid 9 and name HN) (segid " C" and resid 9 and name HD22)
or (segid " C" and resid 9 and name HN) (segid " C" and resid 9 and name HD21)
assign (segid " C" and resid 10 and name HN) (segid " C" and resid 11 and name HD2) 4.275 2.285 2.285 weight 1.000 ! spec=N_noesy, no=36, id=23, vol=6.880555e+07
or (segid " C" and resid 10 and name HN) (segid " C" and resid 11 and name HD1)
assign (segid " C" and resid 12 and name HN) (segid " C" and resid 12 and name HA1) 2.600 0.845 0.845 weight 1.000 ! spec=N_noesy, no=46, id=25, vol=3.729446e+08
or (segid " C" and resid 12 and name HN) (segid " C" and resid 12 and name HA2)
assign (segid " C" and resid 13 and name HN) (segid " C" and resid 12 and name HA1) 2.383 0.710 0.710 weight 1.000 ! spec=N_noesy, no=56, id=30, vol=6.105393e+08
or (segid " C" and resid 13 and name HN) (segid " C" and resid 12 and name HA2)
assign (segid " C" and resid 14 and name HN) (segid " C" and resid 14 and name HB1) 2.533 0.802 0.802 weight 1.000 ! spec=N_noesy, no=66, id=33, vol=4.069941e+08
or (segid " C" and resid 14 and name HN) (segid " C" and resid 14 and name HB2)
assign (segid " C" and resid 16 and name HN) (segid " C" and resid 16 and name HA1) 2.517 0.792 0.792 weight 1.000 ! spec=N_noesy, no=73, id=34, vol=3.486265e+08
or (segid " C" and resid 16 and name HN) (segid " C" and resid 15 and name HA)
assign (segid " C" and resid 17 and name HN) (segid " C" and resid 16 and name HA2) 2.507 0.786 0.786 weight 1.000 ! spec=N_noesy, no=80, id=35, vol=4.752251e+08
or (segid " C" and resid 17 and name HN) (segid " C" and resid 16 and name HA1)
or (segid " C" and resid 17 and name HN) (segid " C" and resid 17 and name HA)
assign (segid " C" and resid 18 and name HN) (segid " C" and resid 17 and name HG23) 3.099 1.200 1.200 weight 1.000 ! spec=N_noesy, no=98, id=47, vol=2.563427e+08
or (segid " C" and resid 18 and name HN) (segid " C" and resid 17 and name HG22)
or (segid " C" and resid 18 and name HN) (segid " C" and resid 17 and name HG21)
or (segid " C" and resid 18 and name HN) (segid " C" and resid 17 and name HG13)
or (segid " C" and resid 18 and name HN) (segid " C" and resid 17 and name HG12)
or (segid " C" and resid 18 and name HN) (segid " C" and resid 17 and name HG11)
assign (segid " C" and resid 19 and name HN) (segid " C" and resid 17 and name HG23) 4.556 2.595 2.595 weight 1.000 ! spec=N_noesy, no=106, id=53, vol=5.114694e+07
or (segid " C" and resid 19 and name HN) (segid " C" and resid 17 and name HG22)
or (segid " C" and resid 19 and name HN) (segid " C" and resid 17 and name HG21)
or (segid " C" and resid 19 and name HN) (segid " C" and resid 17 and name HG13)
or (segid " C" and resid 19 and name HN) (segid " C" and resid 17 and name HG12)
or (segid " C" and resid 19 and name HN) (segid " C" and resid 17 and name HG11)
assign (segid " C" and resid 20 and name HN) (segid " C" and resid 15 and name HN) 3.102 1.203 1.203 weight 1.000 ! spec=N_noesy, no=112, id=58, vol=1.901291e+08
or (segid " C" and resid 20 and name HN) (segid " C" and resid 35 and name HE1)
assign (segid " C" and resid 25 and name HN) (segid " C" and resid 25 and name HD12) 2.817 0.992 0.992 weight 1.000 ! spec=N_noesy, no=170, id=96, vol=3.102787e+08
or (segid " C" and resid 25 and name HN) (segid " C" and resid 25 and name HD11)
or (segid " C" and resid 25 and name HN) (segid " C" and resid 25 and name HD13)
or (segid " C" and resid 25 and name HN) (segid " C" and resid 25 and name HD23)
or (segid " C" and resid 25 and name HN) (segid " C" and resid 25 and name HD21)
or (segid " C" and resid 25 and name HN) (segid " C" and resid 25 and name HD22)
