NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
587887 | 2mpe | 19042 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
assign (segid " A" and resid 123 and name HA) (segid " A" and resid 123 and name HD12) 4.366 2.383 2.383 weight 1.000 ! spec=13C_...spin, no=114, id=1401, vol=6.743396e+06 or (segid " A" and resid 123 and name HA) (segid " A" and resid 123 and name HD11) or (segid " A" and resid 123 and name HA) (segid " A" and resid 123 and name HD13) or (segid " A" and resid 123 and name HA) (segid " A" and resid 126 and name HD12) or (segid " A" and resid 123 and name HA) (segid " A" and resid 126 and name HD11) or (segid " A" and resid 123 and name HA) (segid " A" and resid 126 and name HD13) assign (segid " A" and resid 123 and name HB2) (segid " A" and resid 123 and name HD12) 2.829 1.000 1.000 weight 1.000 ! spec=13C_...spin, no=119, id=1404, vol=2.595098e+07 or (segid " A" and resid 123 and name HB2) (segid " A" and resid 123 and name HD11) or (segid " A" and resid 123 and name HB2) (segid " A" and resid 123 and name HD13) or (segid " A" and resid 123 and name HB2) (segid " A" and resid 126 and name HD12) or (segid " A" and resid 123 and name HB2) (segid " A" and resid 126 and name HD11) or (segid " A" and resid 123 and name HB2) (segid " A" and resid 126 and name HD13) assign (segid " A" and resid 122 and name HB1) (segid " A" and resid 122 and name HD12) 2.656 0.882 0.882 weight 1.000 ! spec=13C_...spin, no=164, id=1434, vol=4.043094e+07 or (segid " A" and resid 122 and name HB1) (segid " A" and resid 122 and name HD11) or (segid " A" and resid 122 and name HB1) (segid " A" and resid 122 and name HD13) or (segid " A" and resid 122 and name HB1) (segid " A" and resid 122 and name HD22) or (segid " A" and resid 122 and name HB1) (segid " A" and resid 122 and name HD21) or (segid " A" and resid 122 and name HB1) (segid " A" and resid 122 and name HD23) assign (segid " A" and resid 120 and name HG) (segid " A" and resid 120 and name HD22) 1.135 0.161 4.865 weight 1.000 ! spec=13C_...spin, no=206, id=1459, vol=2.347316e+09 or (segid " A" and resid 120 and name HG) (segid " A" and resid 120 and name HD21) or (segid " A" and resid 120 and name HG) (segid " A" and resid 120 and name HD23) or (segid " A" and resid 120 and name HG) (segid " A" and resid 120 and name HD12) or (segid " A" and resid 120 and name HG) (segid " A" and resid 120 and name HD11) or (segid " A" and resid 120 and name HG) (segid " A" and resid 120 and name HD13) assign (segid " A" and resid 116 and name HB2) (segid " A" and resid 116 and name HG2) 2.585 0.835 0.835 weight 1.000 ! spec=13C_...spin, no=245, id=1478, vol=6.773404e+07 or (segid " A" and resid 116 and name HB2) (segid " A" and resid 116 and name HG1) assign (segid " A" and resid 114 and name HD1) (segid " A" and resid 114 and name HG2) 2.176 0.592 0.592 weight 1.000 ! spec=13C_...spin, no=287, id=1489, vol=1.451629e+08 or (segid " A" and resid 114 and name HD2) (segid " A" and resid 114 and name HG2) assign (segid " A" and resid 111 and name HD1) (segid " A" and resid 66 and name HD22) 3.621 1.639 1.639 weight 1.000 ! spec=13C_...spin, no=317, id=1507, vol=1.734184e+07 or (segid " A" and resid 111 and name HD1) (segid " A" and resid 66 and name HD21) or (segid " A" and resid 111 and name HD1) (segid " A" and resid 66 and name HD23) or (segid " A" and resid 111 and name HD2) (segid " A" and resid 66 and name HD22) or (segid " A" and resid 111 and name HD2) (segid " A" and resid 66 and name HD21) or (segid " A" and resid 111 and name HD2) (segid " A" and resid 66 and name HD23) or (segid " A" and resid 111 and name HD1) (segid " A" and resid 29 and name HD12) or (segid " A" and resid 111 and name HD1) (segid " A" and resid 29 and name HD11) or (segid " A" and resid 111 and name HD1) (segid " A" and resid 29 and name HD13) or (segid " A" and resid 111 and name HD2) (segid " A" and resid 29 and name HD12) or (segid " A" and resid 111 and name HD2) (segid " A" and resid 29 and name HD11) or (segid " A" and resid 111 and name HD2) (segid " A" and resid 29 and name HD13) assign (segid " A" and resid 111 and name HE1) (segid " A" and resid 51 and name HG22) 4.194 2.199 2.199 weight 1.000 ! spec=13C_...spin, no=325, id=1510, vol=5.862806e+06 or (segid " A" and resid 111 and name HE1) (segid " A" and resid 51 and name HG21) or (segid " A" and resid 111 and name HE1) (segid " A" and resid 51 and name HG23) or (segid " A" and resid 111 and name HE2) (segid " A" and resid 51 and name HG22) or (segid " A" and resid 111 and name HE2) (segid " A" and resid 51 and name HG21) or (segid " A" and resid 111 and name HE2) (segid " A" and resid 51 and name HG23) or (segid " A" and resid 111 and name HE1) (segid " A" and resid 51 and name HD12) or (segid " A" and resid 111 and name HE1) (segid " A" and resid 51 and name HD11) or (segid " A" and resid 111 and name HE1) (segid " A" and resid 51 and name HD13) or (segid " A" and resid 111 and name HE2) (segid " A" and resid 51 and name HD12) or (segid " A" and resid 111 and name HE2) (segid " A" and resid 51 and name HD11) or (segid " A" and resid 111 and name HE2) (segid " A" and resid 51 and name HD13) assign (segid " A" and resid 107 and name HA) (segid " A" and resid 107 and name HG1) 3.440 1.479 1.479 weight 1.000 ! spec=13C_...spin, no=378, id=1545, vol=3.111546e+07 or (segid " A" and resid 107 and name HA) (segid " A" and resid 107 and name HG2) assign (segid " A" and resid 107 and name HD2) (segid " A" and resid 107 and name HG1) 3.343 1.397 1.397 weight 1.000 ! spec=13C_...spin, no=390, id=1552, vol=1.365329e+07 or (segid " A" and resid 107 and name HD2) (segid " A" and resid 107 and name HG2) assign (segid " A" and resid 107 and name HD1) (segid " A" and resid 107 and name HG1) 2.436 0.742 0.742 weight 1.000 ! spec=13C_...spin, no=392, id=1554, vol=6.834169e+07 or (segid " A" and resid 107 and name HD1) (segid " A" and resid 107 and name HG2) assign (segid " A" and resid 106 and name HA) (segid " A" and resid 106 and name HB2) 2.379 0.708 0.708 weight 1.000 ! spec=13C_...spin, no=399, id=1560, vol=9.939675e+07 or (segid " A" and resid 106 and name HA) (segid " A" and resid 106 and name HB1) or (segid " A" and resid 106 and name HA) (segid " A" and resid 106 and name HB3) or (segid " A" and resid 29 and name HA) (segid " A" and resid 29 and name HB1) assign (segid " A" and resid 105 and name HB1) (segid " A" and resid 102 and name HA) 2.908 1.057 1.057 weight 1.000 ! spec=13C_...spin, no=410, id=1565, vol=4.790838e+07 or (segid " A" and resid 105 and name HB2) (segid " A" and resid 102 and name HA) assign (segid " A" and resid 105 and name HA) (segid " A" and resid 105 and name HB2) 2.752 0.946 0.946 weight 1.000 ! spec=13C_...spin, no=411, id=1566, vol=6.774742e+07 or (segid " A" and resid 105 and name HA) (segid " A" and resid 105 and name HB1) assign (segid " A" and resid 105 and name HB1) (segid " A" and resid 102 and name HB2) 4.170 2.173 2.173 weight 1.000 ! spec=13C_...spin, no=412, id=1567, vol=1.274809e+07 or (segid " A" and resid 105 and name HB1) (segid " A" and resid 102 and name HB1) or (segid " A" and resid 105 and name HB1) (segid " A" and resid 102 and name HB3) or (segid " A" and resid 105 and name HB2) (segid " A" and resid 102 and name HB2) or (segid " A" and resid 105 and name HB2) (segid " A" and resid 102 and name HB1) or (segid " A" and resid 105 and name HB2) (segid " A" and resid 102 and name HB3) assign (segid " A" and resid 104 and name HG1) (segid " A" and resid 111 and name HE1) 3.179 1.263 1.263 weight 1.000 ! spec=13C_...spin, no=430, id=1582, vol=1.012084e+08 or (segid " A" and resid 104 and name HG1) (segid " A" and resid 111 and name HE2) or (segid " A" and resid 104 and name HG1) (segid " A" and resid 111 and name HD1) or (segid " A" and resid 104 and name HG1) (segid " A" and resid 111 and name HD2) assign (segid " A" and resid 100 and name HA) (segid " A" and resid 100 and name HB2) 2.555 0.816 0.816 weight 1.000 ! spec=13C_...spin, no=488, id=1612, vol=7.062449e+07 or (segid " A" and resid 100 and name HA) (segid " A" and resid 100 and name HB1) assign (segid " A" and resid 100 and name HD12) (segid " A" and resid 100 and name HB2) 2.467 0.761 0.761 weight 1.000 ! spec=13C_...spin, no=521, id=1620, vol=5.698883e+07 or (segid " A" and resid 100 and name HD11) (segid " A" and resid 100 and name HB2) or (segid " A" and resid 100 and name HD13) (segid " A" and resid 100 and name HB2) or (segid " A" and resid 100 and name HD12) (segid " A" and resid 100 and name HD22) or (segid " A" and resid 100 and name HD12) (segid " A" and resid 100 and name HD21) or (segid " A" and resid 100 and name HD12) (segid " A" and resid 100 and name HD23) or (segid " A" and resid 100 and name HD11) (segid " A" and resid 100 and name HD22) or (segid " A" and resid 100 and name HD11) (segid " A" and resid 100 and name HD21) or (segid " A" and resid 100 and name HD11) (segid " A" and resid 100 and name HD23) or (segid " A" and resid 100 and name HD13) (segid " A" and resid 100 and name HD22) or (segid " A" and resid 100 and name HD13) (segid " A" and resid 100 and name HD21) or (segid " A" and resid 100 and name HD13) (segid " A" and resid 100 and name HD23) assign (segid " A" and resid 98 and name HA) (segid " A" and resid 98 and name HD1) 3.223 1.298 1.298 weight 1.000 ! spec=13C_...spin, no=554, id=1630, vol=3.858478e+07 or (segid " A" and resid 98 and name HA) (segid " A" and resid 98 and name HD2) assign (segid " A" and resid 97 and name HA) (segid " A" and resid 97 and name HG2) 4.360 2.376 2.376 weight 1.000 ! spec=13C_...spin, no=569, id=1632, vol=1.337406e+07 or (segid " A" and resid 97 and name HA) (segid " A" and resid 97 and name HG1) assign (segid " A" and resid 97 and name HA) (segid " A" and resid 100 and name HB2) 3.487 1.520 1.520 weight 1.000 ! spec=13C_...spin, no=570, id=1633, vol=1.220103e+07 or (segid " A" and resid 97 and name HA) (segid " A" and resid 100 and name HB1) assign (segid " A" and resid 97 and name HB2) (segid " A" and resid 97 and name HG1) 2.499 0.781 0.781 weight 1.000 ! spec=13C_...spin, no=574, id=1635, vol=8.911427e+07 or (segid " A" and resid 97 and name HB2) (segid " A" and resid 97 and name HG2) or (segid " A" and resid 97 and name HB1) (segid " A" and resid 97 and name HG1) assign (segid " A" and resid 97 and name HA) (segid " A" and resid 97 and name HB2) 3.369 1.419 1.419 weight 1.000 ! spec=13C_...spin, no=576, id=1637, vol=1.590726e+07 or (segid " A" and resid 97 and name HA) (segid " A" and resid 97 and name HB1) assign (segid " A" and resid 96 and name HA) (segid " A" and resid 96 and name HB2) 4.284 2.295 2.295 weight 1.000 ! spec=13C_...spin, no=586, id=1640, vol=3.515088e+06 or (segid " A" and resid 96 and name HA) (segid " A" and resid 96 and name HG) assign (segid " A" and resid 92 and name HA) (segid " A" and resid 92 and name HB1) 4.044 2.044 2.044 weight 1.000 ! spec=13C_...spin, no=623, id=1664, vol=5.753090e+06 or (segid " A" and resid 92 and name HA) (segid " A" and resid 92 and name HB2) assign (segid " A" and resid 91 and name HG1) (segid " A" and resid 91 and name HA) 3.634 1.651 1.651 weight 1.000 ! spec=13C_...spin, no=631, id=1671, vol=2.304122e+07 or (segid " A" and resid 91 and name HG2) (segid " A" and resid 91 and name HA) assign (segid " A" and resid 90 and name HA) (segid " A" and resid 90 and name HB1) 3.033 1.150 1.150 weight 1.000 ! spec=13C_...spin, no=635, id=1673, vol=3.155154e+07 or (segid " A" and resid 90 and name HA) (segid " A" and resid 90 and name HB2) assign (segid " A" and resid 90 and name HG1) (segid " A" and resid 87 and name HA) 3.800 1.805 1.805 weight 1.000 ! spec=13C_...spin, no=640, id=1678, vol=1.180758e+07 or (segid " A" and resid 90 and name HG2) (segid " A" and resid 87 and name HA) assign (segid " A" and resid 90 and name HA) (segid " A" and resid 90 and name HG1) 3.487 1.520 1.520 weight 1.000 ! spec=13C_...spin, no=642, id=1680, vol=1.541724e+07 or (segid " A" and resid 90 and name HA) (segid " A" and resid 90 and name HG2) assign (segid " A" and resid 90 and name HG1) (segid " A" and resid 89 and name HB2) 5.251 3.447 3.447 weight 1.000 ! spec=13C_...spin, no=643, id=1681, vol=9.314716e+06 or (segid " A" and resid 90 and name HG2) (segid " A" and resid 89 and name HB2) assign (segid " A" and resid 90 and name HG1) (segid " A" and resid 89 and name HB1) 3.699 1.710 1.710 weight 1.000 ! spec=13C_...spin, no=644, id=1682, vol=1.407673e+07 or (segid " A" and resid 90 and name HG2) (segid " A" and resid 89 and name HB1) assign (segid " A" and resid 90 and name HB1) (segid " A" and resid 90 and name HG2) 2.508 0.786 0.786 weight 1.000 ! spec=13C_...spin, no=645, id=1683, vol=1.040994e+08 or (segid " A" and resid 90 and name HB2) (segid " A" and resid 90 and name HG1) or (segid " A" and resid 90 and name HB1) (segid " A" and resid 90 and name HG1) assign (segid " A" and resid 89 and name HA) (segid " A" and resid 89 and name HB1) 3.313 1.372 1.372 weight 1.000 ! spec=13C_...spin, no=648, id=1685, vol=2.428745e+07 or (segid " A" and resid 89 and name HA) (segid " A" and resid 92 and name HB1) assign (segid " A" and resid 90 and name HG1) (segid " A" and resid 89 and name HD1) 5.104 3.256 3.256 weight 1.000 ! spec=13C_...spin, no=662, id=1698, vol=6.499094e+06 or (segid " A" and resid 90 and name HG1) (segid " A" and resid 89 and name HD2) or (segid " A" and resid 90 and name HG2) (segid " A" and resid 89 and name HD1) or (segid " A" and resid 90 and name HG2) (segid " A" and resid 89 and name HD2) assign (segid " A" and resid 88 and name HA) (segid " A" and resid 88 and name HB2) 2.454 0.753 0.753 weight 1.000 ! spec=13C_...spin, no=671, id=1704, vol=9.214253e+07 or (segid " A" and resid 88 and name HA) (segid " A" and resid 88 and name HB1) or (segid " A" and resid 88 and name HA) (segid " A" and resid 91 and name HB1) assign (segid " A" and resid 88 and name HA) (segid " A" and resid 88 and name HD2) 3.310 1.369 1.369 weight 1.000 ! spec=13C_...spin, no=673, id=1705, vol=3.313504e+07 or (segid " A" and resid 88 and name HA) (segid " A" and resid 88 and name HD1) assign (segid " A" and resid 88 and name HB1) (segid " A" and resid 88 and name HG2) 2.606 0.849 0.849 weight 1.000 ! spec=13C_...spin, no=674, id=1706, vol=6.435001e+07 or (segid " A" and resid 88 and name HB2) (segid " A" and resid 88 and name HG2) or (segid " A" and resid 88 and name HB2) (segid " A" and resid 88 and name HG1) assign (segid " A" and resid 87 and name HB2) (segid " A" and resid 87 and name HA) 2.002 0.501 0.501 weight 1.000 ! spec=13C_...spin, no=683, id=1709, vol=2.083492e+08 or (segid " A" and resid 87 and name HB1) (segid " A" and resid 87 and name HA) or (segid " A" and resid 87 and name HB3) (segid " A" and resid 87 and name HA) or (segid " A" and resid 83 and name HB2) (segid " A" and resid 83 and name HA) or (segid " A" and resid 83 and name HB1) (segid " A" and resid 83 and name HA) or (segid " A" and resid 83 and name HB3) (segid " A" and resid 83 and name HA) assign (segid " A" and resid 84 and name HB1) (segid " A" and resid 87 and name HB2) 4.214 2.219 2.219 weight 1.000 ! spec=13C_...spin, no=710, id=1726, vol=1.303875e+07 or (segid " A" and resid 84 and name HB1) (segid " A" and resid 87 and name HB1) or (segid " A" and resid 84 and name HB1) (segid " A" and resid 87 and name HB3) or (segid " A" and resid 84 and name HB1) (segid " A" and resid 83 and name HB2) or (segid " A" and resid 84 and name HB1) (segid " A" and resid 83 and name HB1) or (segid " A" and resid 84 and name HB1) (segid " A" and resid 83 and name HB3) assign (segid " A" and resid 84 and name HB2) (segid " A" and resid 87 and name HB2) 5.452 3.716 3.716 weight 1.000 ! spec=13C_...spin, no=711, id=1727, vol=2.990850e+06 or (segid " A" and resid 84 and name HB2) (segid " A" and resid 87 and name HB1) or (segid " A" and resid 84 and name HB2) (segid " A" and resid 87 and name HB3) or (segid " A" and resid 84 and name HB2) (segid " A" and resid 83 and name HB2) or (segid " A" and resid 84 and name HB2) (segid " A" and resid 83 and name HB1) or (segid " A" and resid 84 and name HB2) (segid " A" and resid 83 and name HB3) assign (segid " A" and resid 82 and name HA) (segid " A" and resid 82 and name HG2) 2.622 0.859 0.859 weight 1.000 ! spec=13C_...spin, no=717, id=1733, vol=7.429864e+07 or (segid " A" and resid 82 and name HA) (segid " A" and resid 82 and name HB1) assign (segid " A" and resid 81 and name HA) (segid " A" and resid 81 and name HB1) 2.899 1.050 1.050 weight 1.000 ! spec=13C_...spin, no=730, id=1743, vol=4.664303e+07 or (segid " A" and resid 81 and name HA) (segid " A" and resid 81 and name HB2) assign (segid " A" and resid 81 and name HG2) (segid " A" and resid 81 and name HB1) 2.734 0.935 0.935 weight 1.000 ! spec=13C_...spin, no=733, id=1746, vol=6.383555e+07 or (segid " A" and resid 81 and name HG2) (segid " A" and resid 81 and name HB2) assign (segid " A" and resid 80 and name HD12) (segid " A" and resid 80 and name HG) 2.941 1.081 1.081 weight 1.000 ! spec=13C_...spin, no=763, id=1769, vol=1.424180e+07 or (segid " A" and resid 80 and name HD11) (segid " A" and resid 80 and name HG) or (segid " A" and resid 80 and name HD13) (segid " A" and resid 80 and name HG) or (segid " A" and resid 80 and name HD12) (segid " A" and resid 80 and name HB1) or (segid " A" and resid 80 and name HD11) (segid " A" and resid 80 and name HB1) or (segid " A" and resid 80 and name HD13) (segid " A" and resid 80 and name HB1) assign (segid " A" and resid 80 and name HG) (segid " A" and resid 80 and name HD22) 2.428 0.737 0.737 weight 1.000 ! spec=13C_...spin, no=767, id=1773, vol=4.216706e+07 or (segid " A" and resid 80 and name HG) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 80 and name HG) (segid " A" and resid 80 and name HD23) or (segid " A" and resid 80 and name HB1) (segid " A" and resid 80 and name HD22) or (segid " A" and resid 80 and name HB1) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 80 and name HB1) (segid " A" and resid 80 and name HD23) assign (segid " A" and resid 23 and name HB1) (segid " A" and resid 23 and name HA) 2.596 0.843 0.843 weight 1.000 ! spec=13C_...spin, no=779, id=1780, vol=7.126034e+07 or (segid " A" and resid 79 and name HB2) (segid " A" and resid 79 and name HA) or (segid " A" and resid 23 and name HB2) (segid " A" and resid 23 and name HA) assign (segid " A" and resid 79 and name HG1) (segid " A" and resid 79 and name HA) 3.081 1.186 1.186 weight 1.000 ! spec=13C_...spin, no=781, id=1781, vol=4.285554e+07 or (segid " A" and resid 79 and name HG2) (segid " A" and resid 79 and name HA) assign (segid " A" and resid 77 and name HD12) (segid " A" and resid 13 and name HD1) 4.364 2.380 2.380 weight 1.000 ! spec=13C_...spin, no=830, id=1814, vol=6.578394e+06 or (segid " A" and resid 77 and name HD12) (segid " A" and resid 13 and name HD2) or (segid " A" and resid 77 and name HD11) (segid " A" and resid 13 and name HD1) or (segid " A" and resid 77 and name HD11) (segid " A" and resid 13 and name HD2) or (segid " A" and resid 77 and name HD13) (segid " A" and resid 13 and name HD1) or (segid " A" and resid 77 and name HD13) (segid " A" and resid 13 and name HD2) or (segid " A" and resid 77 and name HD12) (segid " A" and resid 13 and name HE1) or (segid " A" and resid 77 and name HD12) (segid " A" and resid 13 and name HE2) or (segid " A" and resid 77 and name HD11) (segid " A" and resid 13 and name HE1) or (segid " A" and resid 77 and name HD11) (segid " A" and resid 13 and name HE2) or (segid " A" and resid 77 and name HD13) (segid " A" and resid 13 and name HE1) or (segid " A" and resid 77 and name HD13) (segid " A" and resid 13 and name HE2) assign (segid " A" and resid 76 and name HA) (segid " A" and resid 76 and name HG2) 2.893 1.046 1.046 weight 1.000 ! spec=13C_...spin, no=831, id=1815, vol=6.062657e+07 or (segid " A" and resid 76 and name HA) (segid " A" and resid 76 and name HG1) assign (segid " A" and resid 73 and name HA) (segid " A" and resid 73 and name HB1) 2.936 1.077 1.077 weight 1.000 ! spec=13C_...spin, no=851, id=1825, vol=3.378241e+07 or (segid " A" and resid 73 and name HB2) (segid " A" and resid 73 and name HA) assign (segid " A" and resid 103 and name HZ2) (segid " A" and resid 70 and name HD22) 4.958 3.073 3.073 weight 1.000 ! spec=13C_...spin, no=918, id=1873, vol=1.780482e+06 or (segid " A" and resid 103 and name HZ2) (segid " A" and resid 70 and name HD21) or (segid " A" and resid 103 and name HZ2) (segid " A" and resid 70 and name HD23) or (segid " A" and resid 70 and name HD22) (segid " A" and resid 103 and name HE3) or (segid " A" and resid 70 and name HD21) (segid " A" and resid 103 and name HE3) or (segid " A" and resid 70 and name HD23) (segid " A" and resid 103 and name HE3) assign (segid " A" and resid 68 and name HA) (segid " A" and resid 68 and name HB2) 2.836 1.006 1.006 weight 1.000 ! spec=13C_...spin, no=928, id=1881, vol=2.686513e+07 or (segid " A" and resid 68 and name HA) (segid " A" and resid 68 and name HB1) assign (segid " A" and resid 68 and name HB1) (segid " A" and resid 68 and name HD22) 2.392 0.715 0.715 weight 1.000 ! spec=13C_...spin, no=932, id=1885, vol=5.915435e+07 or (segid " A" and resid 68 and name HB1) (segid " A" and resid 68 and name HD21) or (segid " A" and resid 68 and name HB1) (segid " A" and resid 68 and name HD23) or (segid " A" and resid 68 and name HB2) (segid " A" and resid 68 and name HD22) or (segid " A" and resid 68 and name HB2) (segid " A" and resid 68 and name HD21) or (segid " A" and resid 68 and name HB2) (segid " A" and resid 68 and name HD23) assign (segid " A" and resid 67 and name HA) (segid " A" and resid 52 and name HG22) 2.799 0.979 0.979 weight 1.000 ! spec=13C_...spin, no=953, id=1903, vol=4.159332e+07 or (segid " A" and resid 67 and name HA) (segid " A" and resid 52 and name HG21) or (segid " A" and resid 67 and name HA) (segid " A" and resid 52 and name HG23) or (segid " A" and resid 67 and name HA) (segid " A" and resid 52 and name HG12) or (segid " A" and resid 67 and name HA) (segid " A" and resid 52 and name HG11) or (segid " A" and resid 67 and name HA) (segid " A" and resid 52 and name HG13) assign (segid " A" and resid 66 and name HA) (segid " A" and resid 66 and name HB2) 2.301 0.662 0.662 weight 1.000 ! spec=13C_...spin, no=961, id=1909, vol=8.727217e+07 or (segid " A" and resid 66 and name HA) (segid " A" and resid 66 and name HG) assign (segid " A" and resid 66 and name HB2) (segid " A" and resid 66 and name HD12) 2.599 0.844 0.844 weight 1.000 ! spec=13C_...spin, no=968, id=1914, vol=3.873370e+07 or (segid " A" and resid 66 and name HB2) (segid " A" and resid 66 and name HD11) or (segid " A" and resid 66 and name HB2) (segid " A" and resid 66 and name HD13) or (segid " A" and resid 66 and name HB2) (segid " A" and resid 66 and name HD22) or (segid " A" and resid 66 and name HB2) (segid " A" and resid 66 and name HD21) or (segid " A" and resid 66 and name HB2) (segid " A" and resid 66 and name HD23) assign (segid " A" and resid 93 and name HG) (segid " A" and resid 89 and name HE1) 3.224 1.299 1.299 weight 1.000 ! spec=13C_...spin, no=982, id=1918, vol=3.727446e+07 or (segid " A" and resid 93 and name HG) (segid " A" and resid 89 and name HE2) or (segid " A" and resid 89 and name HD1) (segid " A" and resid 93 and name HG) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 93 and name HG) assign (segid " A" and resid 65 and name HA) (segid " A" and resid 65 and name HB1) 2.148 0.577 0.577 weight 1.000 ! spec=13C_...spin, no=989, id=1923, vol=1.984784e+08 or (segid " A" and resid 65 and name HA) (segid " A" and resid 65 and name HB2) assign (segid " A" and resid 65 and name HA) (segid " A" and resid 65 and name HG2) 5.225 3.413 3.413 weight 1.000 ! spec=13C_...spin, no=990, id=1924, vol=4.919776e+06 or (segid " A" and resid 65 and name HA) (segid " A" and resid 65 and name HG1) assign (segid " A" and resid 60 and name HA) (segid " A" and resid 60 and name HB2) 2.854 1.018 1.018 weight 1.000 ! spec=13C_...spin, no=1039, id=1958, vol=4.050730e+07 or (segid " A" and resid 60 and name HA) (segid " A" and resid 60 and name HB1) assign (segid " A" and resid 60 and name HB1) (segid " A" and resid 60 and name HD2) 3.692 1.704 1.704 weight 1.000 ! spec=13C_...spin, no=1043, id=1962, vol=9.284708e+06 or (segid " A" and resid 60 and name HB1) (segid " A" and resid 60 and name HD1) assign (segid " A" and resid 60 and name HB2) (segid " A" and resid 60 and name HD2) 3.022 1.142 1.142 weight 1.000 ! spec=13C_...spin, no=1044, id=1963, vol=4.956862e+07 or (segid " A" and resid 60 and name HB2) (segid " A" and resid 60 and name HD1) assign (segid " A" and resid 60 and name HA) (segid " A" and resid 60 and name HG1) 3.202 1.282 1.282 weight 1.000 ! spec=13C_...spin, no=1048, id=1966, vol=2.941491e+07 or (segid " A" and resid 60 and name HA) (segid " A" and resid 60 and name HG2) assign (segid " A" and resid 60 and name HG2) (segid " A" and resid 60 and name HD2) 2.719 0.924 0.924 weight 1.000 ! spec=13C_...spin, no=1049, id=1967, vol=4.599987e+07 or (segid " A" and resid 60 and name HG2) (segid " A" and resid 60 and name HD1) or (segid " A" and resid 60 and name HG1) (segid " A" and resid 60 and name HD2) assign (segid " A" and resid 59 and name HA) (segid " A" and resid 59 and name HB) 2.824 0.997 0.997 weight 1.000 ! spec=13C_...spin, no=1052, id=1968, vol=3.400386e+07 or (segid " A" and resid 38 and name HA) (segid " A" and resid 38 and name HB) assign (segid " A" and resid 59 and name HG22) (segid " A" and resid 59 and name HA) 1.594 0.318 4.406 weight 1.000 ! spec=13C_...spin, no=1056, id=1972, vol=9.165460e+08 or (segid " A" and resid 59 and name HG21) (segid " A" and resid 59 and name HA) or (segid " A" and resid 59 and name HG23) (segid " A" and resid 59 and name HA) or (segid " A" and resid 59 and name HG12) (segid " A" and resid 59 and name HA) or (segid " A" and resid 59 and name HG11) (segid " A" and resid 59 and name HA) or (segid " A" and resid 59 and name HG13) (segid " A" and resid 59 and name HA) assign (segid " A" and resid 59 and name HG22) (segid " A" and resid 59 and name HB) 2.189 0.599 0.599 weight 1.000 ! spec=13C_...spin, no=1057, id=1973, vol=7.748550e+07 or (segid " A" and resid 59 and name HG21) (segid " A" and resid 59 and name HB) or (segid " A" and resid 59 and name HG23) (segid " A" and resid 59 and name HB) or (segid " A" and resid 59 and name HG12) (segid " A" and resid 59 and name HB) or (segid " A" and resid 59 and name HG11) (segid " A" and resid 59 and name HB) or (segid " A" and resid 59 and name HG13) (segid " A" and resid 59 and name HB) assign (segid " A" and resid 58 and name HB1) (segid " A" and resid 58 and name HA) 2.049 0.525 0.525 weight 1.000 ! spec=13C_...spin, no=1060, id=1974, vol=3.797463e+08 or (segid " A" and resid 58 and name HB2) (segid " A" and resid 58 and name HA) assign (segid " A" and resid 57 and name HA) (segid " A" and resid 57 and name HG1) 3.276 1.341 1.341 weight 1.000 ! spec=13C_...spin, no=1067, id=1981, vol=2.878166e+07 or (segid " A" and resid 57 and name HA) (segid " A" and resid 57 and name HG2) assign (segid " A" and resid 57 and name HA) (segid " A" and resid 57 and name HB1) 2.865 1.026 1.026 weight 1.000 ! spec=13C_...spin, no=1068, id=1982, vol=5.047388e+07 or (segid " A" and resid 57 and name HA) (segid " A" and resid 57 and name HB2) assign (segid " A" and resid 55 and name HA) (segid " A" and resid 55 and name HB1) 2.400 0.720 0.720 weight 1.000 ! spec=13C_...spin, no=1072, id=1985, vol=1.249589e+08 or (segid " A" and resid 55 and name HA) (segid " A" and resid 55 and name HB2) assign (segid " A" and resid 54 and name HA) (segid " A" and resid 54 and name HD1) 4.557 2.596 2.596 weight 1.000 ! spec=13C_...spin, no=1075, id=1988, vol=5.638656e+06 or (segid " A" and resid 54 and name HA) (segid " A" and resid 54 and name HD2) assign (segid " A" and resid 54 and name HA) (segid " A" and resid 54 and name HG1) 3.309 1.369 1.369 weight 1.000 ! spec=13C_...spin, no=1077, id=1990, vol=3.897417e+07 or (segid " A" and resid 54 and name HA) (segid " A" and resid 54 and name HB2) assign (segid " A" and resid 54 and name HB1) (segid " A" and resid 54 and name HG1) 1.910 0.456 0.456 weight 1.000 ! spec=13C_...spin, no=1079, id=1992, vol=1.874984e+08 or (segid " A" and resid 54 and name HB2) (segid " A" and resid 54 and name HB1) assign (segid " A" and resid 54 and name HB2) (segid " A" and resid 54 and name HD2) 4.556 2.595 2.595 weight 1.000 ! spec=13C_...spin, no=1080, id=1993, vol=4.942571e+06 or (segid " A" and resid 54 and name HB2) (segid " A" and resid 54 and name HD1) assign (segid " A" and resid 54 and name HB1) (segid " A" and resid 54 and name HD1) 4.457 2.483 2.483 weight 1.000 ! spec=13C_...spin, no=1081, id=1994, vol=9.848269e+06 or (segid " A" and resid 54 and name HB1) (segid " A" and resid 54 and name HD2) assign (segid " A" and resid 54 and name HA) (segid " A" and resid 54 and name HG2) 4.443 2.468 2.468 weight 1.000 ! spec=13C_...spin, no=1084, id=1997, vol=7.556948e+06 or (segid " A" and resid 54 and name HA) (segid " A" and resid 54 and name HG1) assign (segid " A" and resid 54 and name HG2) (segid " A" and resid 54 and name HD2) 2.687 0.902 0.902 weight 1.000 ! spec=13C_...spin, no=1085, id=1998, vol=4.905964e+07 or (segid " A" and resid 54 and name HG2) (segid " A" and resid 54 and name HD1) or (segid " A" and resid 54 and name HG1) (segid " A" and resid 54 and name HD1) assign (segid " A" and resid 46 and name HG2) (segid " A" and resid 46 and name HB2) 2.083 0.543 0.543 weight 1.000 ! spec=13C_...spin, no=1086, id=1999, vol=2.187785e+08 or (segid " A" and resid 54 and name HB1) (segid " A" and resid 54 and name