assign (segid " C" and resid 26 and name HN) (segid " C" and resid 25 and name HD23) 3.275 1.341 1.341 weight 1.000 ! spec=N_noesy, no=174, id=100, vol=2.013615e+08
or (segid " C" and resid 26 and name HN) (segid " C" and resid 25 and name HD21)
or (segid " C" and resid 26 and name HN) (segid " C" and resid 25 and name HD22)
or (segid " C" and resid 26 and name HN) (segid " C" and resid 25 and name HD12)
or (segid " C" and resid 26 and name HN) (segid " C" and resid 25 and name HD11)
or (segid " C" and resid 26 and name HN) (segid " C" and resid 25 and name HD13)
assign (segid " C" and resid 26 and name HN) (segid " C" and resid 26 and name HB2) 2.489 0.775 0.775 weight 1.000 ! spec=N_noesy, no=176, id=102, vol=4.398823e+08
or (segid " C" and resid 26 and name HN) (segid " C" and resid 26 and name HB1)
assign (segid " C" and resid 29 and name HN) (segid " C" and resid 28 and name HA) 2.967 1.100 1.100 weight 1.000 ! spec=N_noesy, no=213, id=116, vol=1.872794e+08
or (segid " C" and resid 29 and name HN) (segid " C" and resid 28 and name HB)
assign (segid " C" and resid 34 and name HN) (segid " C" and resid 26 and name HD2) 4.758 2.829 2.829 weight 1.000 ! spec=N_noesy, no=285, id=154, vol=2.391793e+07
or (segid " C" and resid 34 and name HN) (segid " C" and resid 26 and name HD1)
assign (segid " C" and resid 36 and name HN) (segid " C" and resid 36 and name HB1) 2.137 0.571 0.571 weight 1.000 ! spec=N_noesy, no=301, id=159, vol=8.613823e+08
or (segid " C" and resid 36 and name HN) (segid " C" and resid 36 and name HB2)
assign (segid " C" and resid 37 and name HN) (segid " C" and resid 36 and name HB2) 2.288 0.654 0.654 weight 1.000 ! spec=N_noesy, no=312, id=166, vol=8.436576e+08
or (segid " C" and resid 37 and name HN) (segid " C" and resid 35 and name HB1)
assign (segid " C" and resid 38 and name HN) (segid " C" and resid 37 and name HB1) 3.128 1.223 1.223 weight 1.000 ! spec=N_noesy, no=336, id=172, vol=1.331343e+08
or (segid " C" and resid 38 and name HN) (segid " C" and resid 37 and name HB2)
assign (segid " C" and resid 39 and name HN) (segid " C" and resid 38 and name HA) 2.711 0.919 0.919 weight 1.000 ! spec=N_noesy, no=341, id=177, vol=2.769696e+08
or (segid " C" and resid 39 and name HN) (segid " C" and resid 39 and name HA)
assign (segid " C" and resid 39 and name HN) (segid " C" and resid 17 and name HG13) 4.014 2.014 2.014 weight 1.000 ! spec=N_noesy, no=347, id=180, vol=4.802353e+07
or (segid " C" and resid 39 and name HN) (segid " C" and resid 17 and name HG12)
or (segid " C" and resid 39 and name HN) (segid " C" and resid 17 and name HG11)
or (segid " C" and resid 39 and name HN) (segid " C" and resid 17 and name HG23)
or (segid " C" and resid 39 and name HN) (segid " C" and resid 17 and name HG22)
or (segid " C" and resid 39 and name HN) (segid " C" and resid 17 and name HG21)
assign (segid " C" and resid 42 and name HN) (segid " C" and resid 41 and name HG2) 2.832 1.003 1.003 weight 1.000 ! spec=N_noesy, no=372, id=198, vol=2.850264e+08
or (segid " C" and resid 42 and name HN) (segid " C" and resid 41 and name HB2)
assign (segid " C" and resid 42 and name HN) (segid " C" and resid 41 and name HD2) 3.395 1.440 1.440 weight 1.000 ! spec=N_noesy, no=376, id=200, vol=7.991253e+07
or (segid " C" and resid 42 and name HN) (segid " C" and resid 41 and name HD1)
assign (segid " C" and resid 45 and name HN) (segid " C" and resid 45 and name HB1) 2.781 0.967 0.967 weight 1.000 ! spec=N_noesy, no=404, id=209, vol=2.719189e+08
or (segid " C" and resid 45 and name HN) (segid " C" and resid 45 and name HB2)
assign (segid " C" and resid 46 and name HN) (segid " C" and resid 45 and name HB1) 2.962 1.097 1.097 weight 1.000 ! spec=N_noesy, no=410, id=212, vol=3.024089e+08
or (segid " C" and resid 46 and name HN) (segid " C" and resid 45 and name HB2)
assign (segid " C" and resid 46 and name HN) (segid " C" and resid 46 and name HD1) 4.709 2.772 2.772 weight 1.000 ! spec=N_noesy, no=412, id=213, vol=5.457222e+07
or (segid " C" and resid 46 and name HN) (segid " C" and resid 46 and name HD2)
assign (segid " C" and resid 50 and name HN) (segid " C" and resid 50 and name HA1) 2.372 0.703 0.703 weight 1.000 ! spec=N_noesy, no=425, id=217, vol=5.624637e+08
or (segid " C" and resid 50 and name HN) (segid " C" and resid 50 and name HA2)
assign (segid " C" and resid 51 and name HN) (segid " C" and resid 50 and name HA1) 2.240 0.627 0.627 weight 1.000 ! spec=N_noesy, no=432, id=220, vol=7.269569e+08
or (segid " C" and resid 51 and name HN) (segid " C" and resid 50 and name HA2)
assign (segid " C" and resid 51 and name HN) (segid " C" and resid 51 and name HB2) 2.048 0.524 0.524 weight 1.000 ! spec=N_noesy, no=436, id=221, vol=1.091813e+09
or (segid " C" and resid 51 and name HN) (segid " C" and resid 51 and name HB1)
assign (segid " C" and resid 52 and name HN) (segid " C" and resid 51 and name HB2) 2.730 0.932 0.932 weight 1.000 ! spec=N_noesy, no=443, id=225, vol=6.076129e+08
or (segid " C" and resid 52 and name HN) (segid " C" and resid 51 and name HB1)
or (segid " C" and resid 52 and name HN) (segid " C" and resid 52 and name HG1)
assign (segid " C" and resid 52 and name HN) (segid " C" and resid 52 and name HD2) 4.266 2.275 2.275 weight 1.000 ! spec=N_noesy, no=446, id=227, vol=5.500589e+07
or (segid " C" and resid 52 and name HN) (segid " C" and resid 52 and name HD1)
assign (segid " C" and resid 52 and name HN) (segid " C" and resid 50 and name HA1) 3.998 1.998 1.998 weight 1.000 ! spec=N_noesy, no=447, id=228, vol=5.765345e+07
or (segid " C" and resid 52 and name HN) (segid " C" and resid 50 and name HA2)
assign (segid " C" and resid 53 and name HN) (segid " C" and resid 52 and name HB2) 2.734 0.935 0.935 weight 1.000 ! spec=N_noesy, no=459, id=234, vol=2.633889e+08
or (segid " C" and resid 53 and name HN) (segid " C" and resid 52 and name HB1)
assign (segid " C" and resid 53 and name HN) (segid " C" and resid 34 and name HZ) 3.959 1.959 1.959 weight 1.000 ! spec=N_noesy, no=462, id=235, vol=4.957037e+07
or (segid " C" and resid 53 and name HN) (segid " C" and resid 34 and name HE2)
or (segid " C" and resid 53 and name HN) (segid " C" and resid 34 and name HE1)
assign (segid " C" and resid 53 and name HN) (segid " C" and resid 56 and name HN) 3.740 1.748 1.748 weight 1.000 ! spec=N_noesy, no=463, id=236, vol=5.125424e+07
or (segid " C" and resid 53 and name HN) (segid " C" and resid 57 and name HN)
assign (segid " C" and resid 54 and name HN) (segid " C" and resid 54 and name HG2) 2.319 0.672 0.672 weight 1.000 ! spec=N_noesy, no=469, id=242, vol=4.175287e+08
or (segid " C" and resid 54 and name HN) (segid " C" and resid 54 and name HB2)
assign (segid " C" and resid 55 and name HN) (segid " C" and resid 54 and name HG1) 3.186 1.269 1.269 weight 1.000 ! spec=N_noesy, no=475, id=244, vol=7.702143e+07
or (segid " C" and resid 55 and name HN) (segid " C" and resid 54 and name HG2)
assign (segid " C" and resid 57 and name HN) (segid " C" and resid 56 and name HB1) 2.921 1.066 1.066 weight 1.000 ! spec=N_noesy, no=492, id=249, vol=1.923038e+08
or (segid " C" and resid 57 and name HN) (segid " C" and resid 56 and name HB2)
assign (segid " C" and resid 57 and name HN) (segid " C" and resid 52 and name HB1) 3.213 1.291 1.291 weight 1.000 ! spec=N_noesy, no=499, id=250, vol=1.211178e+08