HG1) assign (segid " A" and resid 53 and name HA) (segid " A" and resid 54 and name HD1) 2.370 0.702 0.702 weight 1.000 ! spec=13C_...spin, no=1092, id=2002, vol=7.423714e+07 or (segid " A" and resid 53 and name HA) (segid " A" and resid 54 and name HD2) assign (segid " A" and resid 52 and name HA) (segid " A" and resid 52 and name HG12) 2.847 1.013 1.013 weight 1.000 ! spec=13C_...spin, no=1100, id=2004, vol=2.464181e+07 or (segid " A" and resid 52 and name HA) (segid " A" and resid 52 and name HG11) or (segid " A" and resid 52 and name HA) (segid " A" and resid 52 and name HG13) or (segid " A" and resid 52 and name HA) (segid " A" and resid 52 and name HG22) or (segid " A" and resid 52 and name HA) (segid " A" and resid 52 and name HG21) or (segid " A" and resid 52 and name HA) (segid " A" and resid 52 and name HG23) assign (segid " A" and resid 52 and name HB) (segid " A" and resid 52 and name HG12) 2.297 0.660 0.660 weight 1.000 ! spec=13C_...spin, no=1102, id=2005, vol=5.924022e+07 or (segid " A" and resid 52 and name HB) (segid " A" and resid 52 and name HG11) or (segid " A" and resid 52 and name HB) (segid " A" and resid 52 and name HG13) or (segid " A" and resid 52 and name HB) (segid " A" and resid 52 and name HG22) or (segid " A" and resid 52 and name HB) (segid " A" and resid 52 and name HG21) or (segid " A" and resid 52 and name HB) (segid " A" and resid 52 and name HG23) assign (segid " A" and resid 51 and name HB) (segid " A" and resid 51 and name HD12) 2.031 0.516 0.516 weight 1.000 ! spec=13C_...spin, no=1119, id=2016, vol=1.215590e+08 or (segid " A" and resid 51 and name HB) (segid " A" and resid 51 and name HD11) or (segid " A" and resid 51 and name HB) (segid " A" and resid 51 and name HD13) or (segid " A" and resid 51 and name HB) (segid " A" and resid 51 and name HG22) or (segid " A" and resid 51 and name HB) (segid " A" and resid 51 and name HG21) or (segid " A" and resid 51 and name HB) (segid " A" and resid 51 and name HG23) assign (segid " A" and resid 51 and name HG12) (segid " A" and resid 51 and name HG22) 2.027 0.514 0.514 weight 1.000 ! spec=13C_...spin, no=1127, id=2020, vol=1.034267e+08 or (segid " A" and resid 51 and name HG12) (segid " A" and resid 51 and name HG21) or (segid " A" and resid 51 and name HG12) (segid " A" and resid 51 and name HG23) or (segid " A" and resid 51 and name HG12) (segid " A" and resid 51 and name HD12) or (segid " A" and resid 51 and name HG12) (segid " A" and resid 51 and name HD11) or (segid " A" and resid 51 and name HG12) (segid " A" and resid 51 and name HD13) assign (segid " A" and resid 50 and name HA) (segid " A" and resid 50 and name HB2) 3.840 1.843 1.843 weight 1.000 ! spec=13C_...spin, no=1135, id=2028, vol=5.170717e+06 or (segid " A" and resid 50 and name HA) (segid " A" and resid 50 and name HB1) assign (segid " A" and resid 50 and name HA) (segid " A" and resid 50 and name HG2) 3.439 1.479 1.479 weight 1.000 ! spec=13C_...spin, no=1138, id=2029, vol=3.621301e+07 or (segid " A" and resid 50 and name HA) (segid " A" and resid 50 and name HG1) assign (segid " A" and resid 50 and name HD2) (segid " A" and resid 50 and name HA) 6.449 5.199 5.199 weight 1.000 ! spec=13C_...spin, no=1144, id=2034, vol=2.445872e+06 or (segid " A" and resid 50 and name HD1) (segid " A" and resid 50 and name HA) assign (segid " A" and resid 49 and name HB) (segid " A" and resid 37 and name HG22) 2.810 0.987 0.987 weight 1.000 ! spec=13C_...spin, no=1149, id=2038, vol=2.429004e+07 or (segid " A" and resid 49 and name HB) (segid " A" and resid 37 and name HG21) or (segid " A" and resid 49 and name HB) (segid " A" and resid 37 and name HG23) or (segid " A" and resid 49 and name HB) (segid " A" and resid 37 and name HG12) or (segid " A" and resid 49 and name HB) (segid " A" and resid 37 and name HG11) or (segid " A" and resid 49 and name HB) (segid " A" and resid 37 and name HG13) assign (segid " A" and resid 48 and name HA) (segid " A" and resid 48 and name HG2) 4.858 2.950 2.950 weight 1.000 ! spec=13C_...spin, no=1167, id=2051, vol=4.448474e+06 or (segid " A" and resid 48 and name HA) (segid " A" and resid 48 and name HG1) assign (segid " A" and resid 48 and name HA) (segid " A" and resid 48 and name HB1) 2.292 0.657 0.657 weight 1.000 ! spec=13C_...spin, no=1168, id=2052, vol=1.191255e+08 or (segid " A" and resid 48 and name HA) (segid " A" and resid 48 and name HB2) assign (segid " A" and resid 48 and name HB2) (segid " A" and resid 48 and name HG1) 3.370 1.420 1.420 weight 1.000 ! spec=13C_...spin, no=1172, id=2056, vol=1.304704e+07 or (segid " A" and resid 48 and name HB1) (segid " A" and resid 48 and name HG2) or (segid " A" and resid 48 and name HB1) (segid " A" and resid 48 and name HG1) assign (segid " A" and resid 47 and name HB) (segid " A" and resid 13 and name HE1) 3.626 1.643 1.643 weight 1.000 ! spec=13C_...spin, no=1178, id=2059, vol=1.468768e+07 or (segid " A" and resid 47 and name HB) (segid " A" and resid 13 and name HE2) or (segid " A" and resid 47 and name HB) (segid " A" and resid 13 and name HD1) or (segid " A" and resid 47 and name HB) (segid " A" and resid 13 and name HD2) assign (segid " A" and resid 47 and name HA) (segid " A" and resid 47 and name HG21) 2.532 0.801 0.801 weight 1.000 ! spec=13C_...spin, no=1179, id=2060, vol=4.744144e+07 or (segid " A" and resid 47 and name HA) (segid " A" and resid 47 and name HG22) or (segid " A" and resid 47 and name HA) (segid " A" and resid 47 and name HG23) or (segid " A" and resid 47 and name HB) (segid " A" and resid 47 and name HG21) or (segid " A" and resid 47 and name HB) (segid " A" and resid 47 and name HG22) or (segid " A" and resid 47 and name HB) (segid " A" and resid 47 and name HG23) assign (segid " A" and resid 47 and name HG21) (segid " A" and resid 13 and name HE1) 3.011 1.134 1.134 weight 1.000 ! spec=13C_...spin, no=1181, id=2061, vol=3.500488e+07 or (segid " A" and resid 47 and name HG21) (segid " A" and resid 13 and name HE2) or (segid " A" and resid 47 and name HG22) (segid " A" and resid 13 and name HE1) or (segid " A" and resid 47 and name HG22) (segid " A" and resid 13 and name HE2) or (segid " A" and resid 47 and name HG23) (segid " A" and resid 13 and name HE1) or (segid " A" and resid 47 and name HG23) (segid " A" and resid 13 and name HE2) or (segid " A" and resid 47 and name HG21) (segid " A" and resid 13 and name HD1) or (segid " A" and resid 47 and name HG21) (segid " A" and resid 13 and name HD2) or (segid " A" and resid 47 and name HG22) (segid " A" and resid 13 and name HD1) or (segid " A" and resid 47 and name HG22) (segid " A" and resid 13 and name HD2) or (segid " A" and resid 47 and name HG23) (segid " A" and resid 13 and name HD1) or (segid " A" and resid 47 and name HG23) (segid " A" and resid 13 and name HD2) assign (segid " A" and resid 40 and name HE1) (segid " A" and resid 40 and name HA) 5.561 3.866 3.866 weight 1.000 ! spec=13C_...spin, no=1201, id=2071, vol=3.359290e+06 or (segid " A" and resid 40 and name HE2) (segid " A" and resid 40 and name HA) or (segid " A" and resid 40 and name HE1) (segid " A" and resid 44 and name HA2) or (segid " A" and resid 40 and name HE2) (segid " A" and resid 44 and name HA2) assign (segid " A" and resid 45 and name HA) (segid " A" and resid 45 and name HB1) 2.836 1.005 1.005 weight 1.000 ! spec=13C_...spin, no=1237, id=2093, vol=4.438314e+07 or (segid " A" and resid 45 and name HA) (segid " A" and resid 45 and name HB2) assign (segid " A" and resid 37 and name HA) (segid " A" and resid 37 and name HG12) 2.544 0.809 0.809 weight 1.000 ! spec=13C_...spin, no=1280, id=2122, vol=3.929155e+07 or (segid " A" and resid 37 and name HA) (segid " A" and resid 37 and name HG11) or (segid " A" and resid 37 and name HA) (segid " A" and resid 37 and name HG13) or (segid " A" and resid 37 and name HA) (segid " A" and resid 37 and name HG22) or (segid " A" and resid 37 and name HA) (segid " A" and resid 37 and name HG21) or (segid " A" and resid 37 and name HA) (segid " A" and resid 37 and name HG23) assign (segid " A" and resid 37 and name HB) (segid " A" and resid 37 and name HG12) 2.226 0.619 0.619 weight 1.000 ! spec=13C_...spin, no=1282, id=2124, vol=7.207142e+07 or (segid " A" and resid 37 and name HB) (segid " A" and resid 37 and name HG11) or (segid " A" and resid 37 and name HB) (segid " A" and resid 37 and name HG13) or (segid " A" and resid 37 and name HB) (segid " A" and resid 37 and name HG22) or (segid " A" and resid 37 and name HB) (segid " A" and resid 37 and name HG21) or (segid " A" and resid 37 and name HB) (segid " A" and resid 37 and name HG23) assign (segid " A" and resid 36 and name HA) (segid " A" and resid 36 and name HB1) 2.585 0.835 0.835 weight 1.000 ! spec=13C_...spin, no=1288, id=2130, vol=9.190014e+07 or (segid " A" and resid 36 and name HA) (segid " A" and resid 36 and name HB2) assign (segid " A" and resid 34 and name HA) (segid " A" and resid 34 and name HB2) 2.609 0.851 0.851 weight 1.000 ! spec=13C_...spin, no=1299, id=2139, vol=8.003071e+07 or (segid " A" and resid 34 and name HA) (segid " A" and resid 34 and name HB1) assign (segid " A" and resid 33 and name HA) (segid " A" and resid 54 and name HD1) 3.144 1.235 1.235 weight 1.000 ! spec=13C_...spin, no=1311, id=2143, vol=3.180331e+07 or (segid " A" and resid 33 and name HA) (segid " A" and resid 54 and name HD2) assign (segid " A" and resid 32 and name HG2) (segid " A" and resid 32 and name HD1) 1.966 0.483 0.483 weight 1.000 ! spec=13C_...spin, no=1326, id=2151, vol=3.016561e+08 or (segid " A" and resid 32 and name HG2) (segid " A" and resid 32 and name HD2) assign (segid " A" and resid 32 and name HG1) (segid " A" and resid 32 and name HD1) 1.529 0.292 4.471 weight 1.000 ! spec=13C_...spin, no=1332, id=2154, vol=1.821341e+09 or (segid " A" and resid 32 and name HG1) (segid " A" and resid 32 and name HD2) assign (segid " A" and resid 28 and name HB1) (segid " A" and resid 28 and name HD22) 2.126 0.565 0.565 weight 1.000 ! spec=13C_...spin, no=1391, id=2196, vol=9.602774e+07 or (segid " A" and resid 28 and name HB1) (segid " A" and resid 28 and name HD21) or (segid " A" and resid 28 and name HB1) (segid " A" and resid 28 and name HD23) or (segid " A" and resid 28 and name HG) (segid " A" and resid 28 and name HD22) or (segid " A" and resid 28 and name HG) (segid " A" and resid 28 and name HD21) or (segid " A" and resid 28 and name HG) (segid " A" and resid 28 and name HD23) assign (segid " A" and resid 25 and name HA) (segid " A" and resid 28 and name HB1) 3.101 1.202 1.202 weight 1.000 ! spec=13C_...spin, no=1409, id=2208, vol=2.212190e+07 or (segid " A" and resid 25 and name HA) (segid " A" and resid 25 and name HB) assign (segid " A" and resid 25 and name HA) (segid " A" and resid 25 and name HG11) 3.847 1.849 1.849 weight 1.000 ! spec=13C_...spin, no=1411, id=2210, vol=5.883736e+06 or (segid " A" and resid 25 and name HA) (segid " A" and resid 25 and name HG12) assign (segid " A" and resid 25 and name HB) (segid " A" and resid 25 and name HG12) 4.102 2.104 2.104 weight 1.000 ! spec=13C_...spin, no=1419, id=2213, vol=3.242897e+06 or (segid " A" and resid 25 and name HB) (segid " A" and resid 25 and name HG11) assign (segid " A" and resid 25 and name HB) (segid " A" and resid 25 and name HG11) 2.106 0.554 0.554 weight 1.000 ! spec=13C_...spin, no=1421, id=2215, vol=2.325941e+08 or (segid " A" and resid 5 and name HG1) (segid " A" and resid 5 and name HB2) or (segid " A" and resid 5 and name HG1) (segid " A" and resid 5 and name HB1) or (segid " A" and resid 5 and name HG2) (segid " A" and resid 5 and name HB2) or (segid " A" and resid 5 and name HG2) (segid " A" and resid 5 and name HB1) or (segid " A" and resid 5 and name HG2) (segid " A" and resid 5 and name HE2) or (segid " A" and resid 5 and name HG2) (segid " A" and resid 5 and name HE1) or (segid " A" and resid 5 and name HG2) (segid " A" and resid 5 and name HE3) assign (segid " A" and resid 25 and name HG11) (segid " A" and resid 25 and name HG22) 2.819 0.993 0.993 weight 1.000 ! spec=13C_...spin, no=1425, id=2216, vol=3.124566e+07 or (segid " A" and resid 25 and name HG11) (segid " A" and resid 25 and name HG21) or (segid " A" and resid 25 and name HG11) (segid " A" and resid 25 and name HG23) or (segid " A" and resid 25 and name HG12) (segid " A" and resid 25 and name HG22) or (segid " A" and resid 25 and name HG12) (segid " A" and resid 25 and name HG21) or (segid " A" and resid 25 and name HG12) (segid " A" and resid 25 and name HG23) assign (segid " A" and resid 25 and name HG12) (segid " A" and resid 25 and name HD12) 1.868 0.436 0.436 weight 1.000 ! spec=13C_...spin, no=1426, id=2217, vol=2.112465e+08 or (segid " A" and resid 25 and name HG12) (segid " A" and resid 25 and name HD11) or (segid " A" and resid 25 and name HG12) (segid " A" and resid 25 and name HD13) or (segid " A" and resid 25 and name HG11) (segid " A" and resid 25 and name HD12) or (segid " A" and resid 25 and name HG11) (segid " A" and resid 25 and name HD11) or (segid " A" and resid 25 and name HG11) (segid " A" and resid 25 and name HD13) assign (segid " A" and resid 35 and name HB) (segid " A" and resid 22 and name HB2) 2.559 0.819 0.819 weight 1.000 ! spec=13C_...spin, no=1444, id=2227, vol=5.082277e+07 or (segid " A" and resid 35 and name HB) (segid " A" and resid 22 and name HB1) or (segid " A" and resid 35 and name HB) (segid " A" and resid 22 and name HB3) or (segid " A" and resid 22 and name HB2) (segid " A" and resid 19 and name HA) or (segid " A" and resid 22 and name HB1) (segid " A" and resid 19 and name HA) or (segid " A" and resid 22 and name HB3) (segid " A" and resid 19 and name HA) assign (segid " A" and resid 21 and name HA) (segid " A" and resid 21 and name HG12) 2.270 0.644 0.644 weight 1.000 ! spec=13C_...spin, no=1449, id=2232, vol=1.536231e+08 or (segid " A" and resid 21 and name HA) (segid " A" and resid 21 and name HG11) assign (segid " A" and resid 21 and name HB) (segid " A" and resid 21 and name HG11) 3.490 1.522 1.522 weight 1.000 ! spec=13C_...spin, no=1456, id=2239, vol=8.784752e+06 or (segid " A" and resid 21 and name HB) (segid " A" and resid 21 and name HG12) assign (segid " A" and resid 21 and name HG11) (segid " A" and resid 21 and name HD12) 2.566 0.823 0.823 weight 1.000 ! spec=13C_...spin, no=1466, id=2249, vol=3.041981e+07 or (segid " A" and resid 21 and name HG11) (segid " A" and resid 21 and name HD11) or (segid " A" and resid 21 and name HG11) (segid " A" and resid 21 and name HD13) or (segid " A" and resid 21 and name HG12) (segid " A" and resid 21 and name HD12) or (segid " A" and resid 21 and name HG12) (segid " A" and resid 21 and name HD11) or (segid " A" and resid 21 and name HG12) (segid " A" and resid 21 and name HD13) assign (segid " A" and resid 18 and name HB2) (segid " A" and resid 13 and name HE1) 3.110 1.209 1.209 weight 1.000 ! spec=13C_...spin, no=1483, id=2263, vol=4.947936e+07 or (segid " A" and resid 18 and name HB2) (segid " A" and resid 13 and name HE2) or (segid " A" and resid 18 and name HB1) (segid " A" and resid 13 and name HE1) or (segid " A" and resid 18 and name HB1) (segid " A" and resid 13 and name HE2) or (segid " A" and resid 18 and name HB3) (segid " A" and resid 13 and name HE1) or (segid " A" and resid 18 and name HB3) (segid " A" and resid 13 and name HE2) or (segid " A" and resid 18 and name HB2) (segid " A" and resid 13 and name HD1) or (segid " A" and resid 18 and name HB2) (segid " A" and resid 13 and name HD2) or (segid " A" and resid 18 and name HB1) (segid " A" and resid 13 and name HD1) or (segid " A" and resid 18 and name HB1) (segid " A" and resid 13 and name HD2) or (segid " A" and resid 18 and name HB3) (segid " A" and resid 13 and name HD1) or (segid " A" and resid 18 and name HB3) (segid " A" and resid 13 and name HD2) assign (segid " A" and resid 16 and name HA) (segid " A" and resid 16 and name HB1) 3.300 1.361 1.361 weight 1.000 ! spec=13C_...spin, no=1507, id=2281, vol=4.695863e+07 or (segid " A" and resid 16 and name HA) (segid " A" and resid 16 and name HG2) assign (segid " A" and resid 12 and name HA) (segid " A" and resid 12 and name HD1) 5.530 3.822 3.822 weight 1.000 ! spec=13C_...spin, no=1559, id=2311, vol=5.632568e+06 or (segid " A" and resid 12 and name HA) (segid " A" and resid 12 and name HD2) assign (segid " A" and resid 12 and name HB2) (segid " A" and resid 12 and name HG1) 1.859 0.432 0.432 weight 1.000 ! spec=13C_...spin, no=1563, id=2314, vol=4.024740e+08 or (segid " A" and resid 91 and name HB1) (segid " A" and resid 91 and name HG2) or (segid " A" and resid 91 and name HB1) (segid " A" and resid 91 and name HG1) assign (segid " A" and resid 12 and name HB2) (segid " A" and resid 12 and name HD1) 3.255 1.325 1.325 weight 1.000 ! spec=13C_...spin, no=1564, id=2315, vol=2.557994e+07 or (segid " A" and resid 12 and name HB2) (segid " A" and resid 12 and name HD2) assign (segid " A" and resid 11 and name HA) (segid " A" and resid 11 and name HD2) 3.990 1.990 1.990 weight 1.000 ! spec=13C_...spin, no=1567, id=2316, vol=8.656699e+06 or (segid " A" and resid 11 and name HA) (segid " A" and resid 11 and name HD1) assign (segid " A" and resid 11 and name HA) (segid " A" and resid 11 and name HG2) 2.590 0.838 0.838 weight 1.000 ! spec=13C_...spin, no=1570, id=2319, vol=8.583580e+07 or (segid " A" and resid 11 and name HA) (segid " A" and resid 11 and name HG1) assign (segid " A" and resid 11 and name HG2) (segid " A" and resid 11 and name HD2) 2.280 0.650 0.650 weight 1.000 ! spec=13C_...spin, no=1576, id=2322, vol=1.428370e+08 or (segid " A" and resid 11 and name HG2) (segid " A" and resid 11 and name HD1) or (segid " A" and resid 11 and name HG1) (segid " A" and resid 11 and name HD2) or (segid " A" and resid 11 and name HG1) (segid " A" and resid 11 and name HD1) assign (segid " A" and resid 6 and name HA) (segid " A" and resid 7 and name HD2) 2.197 0.603 0.603 weight 1.000 ! spec=13C_...spin, no=1628, id=2344, vol=1.749957e+08 or (segid " A" and resid 6 and name HA) (segid " A" and resid 6 and name HB1) assign (segid " A" and resid 7 and name HB1) (segid " A" and resid 7 and name HD2) 2.927 1.071 1.071 weight 1.000 ! spec=13C_...spin, no=1636, id=2347, vol=7.057753e+07 or (segid " A" and resid 7 and name HB1) (segid " A" and resid 7 and name HD1) assign (segid " A" and resid 7 and name HB2) (segid " A" and resid 7 and name HD1) 4.334 2.348 2.348 weight 1.000 ! spec=13C_...spin, no=1639, id=2349, vol=1.369383e+07 or (segid " A" and resid 7 and name HB2) (segid " A" and resid 7 and name HD2) assign (segid " A" and resid 7 and name HA) (segid " A" and resid 7 and name HD1) 3.265 1.332 1.332 weight 1.000 ! spec=13C_...spin, no=1646, id=2353, vol=4.004702e+07 or (segid " A" and resid 7 and name HA) (segid " A" and resid 7 and name HD2) assign (segid " A" and resid 6 and name HA) (segid " A" and resid 7 and name HD2) 2.564 0.822 0.822 weight 1.000 ! spec=13C_...spin, no=1647, id=2354, vol=6.446275e+07 or (segid " A" and resid 6 and name HA) (segid " A" and resid 7 and name HD1) assign (segid " A" and resid 7 and name HG1) (segid " A" and resid 7 and name HD2) 2.872 1.031 1.031 weight 1.000 ! spec=13C_...spin, no=1649, id=2356, vol=3.200786e+07 or (segid " A" and resid 7 and name HG1) (segid " A" and resid 7 and name HD1) assign (segid " A" and resid 5 and name HA) (segid " A" and resid 5 and name HB1) 2.394 0.717 0.717 weight 1.000 ! spec=13C_...spin, no=1659, id=2363, vol=1.297923e+08 or (segid " A" and resid 5 and name HA) (segid " A" and resid 5 and name HB2) assign (segid " A" and resid 5 and name HG1) (segid " A" and resid 5 and name HB2) 2.624 0.861 0.861 weight 1.000 ! spec=13C_...spin, no=1660, id=2364, vol=7.190887e+07 or (segid " A" and resid 5 and name HG1) (segid " A" and resid 5 and name HB1) assign (segid " A" and resid 5 and name HG2) (segid " A" and resid 5 and name HA) 3.506 1.536 1.536 weight 1.000 ! spec=13C_...spin, no=1664, id=2366, vol=1.756976e+07 or (segid " A" and resid 5 and name HG1) (segid " A" and resid 5 and name HA) assign (segid " A" and resid 3 and name HA) (segid " A" and resid 3 and name HB2) 3.384 1.431 1.431 weight 1.000 ! spec=13C_...spin, no=1668, id=2369, vol=1.954420e+07 or (segid " A" and resid 3 and name HA) (segid " A" and resid 3 and name HB1) assign (segid " A" and resid 3 and name HB1) (segid " A" and resid 3 and name HG2) 3.028 1.146 1.146 weight 1.000 ! spec=13C_...spin, no=1673, id=2372, vol=3.696250e+07 or (segid " A" and resid 3 and name HB1) (segid " A" and resid 3 and name HG1) assign (segid " A" and resid 120 and name HD12) (segid " A" and resid 120 and name HB1) 2.552 0.814 0.814 weight 1.000 ! spec=13C_...spin, no=1824, id=2384, vol=1.771950e+08 or (segid " A" and resid 120 and name HD11) (segid " A" and resid 120 and name HB1) or (segid " A" and resid 120 and name HD13) (segid " A" and resid 120 and name HB1) or (segid " A" and resid 120 and name HD12) (segid " A" and resid 122 and name HG) or (segid " A" and resid 120 and name HD11) (segid " A" and resid 122 and name HG) or (segid " A" and resid 120 and name HD13) (segid " A" and resid 122 and name HG) assign (segid " A" and resid 116 and name HG1) (segid " A" and resid 116 and name HA) 4.188 2.192 2.192 weight 1.000 ! spec=13C_...spin, no=1920, id=2396, vol=1.178247e+07 or (segid " A" and resid 116 and name HG2) (segid " A" and resid 116 and name HA) assign (segid " A" and resid 38 and name HB) (segid " A" and resid 48 and name HG1) 2.329 0.678 0.678 weight 1.000 ! spec=13C_...spin, no=1987, id=2409, vol=7.693284e+07 or (segid " A" and resid 38 and name HB) (segid " A" and resid 48 and name HG2) assign (segid " A" and resid 82 and name HA) (segid " A" and resid 81 and name HB1) 3.731 1.740 1.740 weight 1.000 ! spec=13C_...spin, no=2000, id=2414, vol=1.343892e+07 or (segid " A" and resid 82 and name HA) (segid " A" and resid 81 and name HB2) assign (segid " A" and resid 109 and name HG22) (segid " A" and resid 111 and name HE1) 3.200 1.280 1.280 weight 1.000 ! spec=13C_...spin, no=2040, id=2422, vol=6.201749e+07 or (segid " A" and resid 109 and name HG22) (segid " A" and resid 111 and name HE2) or (segid " A" and resid 109 and name HG21) (segid " A" and resid 111 and name HE1) or (segid " A" and resid 109 and name HG21) (segid " A" and resid 111 and name HE2) or (segid " A" and resid 109 and name HG23) (segid " A" and resid 111 and name HE1) or (segid " A" and resid 109 and name HG23) (segid " A" and resid 111 and name HE2) or (segid " A" and resid 109 and name HG22) (segid " A" and resid 111 and name HD1) or (segid " A" and resid 109 and name HG22) (segid " A" and resid 111 and name HD2) or (segid " A" and resid 109 and name HG21) (segid " A" and resid 111 and name HD1) or (segid " A" and resid 109 and name HG21) (segid " A" and resid 111 and name HD2) or (segid " A" and resid 109 and name HG23) (segid " A" and resid 111 and name HD1) or (segid " A" and resid 109 and name HG23) (segid " A" and resid 111 and name HD2) assign (segid " A" and resid 38 and name HG22) (segid " A" and resid 48 and name HB1) 3.529 1.557 1.557 weight 1.000 ! spec=13C_...spin, no=2093, id=2427, vol=5.146553e+07 or (segid " A" and resid 38 and name HG21) (segid " A" and resid 48 and name HB1) or (segid " A" and resid 38 and name HG23) (segid " A" and resid 48 and name HB1) or (segid " A" and resid 38 and name HG22) (segid " A" and resid 48 and name HB2) or (segid " A" and resid 38 and name HG21) (segid " A" and resid 48 and name HB2) or (segid " A" and resid 38 and name HG23) (segid " A" and resid 48 and name HB2) assign (segid " A" and resid 38 and name HG12) (segid " A" and resid 48 and name HB1) 3.835 1.839 1.839 weight 1.000 ! spec=13C_...spin, no=2094, id=2428, vol=3.946108e+07 or (segid " A" and resid 38 and name HG11) (segid " A" and resid 48 and name HB1) or (segid " A" and resid 38 and name HG13) (segid " A" and resid 48 and name HB1) or (segid " A" and resid 38 and name HG12) (segid " A" and resid 48 and name HB2) or (segid " A" and resid 38 and name HG11) (segid " A" and resid 48 and name HB2) or (segid " A" and resid 38 and name HG13) (segid " A" and resid 48 and name HB2) assign (segid " A" and resid 8 and name HA) (segid " A" and resid 11 and name HD1) 4.520 2.554 2.554 weight 1.000 ! spec=13C_...spin, no=2132, id=2433, vol=6.273189e+06 or (segid " A" and resid 8 and name HA) (segid " A" and resid 11 and name HD2) assign (segid " A" and resid 9 and name HA) (segid " A" and resid 12 and name HD1) 4.163 2.166 2.166 weight 1.000 ! spec=13C_...spin, no=2156, id=2438, vol=1.268654e+07 or (segid " A" and resid 9 and name HA) (segid " A" and resid 12 and name HD2) assign (segid " A" and resid 69 and name HB2) (segid " A" and resid 50 and name HB1) 4.161 2.164 2.164 weight 1.000 ! spec=13C_...spin, no=2254, id=2456, vol=5.898286e+06 or (segid " A" and resid 69 and name HB1) (segid " A" and resid 50 and name HB1) or (segid " A" and resid 69 and name HB3) (segid " A" and resid 50 and name HB1) or (segid " A" and resid 69 and name HB2) (segid " A" and resid 50 and name HB2) or (segid " A" and resid 69 and name HB1) (segid " A" and resid 50 and name HB2) or (segid " A" and resid 69 and name HB3) (segid " A" and resid 50 and name HB2) assign (segid " A" and resid 109 and name HG22) (segid " A" and resid 116 and name HG2) 4.005 2.005 2.005 weight 1.000 ! spec=13C_...spin, no=2409, id=2489, vol=1.478054e+07 or (segid " A" and resid 109 and name HG21) (segid " A" and resid 116 and name HG2) or (segid " A" and resid 109 and name HG23) (segid " A" and resid 116 and name HG2) or (segid " A" and resid 109 and name HG22) (segid " A" and resid 116 and name HG1) or (segid " A" and resid 109 and name HG21) (segid " A" and resid 116 and name HG1) or (segid " A" and resid 109 and name HG23) (segid " A" and resid 116 and name HG1) assign (segid " A" and resid 114 and name HD2) (segid " A" and resid 32 and name HB1) 3.691 1.703 1.703 weight 1.000 ! spec=13C_...spin, no=2551, id=2511, vol=7.753390e+06 or (segid " A" and resid 114 and name HD1) (segid " A" and resid 32 and name HB1) assign (segid " A" and resid 54 and name HD2) (segid " A" and resid 53 and name HB2) 3.834 1.838 1.838 weight 1.000 ! spec=13C_...spin, no=2555, id=2512, vol=2.189633e+07 or (segid " A" and resid 54 and name HD2) (segid " A" and resid 53 and name HB1) or (segid " A" and resid 54 and name HD2) (segid " A" and resid 53 and name HB3) or (segid " A" and resid 54 and name HD1) (segid " A" and resid 53 and name HB2) or (segid " A" and resid 54 and name HD1) (segid " A" and resid 53 and name HB1) or (segid " A" and resid 54 and name HD1) (segid " A" and resid 53 and name HB3) assign (segid " A" and resid 48 and name HN) (segid " A" and resid 48 and name HB1) 2.936 1.078 1.078 weight 1.000 ! spec=15N_...last, no=40, id=475, vol=1.713699e+07 or (segid " A" and resid 48 and name HN) (segid " A" and resid 48 and name HB2) assign (segid " A" and resid 70 and name HN) (segid " A" and resid 70 and name HB1) 3.264 1.332 1.332 weight 1.000 ! spec=15N_...last, no=56, id=485, vol=1.659413e+07 or (segid " A" and resid 70 and name HN) (segid " A" and resid 70 and name HD12) or (segid " A" and resid 70 and name HN) (segid " A" and resid 70 and name HD11) or (segid " A" and resid 70 and name HN) (segid " A" and resid 70 and name HD13) assign (segid " A" and resid 115 and name HN) (segid " A" and resid 114 and name HA) 2.769 0.959 0.959 weight 1.000 ! spec=15N_...last, no=71, id=494, vol=1.403778e+07 or (segid " A" and resid 115 and name HN) (segid " A" and resid 113 and name HB1) assign (segid " A" and resid 5 and name HN) (segid " A" and resid 4 and name HA1) 2.477 0.767 0.767 weight 1.000 ! spec=15N_...last, no=75, id=498, vol=2.633299e+07 or (segid " A" and resid 5 and name HN) (segid " A" and resid 4 and name HA2) assign (segid " A" and resid 5 and name HN) (segid " A" and resid 5 and name HB2) 2.972 1.104 1.104 weight 1.000 ! spec=15N_...last, no=77, id=500, vol=1.215411e+07 or (segid " A" and resid 5 and name HN) (segid " A" and resid 5 and name HB1) assign (segid " A" and resid 100 and name HN) (segid " A" and resid 100 and name HB1) 2.145 0.575 0.575 weight 1.000 ! spec=15N_...last, no=147, id=534, vol=4.603984e+07 or (segid " A" and resid 100 and name HN) (segid " A" and resid 100 and name HB2) assign (segid " A" and resid 16 and name HN) (segid " A" and resid 16 and name HA) 2.809 0.986 0.986 weight 1.000 ! spec=15N_...last, no=209, id=572, vol=1.303222e+07 or (segid " A" and resid 16 and name HN) (segid " A" and resid 13 and name HA) assign (segid " A" and resid 50 and name HE) (segid " A" and resid 50 and name HD1) 3.073 1.180 1.180 weight 1.000 ! spec=15N_...last, no=249, id=596, vol=5.812966e+06 or (segid " A" and resid 50 and name HE) (segid " A" and resid 50 and name HD2) assign (segid " A" and resid 50 and name HE) (segid " A" and resid 50 and name HB1) 3.905 1.906 1.906 weight 1.000 ! spec=15N_...last, no=250, id=597, vol=2.977608e+06 or (segid " A" and resid 50 and name HE) (segid " A" and resid 50 and name HB2) assign (segid " A" and resid 50 and name HE) (segid " A" and resid 50 and name HG2) 3.458 1.495 1.495 weight 1.000 ! 