or (segid " C" and resid 57 and name HN) (segid " C" and resid 52 and name HB2)
assign (segid " C" and resid 58 and name HN) (segid " C" and resid 58 and name HA1) 2.392 0.715 0.715 weight 1.000 ! spec=N_noesy, no=503, id=252, vol=6.246967e+08
or (segid " C" and resid 58 and name HN) (segid " C" and resid 58 and name HA2)
assign (segid " C" and resid 59 and name HN) (segid " C" and resid 58 and name HA2) 2.490 0.775 0.775 weight 1.000 ! spec=N_noesy, no=507, id=255, vol=4.728634e+08
or (segid " C" and resid 59 and name HN) (segid " C" and resid 58 and name HA1)
assign (segid " C" and resid 59 and name HN) (segid " C" and resid 59 and name HB2) 2.642 0.873 0.873 weight 1.000 ! spec=N_noesy, no=511, id=256, vol=3.585668e+08
or (segid " C" and resid 59 and name HN) (segid " C" and resid 59 and name HB1)
assign (segid " C" and resid 60 and name HN) (segid " C" and resid 60 and name HG23) 2.557 0.817 0.817 weight 1.000 ! spec=N_noesy, no=521, id=261, vol=3.397930e+08
or (segid " C" and resid 60 and name HN) (segid " C" and resid 60 and name HG21)
or (segid " C" and resid 60 and name HN) (segid " C" and resid 60 and name HG22)
or (segid " C" and resid 60 and name HN) (segid " C" and resid 60 and name HG11)
or (segid " C" and resid 60 and name HN) (segid " C" and resid 60 and name HG13)
or (segid " C" and resid 60 and name HN) (segid " C" and resid 60 and name HG12)
assign (segid " C" and resid 61 and name HN) (segid " C" and resid 60 and name HG11) 3.053 1.165 1.165 weight 1.000 ! spec=N_noesy, no=528, id=265, vol=1.425424e+08
or (segid " C" and resid 61 and name HN) (segid " C" and resid 60 and name HG13)
or (segid " C" and resid 61 and name HN) (segid " C" and resid 60 and name HG12)
or (segid " C" and resid 61 and name HN) (segid " C" and resid 60 and name HG23)
or (segid " C" and resid 61 and name HN) (segid " C" and resid 60 and name HG21)
or (segid " C" and resid 61 and name HN) (segid " C" and resid 60 and name HG22)
assign (segid " C" and resid 66 and name HN) (segid " C" and resid 66 and name HB1) 3.014 1.136 1.136 weight 1.000 ! spec=N_noesy, no=568, id=275, vol=1.439397e+08
or (segid " C" and resid 66 and name HN) (segid " C" and resid 66 and name HB2)
assign (segid " C" and resid 3 and name HN) (segid " C" and resid 4 and name HB2) 4.730 2.796 2.796 weight 1.000 ! spec=N_noesy, no=576, id=276, vol=5.389444e+07
or (segid " C" and resid 3 and name HN) (segid " C" and resid 4 and name HB1)
assign (segid " C" and resid 15 and name HN) (segid " C" and resid 14 and name HG2) 3.506 1.536 1.536 weight 1.000 ! spec=N_noesy, no=592, id=280, vol=6.734427e+07
or (segid " C" and resid 15 and name HN) (segid " C" and resid 14 and name HB2)
assign (segid " C" and resid 53 and name HN) (segid " C" and resid 57 and name HB2) 3.826 1.830 1.830 weight 1.000 ! spec=N_noesy, no=614, id=289, vol=5.330067e+07
or (segid " C" and resid 53 and name HN) (segid " C" and resid 57 and name HB1)
assign (segid " C" and resid 37 and name HN) (segid " C" and resid 37 and name HB1) 2.115 0.559 0.559 weight 1.000 ! spec=N_noesy, no=648, id=292, vol=9.318266e+08
or (segid " C" and resid 37 and name HN) (segid " C" and resid 37 and name HG1)
or (segid " C" and resid 37 and name HN) (segid " C" and resid 37 and name HB2)
assign (segid " C" and resid 19 and name HN) (segid " C" and resid 18 and name HB2) 4.081 2.082 2.082 weight 1.000 ! spec=N_noesy, no=652, id=293, vol=6.838793e+07
or (segid " C" and resid 19 and name HN) (segid " C" and resid 20 and name HB2)
assign (segid " C" and resid 57 and name HN) (segid " C" and resid 57 and name HB1) 2.238 0.626 0.626 weight 1.000 ! spec=N_noesy, no=666, id=294, vol=8.399491e+08