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spec=15N_...last, no=1018, id=1116, vol=2.785683e+06 or (segid " A" and resid 114 and name HN) (segid " A" and resid 114 and name HD1) assign (segid " A" and resid 114 and name HN) (segid " A" and resid 114 and name HB2) 2.905 1.055 1.055 weight 1.000 ! spec=15N_...last, no=1020, id=1117, vol=8.996107e+06 or (segid " A" and resid 114 and name HN) (segid " A" and resid 114 and name HG1) assign (segid " A" and resid 115 and name HN) (segid " A" and resid 114 and name HB1) 3.951 1.951 1.951 weight 1.000 ! spec=15N_...last, no=1025, id=1119, vol=3.992665e+06 or (segid " A" and resid 115 and name HN) (segid " A" and resid 114 and name HG2) assign (segid " A" and resid 116 and name HN) (segid " A" and resid 116 and name HG2) 2.798 0.979 0.979 weight 1.000 ! spec=15N_...last, no=1036, id=1124, vol=1.018057e+07 or (segid " A" and resid 116 and name HN) (segid " A" and resid 116 and name HG1) assign (segid " A" and resid 117 and name HN) (segid " A" and resid 116 and name HG2) 3.548 1.573 1.573 weight 1.000 ! spec=15N_...last, no=1045, id=1130, vol=1.141871e+07 or (segid " A" and resid 117 and name HN) (segid " A" and resid 116 and name HG1) assign (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HD12) 3.162 1.250 1.250 weight 1.000 ! spec=15N_...last, no=1100, id=1170, vol=1.486569e+07 or (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HD11) or (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HD13) or (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HD22) or (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HD21) or (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HD23) assign (segid " A" and resid 126 and name HN) (segid " A" and resid 126 and name HB1) 3.275 1.341 1.341 weight 1.000 ! spec=15N_...last, no=1127, id=1194, vol=1.982493e+07 or (segid " A" and resid 126 and name HN) (segid " A" and resid 126 and name HD22) or (segid " A" and resid 126 and name HN) (segid " A" and resid 126 and name HD21) or (segid " A" and resid 126 and name HN) (segid " A" and resid 126 and name HD23) assign (segid " A" and resid 128 and name HN) (segid " A" and resid 127 and name HB2) 3.329 1.385 1.385 weight 1.000 ! spec=15N_...last, no=1138, id=1204, vol=2.012906e+07 or (segid " A" and resid 128 and name HN) (segid " A" and resid 128 and name HB1) assign (segid " A" and resid 48 and name HE22) (segid " A" and resid 48 and name HG1) 4.034 2.034 2.034 weight 1.000 ! spec=15N_...last, no=1187, id=1218, vol=7.460382e+06 or (segid " A" and resid 48 and name HE22) (segid " A" and resid 48 and name HG2) assign (segid " A" and resid 48 and name HE21) (segid " A" and resid 48 and name HG2) 3.137 1.230 1.230 weight 1.000 ! spec=15N_...last, no=1188, id=1219, vol=4.030765e+06 or (segid " A" and resid 48 and name HE21) (segid " A" and resid 48 and name HG1) assign (segid " A" and resid 116 and name HE21) (segid " A" and resid 116 and name HG2) 3.001 1.125 1.125 weight 1.000 ! spec=15N_...last, no=1209, id=1225, vol=5.133890e+06 or (segid " A" and resid 116 and name HE21) (segid " A" and resid 116 and name HG1) assign (segid " A" and resid 116 and name HE22) (segid " A" and resid 116 and name HG2) 3.483 1.517 1.517 weight 1.000 ! spec=15N_...last, no=1237, id=1231, vol=1.291556e+07 or (segid " A" and resid 116 and name HE22) (segid " A" and resid 116 and name HG1) assign (segid " A" and resid 105 and name HD21) (segid " A" and resid 105 and name HB2) 3.124 1.220 1.220 weight 1.000 ! spec=15N_...last, no=1244, id=1233, vol=6.059735e+06 or (segid " A" and resid 105 and name HD21) (segid " A" and resid 105 and name HB1) assign (segid " A" and resid 105 and name HD22) (segid " A" and resid 105 and name HB2) 4.639 2.690 2.690 weight 1.000 ! spec=15N_...last, no=1245, id=1234, vol=3.537523e+06 or (segid " A" and resid 105 and name HD22) (segid " A" and resid 105 and name HB1) assign (segid " A" and resid 25 and name HN) (segid " A" and resid 26 and name HN) 2.032 0.516 0.516 weight 1.000 ! spec=15N_...last, no=1292, id=1245, vol=6.031343e+07 or (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HN) assign (segid " A" and resid 24 and name HN) (segid " A" and resid 23 and name HB2) 2.319 0.672 0.672 weight 1.000 ! spec=15N_...last, no=1296, id=1247, vol=3.524859e+07 or (segid " A" and resid 24 and name HN) (segid " A" and resid 23 and name HB1) or (segid " A" and resid 21 and name HN) (segid " A" and resid 20 and name HB1) assign (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HB2) 1.898 0.450 0.450 weight 1.000 ! spec=15N_...last, no=1298, id=1249, vol=7.218027e+07 or (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HB1) or (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HB3) or (segid " A" and resid 26 and name HN) (segid " A" and resid 26 and name HB2) or (segid " A" and resid 26 and name HN) (segid " A" and resid 26 and name HB1) or (segid " A" and resid 26 and name HN) (segid " A" and resid 26 and name HB3) assign (segid " A" and resid 45 and name HN) (segid " A" and resid 44 and name HA2) 3.286 1.349 1.349 weight 1.000 ! spec=15N_...last, no=1318, id=1253, vol=4.410274e+06 or (segid " A" and resid 45 and name HN) (segid " A" and resid 45 and name HA) assign (segid " A" and resid 48 and name HE21) (segid " A" and resid 48 and name HB2) 3.578 1.600 1.600 weight 1.000 ! spec=15N_...last, no=1451, id=1283, vol=4.189581e+06 or (segid " A" and resid 48 and name HE21) (segid " A" and resid 48 and name HB1) assign (segid " A" and resid 48 and name HE22) (segid " A" and resid 48 and name HB1) 4.163 2.166 2.166 weight 1.000 ! spec=15N_...last, no=1452, id=1284, vol=4.680952e+06 or (segid " A" and resid 48 and name HE22) (segid " A" and resid 48 and name HB2) assign (segid " A" and resid 99 and name HN) (segid " A" and resid 98 and name HG2) 4.131 2.133 2.133 weight 1.000 ! spec=15N_...last, no=1483, id=1294, vol=3.962210e+06 or (segid " A" and resid 99 and name HN) (segid " A" and resid 98 and name HG1) assign (segid " A" and resid 12 and name HN) (segid " A" and resid 12 and name HD1) 4.314 2.326 2.326 weight 1.000 ! spec=15N_...last, no=1510, id=1302, vol=6.673314e+06 or (segid " A" and resid 12 and name HN) (segid " A" and resid 12 and name HD2) assign (segid " A" and resid 36 and name HN) (segid " A" and resid 50 and name HG2) 3.314 1.373 1.373 weight 1.000 ! spec=15N_...last, no=1515, id=1303, vol=4.850655e+06 or (segid " A" and resid 36 and name HN) (segid " A" and resid 50 and name HG1) assign (segid " A" and resid 114 and name HN) (segid " A" and resid 114 and name HB1) 3.854 1.856 1.856 weight 1.000 ! spec=15N_...last, no=1523, id=1306, vol=5.801954e+06 or (segid " A" and resid 114 and name HN) (segid " A" and resid 114 and name HG2) assign (segid " A" and resid 127 and name HN) (segid " A" and resid 127 and name HB1) 3.498 1.529 1.529 weight 1.000 ! spec=15N_...last, no=1541, id=1312, vol=1.476955e+07 or (segid " A" and resid 118 and name HN) (segid " A" and resid 118 and name HB1) assign (segid " A" and resid 99 and name HN) (segid " A" and resid 98 and name HB1) 3.121 1.217 1.217 weight 1.000 ! spec=15N_...last, no=1562, id=1318, vol=5.283620e+06 or (segid " A" and resid 99 and name HN) (segid " A" and resid 98 and name HB2) assign (segid " A" and resid 34 and name HN) (segid " A" and resid 54 and name HD2) 3.457 1.493 1.493 weight 1.000 ! spec=15N_...last, no=1565, id=1320, vol=4.041734e+06 or (segid " A" and resid 34 and name HN) (segid " A" and resid 54 and name HD1) assign (segid " A" and resid 17 and name HD1) (segid " A" and resid 17 and name HZ) 3.835 1.838 1.838 weight 1.000 ! spec=NOESY_D2O, no=200, id=81, vol=1.128733e+06 or (segid " A" and resid 17 and name HD2) (segid " A" and resid 17 and name HZ) or (segid " A" and resid 17 and name HD1) (segid " A" and resid 13 and name HD1) or (segid " A" and resid 17 and name HD1) (segid " A" and resid 13 and name HD2) or (segid " A" and resid 17 and name HD2) (segid " A" and resid 13 and name HD1) or (segid " A" and resid 17 and name HD2) (segid " A" and resid 13 and name HD2) assign (segid " A" and resid 23 and name HD2) (segid " A" and resid 23 and name HA) 4.142 2.145 2.145 weight 1.000 ! spec=NOESY_D2O, no=3017, id=168, vol=1.169405e+06 or (segid " A" and resid 23 and name HD1) (segid " A" and resid 23 and name HA) assign (segid " A" and resid 72 and name HB2) (segid " A" and resid 72 and name HA) 2.752 0.947 0.947 weight 1.000 ! spec=NOESY_D2O, no=3037, id=170, vol=1.989229e+06 or (segid " A" and resid 127 and name HB1) (segid " A" and resid 127 and name HA) assign (segid " A" and resid 103 and name HZ2) (segid " A" and resid 70 and name HD22) 3.450 1.488 1.488 weight 1.000 ! spec=NOESY_D2O, no=3215, id=194, vol=9.848388e+05 or (segid " A" and resid 103 and name HZ2) (segid " A" and resid 70 and name HD21) or (segid " A" and resid 103 and name HZ2) (segid " A" and resid 70 and name HD23) or (segid " A" and resid 126 and name HB2) (segid " A" and resid 103 and name HZ2) assign (segid " A" and resid 89 and name HZ) (segid " A" and resid 21 and name HG11) 3.540 1.566 1.566 weight 1.000 ! spec=NOESY_D2O, no=3223, id=201, vol=3.345484e+05 or (segid " A" and resid 89 and name HZ) (segid " A" and resid 21 and name HG12) assign (segid " A" and resid 36 and name HB1) (segid " A" and resid 50 and name HG2) 3.084 1.189 1.189 weight 1.000 ! spec=NOESY_D2O, no=3265, id=213, vol=1.117356e+06 or (segid " A" and resid 36 and name HB1) (segid " A" and resid 50 and name HG1) assign (segid " A" and resid 129 and name HG1) (segid " A" and resid 127 and name HB2) 3.862 1.864 1.864 weight 1.000 ! spec=NOESY_D2O, no=3293, id=225, vol=6.661601e+05 or (segid " A" and resid 129 and name HG2) (segid " A" and resid 127 and name HB2) assign (segid " A" and resid 58 and name HD2) (segid " A" and resid 58 and name HB1) 3.109 1.208 1.208 weight 1.000 ! spec=NOESY_H2O, no=84, id=289, vol=1.579474e+06 or (segid " A" and resid 58 and name HD2) (segid " A" and resid 58 and name HB2) assign (segid " A" and resid 28 and name HN) (segid " A" and resid 28 and name HA) 2.246 0.630 0.630 weight 1.000 ! spec=NOESY_H2O, no=314, id=398, vol=9.919600e+06 or (segid " A" and resid 28 and name HN) (segid " A" and resid 27 and name HA) assign (segid " A" and resid 48 and name HN) (segid " A" and resid 47 and name HG21) 2.472 0.764 0.764 weight 1.000 ! spec=NOESY_H2O, no=319, id=399, vol=2.313034e+06 or (segid " A" and resid 48 and name HN) (segid " A" and resid 47 and name HG22) or (segid " A" and resid 48 and name HN) (segid " A" and resid 47 and name HG23) or (segid " A" and resid 70 and name HN) (segid " A" and resid 70 and name HB2) assign (segid " A" and resid 69 and name HA) (segid " A" and resid 50 and name HB1) 2.985 1.114 1.114 weight 1.000 ! spec=NOESY_H2O, no=502, id=441, vol=1.552546e+06 or (segid " A" and resid 69 and name HA) (segid " A" and resid 50 and name HB2) assign (segid " A" and resid 130 and name HA) (segid " A" and resid 130 and name HB2) 1.925 0.463 0.463 weight 1.000 ! spec=13C_...spin, no=1, id=1342, vol=2.716421e+08 or (segid " A" and resid 130 and name HA) (segid " A" and resid 130 and name HB1) or (segid " A" and resid 130 and name HA) (segid " A" and resid 130 and name HB3) assign (segid " A" and resid 129 and name HA) (segid " A" and resid 129 and name HB2) 4.642 2.694 2.694 weight 1.000 ! spec=13C_...spin, no=15, id=1344, vol=2.423648e+06 assign (segid " A" and resid 128 and name HA) (segid " A" and resid 92 and name HE1) 4.671 2.727 2.727 weight 1.000 ! spec=13C_...spin, no=20, id=1346, vol=5.956339e+06 or (segid " A" and resid 128 and name HA) (segid " A" and resid 92 and name HE2) assign (segid " A" and resid 128 and name HA) (segid " A" and resid 128 and name HB1) 2.569 0.825 0.825 weight 1.000 ! spec=13C_...spin, no=21, id=1347, vol=7.062942e+07 assign (segid " A" and resid 128 and name HB2) (segid " A" and resid 128 and name HB1) 2.606 0.849 0.849 weight 1.000 ! spec=13C_...spin, no=26, id=1351, vol=2.481892e+07 assign (segid " A" and resid 128 and name HE1) (segid " A" and resid 89 and name HD1) 2.948 1.086 1.086 weight 1.000 ! spec=13C_...spin, no=32, id=1357, vol=1.005958e+07 or (segid " A" and resid 128 and name HE1) (segid " A" and resid 89 and name HD2) or (segid " A" and resid 128 and name HE2) (segid " A" and resid 89 and name HD1) or (segid " A" and resid 128 and name HE2) (segid " A" and resid 89 and name HD2) assign (segid " A" and resid 128 and name HE1) (segid " A" and resid 77 and name HA) 4.912 3.016 3.016 weight 1.000 ! spec=13C_...spin, no=33, id=1358, vol=5.236998e+06 or (segid " A" and resid 128 and name HE2) (segid " A" and resid 77 and name HA) assign (segid " A" and resid 128 and name HE1) (segid " A" and resid 80 and name HG) 4.610 2.656 2.656 weight 1.000 ! spec=13C_...spin, no=35, id=1360, vol=5.350409e+06 or (segid " A" and resid 128 and name HE2) (segid " A" and resid 80 and name HG) assign (segid " A" and resid 127 and name HB1) (segid " A" and resid 127 and name HB2) 2.254 0.635 0.635 weight 1.000 ! spec=13C_...spin, no=39, id=1362, vol=5.304295e+07 assign (segid " A" and resid 127 and name HA) (segid " A" and resid 127 and name HB2) 3.526 1.554 1.554 weight 1.000 ! spec=13C_...spin, no=41, id=1364, vol=2.634495e+07 assign (segid " A" and resid 126 and name HB2) (segid " A" and resid 126 and name HA) 2.737 0.936 0.936 weight 1.000 ! spec=13C_...spin, no=45, id=1368, vol=7.880372e+07 assign (segid " A" and resid 126 and name HB1) (segid " A" and resid 126 and name HD12) 3.605 1.625 1.625 weight 1.000 ! spec=13C_...spin, no=49, id=1370, vol=1.954420e+07 or (segid " A" and resid 126 and name HB1) (segid " A" and resid 126 and name HD11) or (segid " A" and resid 126 and name HB1) (segid " A" and resid 126 and name HD13) assign (segid " A" and resid 126 and name HA) (segid " A" and resid 126 and name HB1) 2.714 0.921 0.921 weight 1.000 ! spec=13C_...spin, no=50, id=1371, vol=4.540916e+07 assign (segid " A" and resid 126 and name HB1) (segid " A" and resid 127 and name HA) 5.010 3.137 3.137 weight 1.000 ! spec=13C_...spin, no=51, id=1372, vol=2.376704e+06 assign (segid " A" and resid 126 and name HB2) (segid " A" and resid 127 and name HA) 5.390 3.631 3.631 weight 1.000 ! spec=13C_...spin, no=53, id=1373, vol=2.696036e+06 assign (segid " A" and resid 126 and name HB2) (segid " A" and resid 126 and name HG) 3.918 1.919 1.919 weight 1.000 ! spec=13C_...spin, no=55, id=1375, vol=7.419090e+06 assign (segid " A" and resid 126 and name HB2) (segid " A" and resid 126 and name HB1) 2.256 0.636 0.636 weight 1.000 ! spec=13C_...spin, no=56, id=1376, vol=3.274978e+07 assign (segid " A" and resid 126 and name HA) (segid " A" and resid 126 and name HG) 2.516 0.791 0.791 weight 1.000 ! spec=13C_...spin, no=57, id=1377, vol=5.761063e+07 assign (segid " A" and resid 126 and name HG) (segid " A" and resid 103 and name HZ2) 3.089 1.193 1.193 weight 1.000 ! spec=13C_...spin, no=61, id=1378, vol=1.992599e+07 assign (segid " A" and resid 126 and name HD12) (segid " A" and resid 70 and name HA) 4.040 2.041 2.041 weight 1.000 ! spec=13C_...spin, no=74, id=1379, vol=6.651126e+06 or (segid " A" and resid 126 and name HD11) (segid " A" and resid 70 and name HA) or (segid " A" and resid 126 and name HD13) (segid " A" and resid 70 and name HA) assign (segid " A" and resid 126 and name HD12) (segid " A" and resid 103 and name HZ2) 4.649 2.701 2.701 weight 1.000 ! spec=13C_...spin, no=76, id=1380, vol=3.685933e+06 or (segid " A" and resid 126 and name HD11) (segid " A" and resid 103 and name HZ2) or (segid " A" and resid 126 and name HD13) (segid " A" and resid 103 and name HZ2) assign (segid " A" and resid 126 and name HD12) (segid " A" and resid 72 and name HA) 5.308 3.522 3.522 weight 1.000 ! spec=13C_...spin, no=79, id=1381, vol=2.217394e+06 or (segid " A" and resid 126 and name HD11) (segid " A" and resid 72 and name HA) or (segid " A" and resid 126 and name HD13) (segid " A" and resid 72 and name HA) assign (segid " A" and resid 126 and name HA) (segid " A" and resid 126 and name HD12) 4.626 2.676 2.676 weight 1.000 ! spec=13C_...spin, no=80, id=1382, vol=3.021535e+06 or (segid " A" and resid 126 and name HA) (segid " A" and resid 126 and name HD11) or (segid " A" and resid 126 and name HA) (segid " A" and resid 126 and name HD13) assign (segid " A" and resid 126 and name HD12) (segid " A" and resid 123 and name HD22) 3.615 1.634 1.634 weight 1.000 ! spec=13C_...spin, no=81, id=1383, vol=1.571476e+07 or (segid " A" and resid 126 and name HD12) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 126 and name HD12) (segid " A" and resid 123 and name HD23) or (segid " A" and resid 126 and name HD11) (segid " A" and resid 123 and name HD22) or (segid " A" and resid 126 and name HD11) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 126 and name HD11) (segid " A" and resid 123 and name HD23) or (segid " A" and resid 126 and name HD13) (segid " A" and resid 123 and name HD22) or (segid " A" and resid 126 and name HD13) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 126 and name HD13) (segid " A" and resid 123 and name HD23) assign (segid " A" and resid 126 and name HB2) (segid " A" and resid 126 and name HD12) 2.123 0.564 0.564 weight 1.000 ! spec=13C_...spin, no=82, id=1384, vol=1.095615e+08 or (segid " A" and resid 126 and name HB2) (segid " A" and resid 126 and name HD11) or (segid " A" and resid 126 and name HB2) (segid " A" and resid 126 and name HD13) assign (segid " A" and resid 126 and name HD12) (segid " A" and resid 123 and name HB1) 2.155 0.580 0.580 weight 1.000 ! spec=13C_...spin, no=84, id=1385, vol=8.069127e+07 or (segid " A" and resid 126 and name HD11) (segid " A" and resid 123 and name HB1) or (segid " A" and resid 126 and name HD13) (segid " A" and resid 123 and name HB1) assign (segid " A" and resid 126 and name HD12) (segid " A" and resid 126 and name HD22) 2.668 0.890 0.890 weight 1.000 ! spec=13C_...spin, no=85, id=1386, vol=4.544642e+07 or (segid " A" and resid 126 and name HD12) (segid " A" and resid 126 and name HD21) or (segid " A" and resid 126 and name HD12) (segid " A" and resid 126 and name HD23) or (segid " A" and resid 126 and name HD11) (segid " A" and resid 126 and name HD22) or (segid " A" and resid 126 and name HD11) (segid " A" and resid 126 and name HD21) or (segid " A" and resid 126 and name HD11) (segid " A" and resid 126 and name HD23) or (segid " A" and resid 126 and name HD13) (segid " A" and resid 126 and name HD22) or (segid " A" and resid 126 and name HD13) (segid " A" and resid 126 and name HD21) or (segid " A" and resid 126 and name HD13) (segid " A" and resid 126 and name HD23) assign (segid " A" and resid 125 and name HA1) (segid " A" and resid 73 and name HB2) 6.386 5.098 5.098 weight 1.000 ! spec=13C_...spin, no=95, id=1387, vol=6.337710e+06 assign (segid " A" and resid 125 and name HA1) (segid " A" and resid 72 and name HA) 5.305 3.518 3.518 weight 1.000 ! spec=13C_...spin, no=96, id=1388, vol=7.274500e+06 assign (segid " A" and resid 125 and name HA2) (segid " A" and resid 73 and name HB2) 4.105 2.106 2.106 weight 1.000 ! spec=13C_...spin, no=97, id=1389, vol=2.962554e+07 assign (segid " A" and resid 125 and name HA2) (segid " A" and resid 73 and name HB1) 5.667 4.014 4.014 weight 1.000 ! spec=13C_...spin, no=98, id=1390, vol=4.001151e+06 assign (segid " A" and resid 125 and name HA2) (segid " A" and resid 125 and name HA1) 2.107 0.555 0.555 weight 1.000 ! spec=13C_...spin, no=102, id=1392, vol=9.034598e+07 assign (segid " A" and resid 125 and name HA2) (segid " A" and resid 72 and name HA) 5.077 3.222 3.222 weight 1.000 ! spec=13C_...spin, no=103, id=1393, vol=2.706298e+06 assign (segid " A" and resid 124 and name HA2) (segid " A" and resid 124 and name HA1) 1.594 0.317 0.317 weight 1.000 ! spec=13C_...spin, no=104, id=1394, vol=3.983414e+08 assign (segid " A" and resid 124 and name HA1) (segid " A" and resid 71 and name HB) 6.765 5.720 5.720 weight 1.000 ! spec=13C_...spin, no=108, id=1396, vol=2.477985e+06 assign (segid " A" and resid 123 and name HA) (segid " A" and resid 121 and name HG22) 4.372 2.389 2.389 weight 1.000 ! spec=13C_...spin, no=110, id=1397, vol=4.426006e+06 or (segid " A" and resid 123 and name HA) (segid " A" and resid 121 and name HG21) or (segid " A" and resid 123 and name HA) (segid " A" and resid 121 and name HG23) assign (segid " A" and resid 123 and name HA) (segid " A" and resid 123 and name HB1) 2.913 1.061 1.061 weight 1.000 ! spec=13C_...spin, no=111, id=1398, vol=1.994466e+07 assign (segid " A" and resid 123 and name HA) (segid " A" and resid 123 and name HG) 3.321 1.379 1.379 weight 1.000 ! spec=13C_...spin, no=112, id=1399, vol=1.654983e+07 assign (segid " A" and resid 123 and name HA) (segid " A" and resid 123 and name HD22) 2.703 0.913 0.913 weight 1.000 ! spec=13C_...spin, no=113, id=1400, vol=3.063465e+07 or (segid " A" and resid 123 and name HA) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 123 and name HA) (segid " A" and resid 123 and name HD23) assign (segid " A" and resid 123 and name HB2) (segid " A" and resid 123 and name HB1) 1.939 0.470 0.470 weight 1.000 ! spec=13C_...spin, no=117, id=1402, vol=8.932083e+07 assign (segid " A" and resid 123 and name HB2) (segid " A" and resid 70 and name HD22) 2.401 0.721 0.721 weight 1.000 ! spec=13C_...spin, no=120, id=1405, vol=3.863422e+07 or (segid " A" and resid 123 and name HB2) (segid " A" and resid 70 and name HD21) or (segid " A" and resid 123 and name HB2) (segid " A" and resid 70 and name HD23) assign (segid " A" and resid 123 and name HG) (segid " A" and resid 123 and name HB2) 1.793 0.402 4.207 weight 1.000 ! spec=13C_...spin, no=128, id=1409, vol=2.479801e+08 assign (segid " A" and resid 123 and name HD12) (segid " A" and resid 123 and name HD22) 1.984 0.492 0.492 weight 1.000 ! spec=13C_...spin, no=134, id=1413, vol=6.312314e+07 or (segid " A" and resid 123 and name HD12) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 123 and name HD12) (segid " A" and resid 123 and name HD23) or (segid " A" and resid 123 and name HD11) (segid " A" and resid 123 and name HD22) or (segid " A" and resid 123 and name HD11) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 123 and name HD11) (segid " A" and resid 123 and name HD23) or (segid " A" and resid 123 and name HD13) (segid " A" and resid 123 and name HD22) or (segid " A" and resid 123 and name HD13) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 123 and name HD13) (segid " A" and resid 123 and name HD23) assign (segid " A" and resid 123 and name HD12) (segid " A" and resid 123 and name HB1) 2.188 0.598 0.598 weight 1.000 ! spec=13C_...spin, no=135, id=1414, vol=1.144828e+08 or (segid " A" and resid 123 and name HD11) (segid " A" and resid 123 and name HB1) or (segid " A" and resid 123 and name HD13) (segid " A" and resid 123 and name HB1) assign (segid " A" and resid 123 and name HG) (segid " A" and resid 123 and name HD12) 1.978 0.489 0.489 weight 1.000 ! spec=13C_...spin, no=136, id=1415, vol=7.610535e+07 or (segid " A" and resid 123 and name HG) (segid " A" and resid 123 and name HD11) or (segid " A" and resid 123 and name HG) (segid " A" and resid 123 and name HD13) assign (segid " A" and resid 123 and name HB2) (segid " A" and resid 123 and name HD12) 2.154 0.580 0.580 weight 1.000 ! spec=13C_...spin, no=137, id=1416, vol=1.210639e+08 or (segid " A" and resid 123 and name HB2) (segid " A" and resid 123 and name HD11) or (segid " A" and resid 123 and name HB2) (segid " A" and resid 123 and name HD13) assign (segid " A" and resid 123 and name HD12) (segid " A" and resid 121 and name HG22) 2.180 0.594 3.820 weight 1.000 ! spec=13C_...spin, no=138, id=1417, vol=5.616691e+07 or (segid " A" and resid 123 and name HD12) (segid " A" and resid 121 and name HG21) or (segid " A" and resid 123 and name HD12) (segid " A" and resid 121 and name HG23) or (segid " A" and resid 123 and name HD11) (segid " A" and resid 121 and name HG22) or (segid " A" and resid 123 and name HD11) (segid " A" and resid 121 and name HG21) or (segid " A" and resid 123 and name HD11) (segid " A" and resid 121 and name HG23) or (segid " A" and resid 123 and name HD13) (segid " A" and resid 121 and name HG22) or (segid " A" and resid 123 and name HD13) (segid " A" and resid 121 and name HG21) or (segid " A" and resid 123 and name HD13) (segid " A" and resid 121 and name HG23) assign (segid " A" and resid 123 and name HD12) (segid " A" and resid 103 and name HB2) 3.968 1.968 1.968 weight 1.000 ! spec=13C_...spin, no=140, id=1418, vol=8.398480e+06 or (segid " A" and resid 123 and name HD11) (segid " A" and resid 103 and name HB2) or (segid " A" and resid 123 and name HD13) (segid " A" and resid 103 and name HB2) assign (segid " A" and resid 123 and name HD12) (segid " A" and resid 70 and name HA) 4.518 2.552 2.552 weight 1.000 ! spec=13C_...spin, no=141, id=1419, vol=3.842382e+06 or (segid " A" and resid 123 and name HD11) (segid " A" and resid 70 and name HA) or (segid " A" and resid 123 and name HD13) (segid " A" and resid 70 and name HA) assign (segid " A" and resid 123 and name HD12) (segid " A" and resid 103 and name HZ2) 3.547 1.573 1.573 weight 1.000 ! spec=13C_...spin, no=142, id=1420, vol=7.684864e+06 or (segid " A" and resid 123 and name HD11) (segid " A" and resid 103 and name HZ2) or (segid " A" and resid 123 and name HD13) (segid " A" and resid 103 and name HZ2) assign (segid " A" and resid 123 and name HD22) (segid " A" and resid 103 and name HD1) 3.985 1.985 1.985 weight 1.000 ! spec=13C_...spin, no=145, id=1421, vol=5.033725e+06 or (segid " A" and resid 123 and name HD21) (segid " A" and resid 103 and name HD1) or (segid " A" and resid 123 and name HD23) (segid " A" and resid 103 and name HD1) assign (segid " A" and resid 123 and name HD22) (segid " A" and resid 107 and name HG1) 2.565 0.823 0.823 weight 1.000 ! spec=13C_...spin, no=148, id=1423, vol=2.606656e+07 or (segid " A" and resid 123 and name HD21) (segid " A" and resid 107 and name HG1) or (segid " A" and resid 123 and name HD23) (segid " A" and resid 107 and name HG1) assign (segid " A" and resid 123 and name HB2) (segid " A" and resid 123 and name HD22) 3.402 1.447 1.447 weight 1.000 ! spec=13C_...spin, no=151, id=1424, vol=2.549872e+07 or (segid " A" and resid 123 and name HB2) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 123 and name HB2) (segid " A" and resid 123 and name HD23) assign (segid " A" and resid 123 and name HB1) (segid " A" and resid 123 and name HD22) 2.324 0.675 0.675 weight 1.000 ! spec=13C_...spin, no=152, id=1425, vol=6.816460e+07 or (segid " A" and resid 123 and name HB1) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 123 and name HB1) (segid " A" and resid 123 and name HD23) assign (segid " A" and resid 123 and name HG) (segid " A" and resid 123 and name HD22) 1.393 0.243 4.607 weight 1.000 ! spec=13C_...spin, no=153, id=1426, vol=6.083654e+08 or (segid " A" and resid 123 and name HG) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 123 and name HG) (segid " A" and resid 123 and name HD23) assign (segid " A" and resid 123 and name HD22) (segid " A" and resid 121 and name HG22) 1.706 0.364 0.364 weight 1.000 ! spec=13C_...spin, no=154, id=1427, vol=8.214147e+07 or (segid " A" and resid 123 and name HD22) (segid " A" and resid 121 and name HG21) or (segid " A" and resid 123 and name HD22) (segid " A" and resid 121 and name HG23) or (segid " A" and resid 123 and name HD21) (segid " A" and resid 121 and name HG22) or (segid " A" and resid 123 and name HD21) (segid " A" and resid 121 and name HG21) or (segid " A" and resid 123 and name HD21) (segid " A" and resid 121 and name HG23) or (segid " A" and resid 123 and name HD23) (segid " A" and resid 121 and name HG22) or (segid " A" and resid 123 and name HD23) (segid " A" and resid 121 and name HG21) or (segid " A" and resid 123 and name HD23) (segid " A" and resid 121 and name HG23) assign (segid " A" and resid 122 and name HB2) (segid " A" and resid 122 and name HB1) 1.650 0.340 0.340 weight 1.000 ! spec=13C_...spin, no=161, id=1431, vol=3.097917e+08 assign (segid " A" and resid 122 and name HB2) (segid " A" and resid 122 and name HA) 3.430 1.470 1.470 weight 1.000 ! spec=13C_...spin, no=162, id=1432, vol=2.251687e+07 assign (segid " A" and resid 122 and name HB2) (segid " A" and resid 122 and name HD12) 2.916 1.063 1.063 weight 1.000 ! spec=13C_...spin, no=165, id=1435, vol=3.590786e+07 or (segid " A" and resid 122 and name HB2) (segid " A" and resid 122 and name HD11) or (segid " A" and resid 122 and name HB2) (segid " A" and resid 122 and name HD13) assign (segid " A" and resid 122 and name HG) (segid " A" and resid 120 and name HD22) 2.573 0.827 0.827 weight 1.000 ! spec=13C_...spin, no=166, id=1436, vol=5.546967e+07 or (segid " A" and resid 122 and name HG) (segid " A" and resid 120 and name HD21) or (segid " A" and resid 122 and name HG) (segid " A" and resid 120 and name HD23) assign (segid " A" and resid 122 and name HB2) (segid " A" and resid 122 and name HG) 2.292 0.657 0.657 weight 1.000 ! spec=13C_...spin, no=167, id=1437, vol=6.605232e+07 assign (segid " A" and resid 122 and name HG) (segid " A" and resid 122 and name HA) 3.401 1.446 1.446 weight 1.000 ! spec=13C_...spin, no=168, id=1438, vol=1.158562e+07 assign (segid " A" and resid 122 and name HD22) (segid " A" and resid 122 and name HG) 1.607 0.323 4.393 weight 1.000 ! spec=13C_...spin, no=171, id=1439, vol=3.519547e+08 or (segid " A" and resid 122 and name HD21) (segid " A" and resid 122 and name HG) or (segid " A" and resid 122 and name HD23) (segid " A" and resid 122 and name HG) assign (segid " A" and resid 121 and name HA) (segid " A" and resid 121 and name HG12) 3.098 1.200 1.200 weight 1.000 ! spec=13C_...spin, no=175, id=1441, vol=3.740455e+07 or (segid " A" and resid 121 and name HA) (segid " A" and resid 121 and name HG11) or (segid " A" and resid 121 and name HA) (segid " A" and resid 121 and name HG13) assign (segid " A" and resid 121 and name HA) (segid " A" and resid 121 and name HG22) 2.850 1.015 1.015 weight 1.000 ! spec=13C_...spin, no=176, id=1442, vol=2.814596e+07 or (segid " A" and resid 121 and name HA) (segid " A" and resid 121 and name HG21) or (segid " A" and resid 121 and name HA) (segid " A" and resid 121 and name HG23) assign (segid " A" and resid 121 and name HB) (segid " A" and resid 121 and name HG12) 1.880 0.442 