or (segid " C" and resid 57 and name HN) (segid " C" and resid 57 and name HB2)
assign (segid " C" and resid 38 and name HN) (segid " C" and resid 17 and name HG13) 5.290 3.498 3.498 weight 1.000 ! spec=N_noesy, no=676, id=296, vol=2.095979e+07
or (segid " C" and resid 38 and name HN) (segid " C" and resid 17 and name HG12)
or (segid " C" and resid 38 and name HN) (segid " C" and resid 17 and name HG11)
or (segid " C" and resid 38 and name HN) (segid " C" and resid 17 and name HG23)
or (segid " C" and resid 38 and name HN) (segid " C" and resid 17 and name HG22)
or (segid " C" and resid 38 and name HN) (segid " C" and resid 17 and name HG21)
assign (segid " C" and resid 54 and name HN) (segid " C" and resid 34 and name HE2) 4.138 2.140 2.140 weight 1.000 ! spec=N_noesy, no=769, id=303, vol=7.405937e+07
or (segid " C" and resid 54 and name HN) (segid " C" and resid 34 and name HE1)
or (segid " C" and resid 54 and name HN) (segid " C" and resid 34 and name HZ)
assign (segid " C" and resid 15 and name HN) (segid " C" and resid 14 and name HD1) 5.263 3.462 3.462 weight 1.000 ! spec=N_noesy, no=826, id=304, vol=2.027110e+07
or (segid " C" and resid 15 and name HN) (segid " C" and resid 14 and name HD2)
assign (segid " C" and resid 52 and name HN) (segid " C" and resid 34 and name HE2) 3.475 1.509 1.509 weight 1.000 ! spec=N_noesy, no=841, id=305, vol=8.902853e+07
or (segid " C" and resid 52 and name HN) (segid " C" and resid 34 and name HE1)
or (segid " C" and resid 52 and name HN) (segid " C" and resid 34 and name HZ)
assign (segid " C" and resid 36 and name HE1) (segid " C" and resid 47 and name HD1) 3.844 1.847 1.847 weight 1.000 ! spec=N_noesy, no=874, id=309, vol=9.206844e+07
or (segid " C" and resid 36 and name HE1) (segid " C" and resid 47 and name HD2)
assign (segid " C" and resid 36 and name HE1) (segid " C" and resid 46 and name HD1) 4.074 2.074 2.074 weight 1.000 ! spec=N_noesy, no=875, id=310, vol=7.014877e+07
or (segid " C" and resid 36 and name HE1) (segid " C" and resid 46 and name HD2)
assign (segid " C" and resid 8 and name HD22) (segid " C" and resid 8 and name HB1) 2.995 1.121 1.121 weight 1.000 ! spec=N_noesy, no=900, id=314, vol=1.293501e+08
or (segid " C" and resid 8 and name HD22) (segid " C" and resid 8 and name HB2)
assign (segid " C" and resid 26 and name HE) (segid " C" and resid 26 and name HD1) 3.450 1.488 1.488 weight 1.000 ! spec=N_noesy, no=923, id=317, vol=4.919723e+07
or (segid " C" and resid 26 and name HE) (segid " C" and resid 26 and name HD2)
assign (segid " C" and resid 26 and name HE) (segid " C" and resid 26 and name HG1) 3.513 1.542 1.542 weight 1.000 ! spec=N_noesy, no=924, id=318, vol=4.306230e+07
or (segid " C" and resid 26 and name HE) (segid " C" and resid 26 and name HB2)
assign (segid " C" and resid 54 and name HE) (segid " C" and resid 54 and name HG2) 3.051 1.163 1.163 weight 1.000 ! spec=N_noesy, no=928, id=319, vol=1.145239e+08
or (segid " C" and resid 54 and name HE) (segid " C" and resid 54 and name HG1)
assign (segid " C" and resid 37 and name HE) (segid " C" and resid 37 and name HD1) 3.533 1.560 1.560 weight 1.000 ! spec=N_noesy, no=931, id=322, vol=4.729410e+07
or (segid " C" and resid 37 and name HE) (segid " C" and resid 37 and name HD2)
assign (segid " C" and resid 37 and name HE) (segid " C" and resid 37 and name HB2) 3.947 1.948 1.948 weight 1.000 ! spec=N_noesy, no=932, id=323, vol=3.009755e+07
or (segid " C" and resid 37 and name HE) (segid " C" and resid 37 and name HG1)
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