0.442 weight 1.000 ! spec=13C_...spin, no=179, id=1443, vol=1.567039e+08 or (segid " A" and resid 121 and name HB) (segid " A" and resid 121 and name HG11) or (segid " A" and resid 121 and name HB) (segid " A" and resid 121 and name HG13) assign (segid " A" and resid 121 and name HB) (segid " A" and resid 121 and name HG22) 1.796 0.403 0.403 weight 1.000 ! spec=13C_...spin, no=180, id=1444, vol=2.117136e+08 or (segid " A" and resid 121 and name HB) (segid " A" and resid 121 and name HG21) or (segid " A" and resid 121 and name HB) (segid " A" and resid 121 and name HG23) assign (segid " A" and resid 121 and name HB) (segid " A" and resid 121 and name HA) 3.983 1.983 1.983 weight 1.000 ! spec=13C_...spin, no=181, id=1445, vol=3.284965e+06 assign (segid " A" and resid 121 and name HG12) (segid " A" and resid 118 and name HB1) 4.558 2.596 2.596 weight 1.000 ! spec=13C_...spin, no=184, id=1447, vol=8.079065e+06 or (segid " A" and resid 121 and name HG11) (segid " A" and resid 118 and name HB1) or (segid " A" and resid 121 and name HG13) (segid " A" and resid 118 and name HB1) assign (segid " A" and resid 120 and name HA) (segid " A" and resid 120 and name HB2) 3.076 1.183 1.183 weight 1.000 ! spec=13C_...spin, no=189, id=1449, vol=1.590914e+07 assign (segid " A" and resid 120 and name HA) (segid " A" and resid 120 and name HB1) 3.411 1.454 1.454 weight 1.000 ! spec=13C_...spin, no=190, id=1450, vol=2.410340e+07 assign (segid " A" and resid 120 and name HA) (segid " A" and resid 120 and name HG) 3.254 1.323 1.323 weight 1.000 ! spec=13C_...spin, no=191, id=1451, vol=1.588750e+07 assign (segid " A" and resid 120 and name HB1) (segid " A" and resid 120 and name HB2) 1.435 0.258 0.258 weight 1.000 ! spec=13C_...spin, no=193, id=1453, vol=7.259717e+08 assign (segid " A" and resid 120 and name HG) (segid " A" and resid 120 and name HB2) 2.371 0.703 0.703 weight 1.000 ! spec=13C_...spin, no=205, id=1458, vol=1.496885e+08 assign (segid " A" and resid 120 and name HA) (segid " A" and resid 120 and name HD12) 2.631 0.865 0.865 weight 1.000 ! spec=13C_...spin, no=208, id=1460, vol=3.633512e+07 or (segid " A" and resid 120 and name HA) (segid " A" and resid 120 and name HD11) or (segid " A" and resid 120 and name HA) (segid " A" and resid 120 and name HD13) assign (segid " A" and resid 120 and name HG) (segid " A" and resid 120 and name HD12) 1.492 0.278 4.508 weight 1.000 ! spec=13C_...spin, no=210, id=1461, vol=4.342483e+08 or (segid " A" and resid 120 and name HG) (segid " A" and resid 120 and name HD11) or (segid " A" and resid 120 and name HG) (segid " A" and resid 120 and name HD13) assign (segid " A" and resid 120 and name HD22) (segid " A" and resid 120 and name HA) 3.596 1.617 1.617 weight 1.000 ! spec=13C_...spin, no=212, id=1462, vol=2.946112e+07 or (segid " A" and resid 120 and name HD21) (segid " A" and resid 120 and name HA) or (segid " A" and resid 120 and name HD23) (segid " A" and resid 120 and name HA) assign (segid " A" and resid 119 and name HB2) (segid " A" and resid 119 and name HA) 2.555 0.816 0.816 weight 1.000 ! spec=13C_...spin, no=216, id=1464, vol=4.592069e+07 or (segid " A" and resid 119 and name HB1) (segid " A" and resid 119 and name HA) or (segid " A" and resid 119 and name HB3) (segid " A" and resid 119 and name HA) assign (segid " A" and resid 119 and name HA) (segid " A" and resid 64 and name HB2) 4.795 2.874 2.874 weight 1.000 ! spec=13C_...spin, no=217, id=1465, vol=9.175187e+06 assign (segid " A" and resid 119 and name HB2) (segid " A" and resid 64 and name HB2) 7.120 6.337 6.337 weight 1.000 ! spec=13C_...spin, no=219, id=1466, vol=1.012728e+06 or (segid " A" and resid 119 and name HB1) (segid " A" and resid 64 and name HB2) or (segid " A" and resid 119 and name HB3) (segid " A" and resid 64 and name HB2) assign (segid " A" and resid 119 and name HB2) (segid " A" and resid 64 and name HE1) 4.061 2.061 2.061 weight 1.000 ! spec=13C_...spin, no=220, id=1467, vol=8.624223e+06 or (segid " A" and resid 119 and name HB1) (segid " A" and resid 64 and name HE1) or (segid " A" and resid 119 and name HB3) (segid " A" and resid 64 and name HE1) assign (segid " A" and resid 118 and name HA) (segid " A" and resid 118 and name HB2) 3.213 1.290 1.290 weight 1.000 ! spec=13C_...spin, no=223, id=1469, vol=4.382004e+07 assign (segid " A" and resid 118 and name HB1) (segid " A" and resid 118 and name HB2) 2.251 0.633 0.633 weight 1.000 ! spec=13C_...spin, no=227, id=1470, vol=5.627085e+07 assign (segid " A" and resid 118 and name HB2) (segid " A" and resid 121 and name HG12) 4.079 2.080 2.080 weight 1.000 ! spec=13C_...spin, no=229, id=1472, vol=9.877320e+06 or (segid " A" and resid 118 and name HB2) (segid " A" and resid 121 and name HG11) or (segid " A" and resid 118 and name HB2) (segid " A" and resid 121 and name HG13) assign (segid " A" and resid 118 and name HA) (segid " A" and resid 118 and name HB1) 2.887 1.042 1.042 weight 1.000 ! spec=13C_...spin, no=233, id=1474, vol=3.768282e+07 assign (segid " A" and resid 117 and name HA) (segid " A" and resid 117 and name HB2) 2.255 0.636 0.636 weight 1.000 ! spec=13C_...spin, no=235, id=1476, vol=1.065266e+08 or (segid " A" and resid 117 and name HA) (segid " A" and resid 117 and name HB1) or (segid " A" and resid 117 and name HA) (segid " A" and resid 117 and name HB3) assign (segid " A" and resid 117 and name HA) (segid " A" and resid 116 and name HB1) 5.593 3.910 3.910 weight 1.000 ! spec=13C_...spin, no=236, id=1477, vol=5.344552e+06 assign (segid " A" and resid 115 and name HB) (segid " A" and resid 115 and name HG21) 2.346 0.688 0.688 weight 1.000 ! spec=13C_...spin, no=255, id=1482, vol=4.641344e+07 or (segid " A" and resid 115 and name HB) (segid " A" and resid 115 and name HG22) or (segid " A" and resid 115 and name HB) (segid " A" and resid 115 and name HG23) assign (segid " A" and resid 115 and name HB) (segid " A" and resid 65 and name HA) 4.534 2.570 2.570 weight 1.000 ! spec=13C_...spin, no=256, id=1483, vol=4.636348e+06 assign (segid " A" and resid 115 and name HG21) (segid " A" and resid 65 and name HA) 3.322 1.380 1.380 weight 1.000 ! spec=13C_...spin, no=261, id=1485, vol=1.460497e+07 or (segid " A" and resid 115 and name HG22) (segid " A" and resid 65 and name HA) or (segid " A" and resid 115 and name HG23) (segid " A" and resid 65 and name HA) assign (segid " A" and resid 114 and name HB2) (segid " A" and resid 114 and name HB1) 2.378 0.707 0.707 weight 1.000 ! spec=13C_...spin, no=269, id=1487, vol=2.648876e+07 assign (segid " A" and resid 113 and name HA) (segid " A" and resid 113 and name HB2) 2.743 0.941 0.941 weight 1.000 ! spec=13C_...spin, no=292, id=1490, vol=5.570584e+07 assign (segid " A" and resid 113 and name HA) (segid " A" and resid 113 and name HB1) 3.012 1.134 1.134 weight 1.000 ! spec=13C_...spin, no=293, id=1491, vol=3.579928e+07 assign (segid " A" and resid 113 and name HB1) (segid " A" and resid 113 and name HB2) 1.960 0.480 0.480 weight 1.000 ! spec=13C_...spin, no=298, id=1493, vol=1.018483e+08 assign (segid " A" and resid 111 and name HA) (segid " A" and resid 111 and name HB1) 2.993 1.120 1.120 weight 1.000 ! spec=13C_...spin, no=303, id=1496, vol=3.009699e+07 assign (segid " A" and resid 111 and name HB2) (segid " A" and resid 29 and name HD22) 3.870 1.872 1.872 weight 1.000 ! spec=13C_...spin, no=308, id=1498, vol=1.725359e+07 or (segid " A" and resid 111 and name HB2) (segid " A" and resid 29 and name HD21) or (segid " A" and resid 111 and name HB2) (segid " A" and resid 29 and name HD23) assign (segid " A" and resid 111 and name HB2) (segid " A" and resid 111 and name HA) 2.815 0.991 0.991 weight 1.000 ! spec=13C_...spin, no=310, id=1500, vol=9.392654e+07 assign (segid " A" and resid 111 and name HZ) (segid " A" and resid 68 and name HD22) 2.355 0.693 0.693 weight 1.000 ! spec=13C_...spin, no=329, id=1512, vol=8.081188e+07 or (segid " A" and resid 111 and name HZ) (segid " A" and resid 68 and name HD21) or (segid " A" and resid 111 and name HZ) (segid " A" and resid 68 and name HD23) assign (segid " A" and resid 110 and name HA) (segid " A" and resid 104 and name HG2) 4.132 2.134 2.134 weight 1.000 ! spec=13C_...spin, no=333, id=1513, vol=6.021568e+06 assign (segid " A" and resid 110 and name HA) (segid " A" and resid 110 and name HB1) 4.127 2.129 2.129 weight 1.000 ! spec=13C_...spin, no=334, id=1514, vol=8.272976e+06 assign (segid " A" and resid 110 and name HA) (segid " A" and resid 110 and name HB2) 2.904 1.054 1.054 weight 1.000 ! spec=13C_...spin, no=335, id=1515, vol=3.323625e+07 assign (segid " A" and resid 110 and name HA) (segid " A" and resid 104 and name HG1) 5.665 4.011 4.011 weight 1.000 ! spec=13C_...spin, no=336, id=1516, vol=3.812040e+06 assign (segid " A" and resid 110 and name HB2) (segid " A" and resid 110 and name HB1) 2.283 0.652 0.652 weight 1.000 ! spec=13C_...spin, no=338, id=1518, vol=5.474830e+07 assign (segid " A" and resid 109 and name HA) (segid " A" and resid 116 and name HA) 3.465 1.501 1.501 weight 1.000 ! spec=13C_...spin, no=346, id=1521, vol=1.613915e+07 assign (segid " A" and resid 109 and name HA) (segid " A" and resid 109 and name HG12) 2.757 0.950 0.950 weight 1.000 ! spec=13C_...spin, no=349, id=1522, vol=2.811296e+07 or (segid " A" and resid 109 and name HA) (segid " A" and resid 109 and name HG11) or (segid " A" and resid 109 and name HA) (segid " A" and resid 109 and name HG13) assign (segid " A" and resid 109 and name HB) (segid " A" and resid 104 and name HG1) 5.433 3.690 3.690 weight 1.000 ! spec=13C_...spin, no=352, id=1525, vol=3.772533e+06 assign (segid " A" and resid 109 and name HB) (segid " A" and resid 109 and name HG22) 2.464 0.759 0.759 weight 1.000 ! spec=13C_...spin, no=358, id=1528, vol=3.271392e+07 or (segid " A" and resid 109 and name HB) (segid " A" and resid 109 and name HG21) or (segid " A" and resid 109 and name HB) (segid " A" and resid 109 and name HG23) assign (segid " A" and resid 109 and name HG22) (segid " A" and resid 116 and name HB1) 2.953 1.090 1.090 weight 1.000 ! spec=13C_...spin, no=359, id=1529, vol=2.756604e+07 or (segid " A" and resid 109 and name HG21) (segid " A" and resid 116 and name HB1) or (segid " A" and resid 109 and name HG23) (segid " A" and resid 116 and name HB1) assign (segid " A" and resid 109 and name HA) (segid " A" and resid 109 and name HG22) 2.639 0.871 0.871 weight 1.000 ! spec=13C_...spin, no=360, id=1530, vol=3.250219e+07 or (segid " A" and resid 109 and name HA) (segid " A" and resid 109 and name HG21) or (segid " A" and resid 109 and name HA) (segid " A" and resid 109 and name HG23) assign (segid " A" and resid 109 and name HG12) (segid " A" and resid 116 and name HA) 4.944 3.056 3.056 weight 1.000 ! spec=13C_...spin, no=363, id=1532, vol=3.327744e+06 or (segid " A" and resid 109 and name HG11) (segid " A" and resid 116 and name HA) or (segid " A" and resid 109 and name HG13) (segid " A" and resid 116 and name HA) assign (segid " A" and resid 109 and name HG12) (segid " A" and resid 116 and name HB1) 3.376 1.425 1.425 weight 1.000 ! spec=13C_...spin, no=365, id=1533, vol=6.905024e+06 or (segid " A" and resid 109 and name HG11) (segid " A" and resid 116 and name HB1) or (segid " A" and resid 109 and name HG13) (segid " A" and resid 116 and name HB1) assign (segid " A" and resid 109 and name HB) (segid " A" and resid 109 and name HG12) 2.064 0.533 0.533 weight 1.000 ! spec=13C_...spin, no=366, id=1534, vol=8.921716e+07 or (segid " A" and resid 109 and name HB) (segid " A" and resid 109 and name HG11) or (segid " A" and resid 109 and name HB) (segid " A" and resid 109 and name HG13) assign (segid " A" and resid 109 and name HG12) (segid " A" and resid 109 and name HG22) 1.890 0.446 0.446 weight 1.000 ! spec=13C_...spin, no=368, id=1535, vol=9.583789e+07 or (segid " A" and resid 109 and name HG12) (segid " A" and resid 109 and name HG21) or (segid " A" and resid 109 and name HG12) (segid " A" and resid 109 and name HG23) or (segid " A" and resid 109 and name HG11) (segid " A" and resid 109 and name HG22) or (segid " A" and resid 109 and name HG11) (segid " A" and resid 109 and name HG21) or (segid " A" and resid 109 and name HG11) (segid " A" and resid 109 and name HG23) or (segid " A" and resid 109 and name HG13) (segid " A" and resid 109 and name HG22) or (segid " A" and resid 109 and name HG13) (segid " A" and resid 109 and name HG21) or (segid " A" and resid 109 and name HG13) (segid " A" and resid 109 and name HG23) assign (segid " A" and resid 109 and name HG22) (segid " A" and resid 116 and name HA) 4.880 2.977 2.977 weight 1.000 ! spec=13C_...spin, no=369, id=1536, vol=4.366620e+06 or (segid " A" and resid 109 and name HG21) (segid " A" and resid 116 and name HA) or (segid " A" and resid 109 and name HG23) (segid " A" and resid 116 and name HA) assign (segid " A" and resid 108 and name HA2) (segid " A" and resid 108 and name HA1) 2.064 0.532 0.532 weight 1.000 ! spec=13C_...spin, no=370, id=1537, vol=1.280299e+08 assign (segid " A" and resid 108 and name HA2) (segid " A" and resid 117 and name HB2) 4.370 2.387 2.387 weight 1.000 ! spec=13C_...spin, no=372, id=1539, vol=5.899498e+06 or (segid " A" and resid 108 and name HA2) (segid " A" and resid 117 and name HB1) or (segid " A" and resid 108 and name HA2) (segid " A" and resid 117 and name HB3) assign (segid " A" and resid 108 and name HA1) (segid " A" and resid 117 and name HB2) 3.733 1.742 1.742 weight 1.000 ! spec=13C_...spin, no=373, id=1540, vol=4.658314e+06 or (segid " A" and resid 108 and name HA1) (segid " A" and resid 117 and name HB1) or (segid " A" and resid 108 and name HA1) (segid " A" and resid 117 and name HB3) assign (segid " A" and resid 107 and name HA) (segid " A" and resid 107 and name HD1) 4.357 2.372 2.372 weight 1.000 ! spec=13C_...spin, no=374, id=1541, vol=2.605133e+07 assign (segid " A" and resid 107 and name HA) (segid " A" and resid 107 and name HD2) 2.652 0.879 0.879 weight 1.000 ! spec=13C_...spin, no=375, id=1542, vol=3.171204e+07 assign (segid " A" and resid 107 and name HA) (segid " A" and resid 107 and name HB2) 2.574 0.828 0.828 weight 1.000 ! spec=13C_...spin, no=376, id=1543, vol=1.306830e+08 assign (segid " A" and resid 107 and name HA) (segid " A" and resid 107 and name HB1) 3.006 1.130 1.130 weight 1.000 ! spec=13C_...spin, no=377, id=1544, vol=1.800294e+07 assign (segid " A" and resid 107 and name HD2) (segid " A" and resid 107 and name HD1) 1.452 0.263 0.263 weight 1.000 ! spec=13C_...spin, no=383, id=1548, vol=4.957135e+08 assign (segid " A" and resid 107 and name HD2) (segid " A" and resid 107 and name HB2) 5.876 4.316 4.316 weight 1.000 ! spec=13C_...spin, no=385, id=1550, vol=2.075842e+06 assign (segid " A" and resid 107 and name HD1) (segid " A" and resid 107 and name HB2) 5.803 4.209 4.209 weight 1.000 ! spec=13C_...spin, no=386, id=1551, vol=4.166504e+06 assign (segid " A" and resid 107 and name HD2) (segid " A" and resid 121 and name HG22) 5.141 3.304 3.304 weight 1.000 ! spec=13C_...spin, no=391, id=1553, vol=4.411004e+06 or (segid " A" and resid 107 and name HD2) (segid " A" and resid 121 and name HG21) or (segid " A" and resid 107 and name HD2) (segid " A" and resid 121 and name HG23) assign (segid " A" and resid 107 and name HD1) (segid " A" and resid 107 and name HB1) 5.348 3.576 3.576 weight 1.000 ! spec=13C_...spin, no=394, id=1555, vol=3.366874e+06 assign (segid " A" and resid 107 and name HD2) (segid " A" and resid 107 and name HB1) 3.434 1.474 1.474 weight 1.000 ! spec=13C_...spin, no=397, id=1558, vol=1.955732e+07 assign (segid " A" and resid 123 and name HD22) (segid " A" and resid 107 and name HD1) 3.608 1.627 1.627 weight 1.000 ! spec=13C_...spin, no=398, id=1559, vol=4.485804e+06 or (segid " A" and resid 123 and name HD21) (segid " A" and resid 107 and name HD1) or (segid " A" and resid 123 and name HD23) (segid " A" and resid 107 and name HD1) assign (segid " A" and resid 106 and name HA) (segid " A" and resid 106 and name HB2) 2.578 0.831 0.831 weight 1.000 ! spec=13C_...spin, no=402, id=1561, vol=4.910759e+07 or (segid " A" and resid 106 and name HA) (segid " A" and resid 106 and name HB1) or (segid " A" and resid 106 and name HA) (segid " A" and resid 106 and name HB3) assign (segid " A" and resid 53 and name HB2) (segid " A" and resid 53 and name HA) 2.541 0.807 0.807 weight 1.000 ! spec=13C_...spin, no=404, id=1562, vol=2.704143e+07 or (segid " A" and resid 53 and name HB1) (segid " A" and resid 53 and name HA) or (segid " A" and resid 53 and name HB3) (segid " A" and resid 53 and name HA) assign (segid " A" and resid 106 and name HB2) (segid " A" and resid 103 and name HD1) 3.982 1.982 1.982 weight 1.000 ! spec=13C_...spin, no=405, id=1563, vol=7.725800e+06 or (segid " A" and resid 106 and name HB1) (segid " A" and resid 103 and name HD1) or (segid " A" and resid 106 and name HB3) (segid " A" and resid 103 and name HD1) assign (segid " A" and resid 104 and name HA) (segid " A" and resid 104 and name HB1) 2.329 0.678 0.678 weight 1.000 ! spec=13C_...spin, no=414, id=1568, vol=1.085760e+08 assign (segid " A" and resid 109 and name HB) (segid " A" and resid 104 and name HA) 2.958 1.094 1.094 weight 1.000 ! spec=13C_...spin, no=415, id=1569, vol=2.448431e+07 assign (segid " A" and resid 104 and name HA) (segid " A" and resid 109 and name HG22) 5.548 3.847 3.847 weight 1.000 ! spec=13C_...spin, no=416, id=1570, vol=2.575946e+06 or (segid " A" and resid 104 and name HA) (segid " A" and resid 109 and name HG21) or (segid " A" and resid 104 and name HA) (segid " A" and resid 109 and name HG23) assign (segid " A" and resid 104 and name HA) (segid " A" and resid 104 and name HG2) 4.506 2.538 2.538 weight 1.000 ! spec=13C_...spin, no=417, id=1571, vol=1.945938e+06 assign (segid " A" and resid 104 and name HA) (segid " A" and resid 109 and name HG12) 4.736 2.803 2.803 weight 1.000 ! spec=13C_...spin, no=418, id=1572, vol=4.819274e+06 or (segid " A" and resid 104 and name HA) (segid " A" and resid 109 and name HG11) or (segid " A" and resid 104 and name HA) (segid " A" and resid 109 and name HG13) assign (segid " A" and resid 104 and name HB2) (segid " A" and resid 104 and name HB1) 1.520 0.289 0.289 weight 1.000 ! spec=13C_...spin, no=420, id=1574, vol=5.175199e+08 assign (segid " A" and resid 104 and name HB2) (segid " A" and resid 101 and name HA) 3.099 1.200 1.200 weight 1.000 ! spec=13C_...spin, no=423, id=1576, vol=2.026416e+07 assign (segid " A" and resid 104 and name HG1) (segid " A" and resid 104 and name HG2) 2.261 0.639 0.639 weight 1.000 ! spec=13C_...spin, no=427, id=1579, vol=4.661164e+07 assign (segid " A" and resid 104 and name HG1) (segid " A" and resid 104 and name HA) 4.780 2.857 2.857 weight 1.000 ! spec=13C_...spin, no=428, id=1580, vol=5.001904e+06 assign (segid " A" and resid 104 and name HG1) (segid " A" and resid 104 and name HB2) 4.108 2.109 2.109 weight 1.000 ! spec=13C_...spin, no=431, id=1583, vol=2.932805e+06 assign (segid " A" and resid 104 and name HG2) (segid " A" and resid 104 and name HB2) 3.856 1.859 1.859 weight 1.000 ! spec=13C_...spin, no=432, id=1584, vol=1.652668e+07 assign (segid " A" and resid 103 and name HA) (segid " A" and resid 103 and name HB2) 4.215 2.220 2.220 weight 1.000 ! spec=13C_...spin, no=437, id=1586, vol=6.471856e+06 assign (segid " A" and resid 103 and name HB2) (segid " A" and resid 103 and name HB1) 2.237 0.625 0.625 weight 1.000 ! spec=13C_...spin, no=443, id=1589, vol=5.635472e+07 assign (segid " A" and resid 103 and name HD1) (segid " A" and resid 102 and name HB2) 4.716 2.780 2.780 weight 1.000 ! spec=13C_...spin, no=452, id=1597, vol=2.714403e+06 or (segid " A" and resid 103 and name HD1) (segid " A" and resid 102 and name HB1) or (segid " A" and resid 103 and name HD1) (segid " A" and resid 102 and name HB3) assign (segid " A" and resid 101 and name HA) (segid " A" and resid 101 and name HB2) 2.002 0.501 0.501 weight 1.000 ! spec=13C_...spin, no=484, id=1610, vol=1.868973e+08 or (segid " A" and resid 101 and name HA) (segid " A" and resid 101 and name HB1) or (segid " A" and resid 101 and name HA) (segid " A" and resid 101 and name HB3) assign (segid " A" and resid 101 and name HB2) (segid " A" and resid 102 and name HA) 2.737 0.936 3.263 weight 1.000 ! spec=13C_...spin, no=486, id=1611, vol=6.226015e+07 or (segid " A" and resid 101 and name HB1) (segid " A" and resid 102 and name HA) or (segid " A" and resid 101 and name HB3) (segid " A" and resid 102 and name HA) assign (segid " A" and resid 100 and name HA) (segid " A" and resid 99 and name HB1) 2.930 1.073 1.073 weight 1.000 ! spec=13C_...spin, no=490, id=1613, vol=4.234242e+07 assign (segid " A" and resid 100 and name HA) (segid " A" and resid 100 and name HG) 3.220 1.296 1.296 weight 1.000 ! spec=13C_...spin, no=491, id=1614, vol=1.583403e+07 assign (segid " A" and resid 100 and name HA) (segid " A" and resid 100 and name HD12) 2.879 1.036 1.036 weight 1.000 ! spec=13C_...spin, no=492, id=1615, vol=2.538064e+07 or (segid " A" and resid 100 and name HA) (segid " A" and resid 100 and name HD11) or (segid " A" and resid 100 and name HA) (segid " A" and resid 100 and name HD13) assign (segid " A" and resid 100 and name HA) (segid " A" and resid 103 and name HZ3) 6.034 4.551 4.551 weight 1.000 ! spec=13C_...spin, no=494, id=1616, vol=1.241269e+06 assign (segid " A" and resid 100 and name HA) (segid " A" and resid 103 and name HE3) 2.932 1.075 1.075 weight 1.000 ! spec=13C_...spin, no=495, id=1617, vol=2.684898e+07 assign (segid " A" and resid 100 and name HD12) (segid " A" and resid 100 and name HD22) 1.505 0.283 4.495 weight 1.000 ! spec=13C_...spin, no=537, id=1622, vol=4.679452e+08 or (segid " A" and resid 100 and name HD12) (segid " A" and resid 100 and name HD21) or (segid " A" and resid 100 and name HD12) (segid " A" and resid 100 and name HD23) or (segid " A" and resid 100 and name HD11) (segid " A" and resid 100 and name HD22) or (segid " A" and resid 100 and name HD11) (segid " A" and resid 100 and name HD21) or (segid " A" and resid 100 and name HD11) (segid " A" and resid 100 and name HD23) or (segid " A" and resid 100 and name HD13) (segid " A" and resid 100 and name HD22) or (segid " A" and resid 100 and name HD13) (segid " A" and resid 100 and name HD21) or (segid " A" and resid 100 and name HD13) (segid " A" and resid 100 and name HD23) assign (segid " A" and resid 100 and name HA) (segid " A" and resid 100 and name HD22) 3.566 1.589 1.589 weight 1.000 ! spec=13C_...spin, no=541, id=1623, vol=1.766933e+07 or (segid " A" and resid 100 and name HA) (segid " A" and resid 100 and name HD21) or (segid " A" and resid 100 and name HA) (segid " A" and resid 100 and name HD23) assign (segid " A" and resid 102 and name HB2) (segid " A" and resid 99 and name HA) 2.266 0.642 0.642 weight 1.000 ! spec=13C_...spin, no=545, id=1624, vol=7.249742e+07 or (segid " A" and resid 102 and name HB1) (segid " A" and resid 99 and name HA) or (segid " A" and resid 102 and name HB3) (segid " A" and resid 99 and name HA) assign (segid " A" and resid 99 and name HA) (segid " A" and resid 99 and name HB1) 2.655 0.881 0.881 weight 1.000 ! spec=13C_...spin, no=546, id=1625, vol=6.006282e+07 assign (segid " A" and resid 99 and name HB1) (segid " A" and resid 99 and name HB2) 1.426 0.254 0.254 weight 1.000 ! spec=13C_...spin, no=548, id=1627, vol=5.716436e+08 assign (segid " A" and resid 99 and name HB2) (segid " A" and resid 99 and name HA) 2.960 1.096 1.096 weight 1.000 ! spec=13C_...spin, no=552, id=1628, vol=3.480466e+07 assign (segid " A" and resid 97 and name HA) (segid " A" and resid 28 and name HD22) 4.054 2.054 2.054 weight 1.000 ! spec=13C_...spin, no=571, id=1634, vol=3.708244e+06 or (segid " A" and resid 97 and name HA) (segid " A" and resid 28 and name HD21) or (segid " A" and resid 97 and name HA) (segid " A" and resid 28 and name HD23) assign (segid " A" and resid 97 and name HB1) (segid " A" and resid 28 and name HD22) 3.521 1.550 1.550 weight 1.000 ! spec=13C_...spin, no=575, id=1636, vol=1.136010e+07 or (segid " A" and resid 97 and name HB1) (segid " A" and resid 28 and name HD21) or (segid " A" and resid 97 and name HB1) (segid " A" and resid 28 and name HD23) assign (segid " A" and resid 96 and name HA) (segid " A" and resid 96 and name HD12) 5.089 3.237 3.237 weight 1.000 ! spec=13C_...spin, no=585, id=1639, vol=4.100123e+06 or (segid " A" and resid 96 and name HA) (segid " A" and resid 96 and name HD11) or (segid " A" and resid 96 and name HA) (segid " A" and resid 96 and name HD13) assign (segid " A" and resid 96 and name HB2) (segid " A" and resid 96 and name HD22) 3.423 1.465 1.465 weight 1.000 ! spec=13C_...spin, no=591, id=1643, vol=2.446368e+07 or (segid " A" and resid 96 and name HB2) (segid " A" and resid 96 and name HD21) or (segid " A" and resid 96 and name HB2) (segid " A" and resid 96 and name HD23) assign (segid " A" and resid 96 and name HB1) (segid " A" and resid 93 and name HA) 3.895 1.896 1.896 weight 1.000 ! spec=13C_...spin, no=594, id=1644, vol=4.116847e+07 assign (segid " A" and resid 96 and name HA) (segid " A" and resid 96 and name HB2) 4.963 3.079 3.079 weight 1.000 ! spec=13C_...spin, no=595, id=1645, vol=2.145464e+06 assign (segid " A" and resid 96 and name HA) (segid " A" and resid 96 and name HB1) 2.612 0.853 0.853 weight 1.000 ! spec=13C_...spin, no=597, id=1646, vol=5.182643e+07 assign (segid " A" and resid 96 and name HG) (segid " A" and resid 96 and name HB1) 2.724 0.927 0.927 weight 1.000 ! spec=13C_...spin, no=600, id=1647, vol=5.562637e+07 assign (segid " A" and resid 96 and name HG) (segid " A" and resid 93 and name HA) 2.590 0.839 0.839 weight 1.000 ! spec=13C_...spin, no=601, id=1648, vol=2.198170e+07 assign (segid " A" and resid 96 and name HD22) (segid " A" and resid 96 and name HA) 2.515 0.791 0.791 weight 1.000 ! spec=13C_...spin, no=604, id=1649, vol=5.694457e+07 or (segid " A" and resid 96 and name HD21) (segid " A" and resid 96 and name HA) or (segid " A" and resid 96 and name HD23) (segid " A" and resid 96 and name HA) assign (segid " A" and resid 96 and name HD12) (segid " A" and resid 21 and name HA) 3.973 1.973 1.973 weight 1.000 ! spec=13C_...spin, no=606, id=1650, vol=3.230335e+06 or (segid " A" and resid 96 and name HD11) (segid " A" and resid 21 and name HA) or (segid " A" and resid 96 and name HD13) (segid " A" and resid 21 and name HA) assign (segid " A" and resid 96 and name HD12) (segid " A" and resid 96 and name HB2) 1.801 0.405 0.405 weight 1.000 ! spec=13C_...spin, no=607, id=1651, vol=2.755858e+08 or (segid " A" and resid 96 and name HD11) (segid " A" and resid 96 and name HB2) or (segid " A" and resid 96 and name HD13) (segid " A" and resid 96 and name HB2) assign (segid " A" and resid 95 and name HA) (segid " A" and resid 95 and name HB2) 2.335 0.682 0.682 weight 1.000 ! spec=13C_...spin, no=609, id=1652, vol=6.684777e+07 or (segid " A" and resid 95 and name HA) (segid " A" and resid 95 and name HB1) or (segid " A" and resid 95 and name HA) (segid " A" and resid 95 and name HB3) assign (segid " A" and resid 95 and name HB2) (segid " A" and resid 92 and name HA) 2.782 0.968 0.968 weight 1.000 ! spec=13C_...spin, no=611, id=1654, vol=3.022406e+07 or (segid " A" and resid 95 and name HB1) (segid " A" and resid 92 and name HA) or (segid " A" and resid 95 and name HB3) (segid " A" and resid 92 and name HA) assign (segid " A" and resid 93 and name HA) (segid " A" and resid 93 and name HG) 2.129 0.566 3.871 weight 1.000 ! spec=13C_...spin, no=612, id=1655, vol=1.578804e+08 assign (segid " A" and resid 93 and name HB1) (segid " A" and resid 93 and name HB2) 1.919 0.460 0.460 weight 1.000 ! spec=13C_...spin, no=614, id=1657, vol=1.069451e+08 assign (segid " A" and resid 93 and name HB2) (segid " A" and resid 93 and name HA) 4.124 2.126 2.126 weight 1.000 ! spec=13C_...spin, no=615, id=1658, vol=5.509144e+06 assign (segid " A" and resid 93 and name HB1) (segid " A" and resid 93 and name HA) 3.360 1.411 1.411 weight 1.000 ! spec=13C_...spin, no=616, id=1659, vol=7.317214e+06 assign (segid " A" and resid 93 and name HB2) (segid " A" and resid 93 and name HG) 2.409 0.725 0.725 weight 1.000 ! spec=13C_...spin, no=617, id=1660, vol=6.145642e+07 assign (segid " A" and resid 93 and name HB1) (segid " A" and resid 93 and name HG) 3.233 1.307 1.307 weight 1.000 ! spec=13C_...spin, no=618, id=1661, vol=2.553125e+07 assign (segid " A" and resid 93 and name HD22) (segid " A" and resid 93 and name HA) 2.914 1.062 1.062 weight 1.000 ! spec=13C_...spin, no=621, id=1662, vol=1.377052e+07 or (segid " A" and resid 93 and name HD21) (segid " A" and resid 93 and name HA) or (segid " A" and resid 93 and name HD23) (segid " A" and resid 93 and name HA) assign (segid " A" and resid 92 and name HA) (segid " A" and resid 92 and name HE1) 5.279 3.484 3.484 weight 1.000 ! spec=13C_...spin, no=625, id=1666, vol=3.826684e+06 or (segid " A" and resid 92 and name HA) (segid " A" and resid 92 and name HE2) assign (segid " A" and resid 92 and name HA) (segid " A" and resid 92 and name HB1) 3.290 1.353 1.353 weight 1.000 ! spec=13C_...spin, no=626, id=1667, vol=3.737281e+07 assign (segid " A" and resid 92 and name HA) (segid " A" and resid 92 and name HB2) 3.643 1.659 1.659 weight 1.000 ! spec=13C_...spin, no=627, id=1668, vol=7.895921e+06 assign (segid " A" and resid 92 and name HB1) (segid " A" and resid 92 and name HD1) 4.376 2.394 2.394 weight 1.000 ! spec=13C_...spin, no=628, id=1669, vol=7.650838e+06 or (segid " A" and resid 92 and name HB1) (segid " A" and resid 92 and name HD2) assign (segid " A" and resid 90 and name HA) (segid " A" and resid 93 and name HG) 2.371 0.703 0.703 weight 1.000 ! spec=13C_...spin, no=633, id=1672, vol=8.270246e+07 assign (segid " A" and resid 90 and name HB2) (segid " A" and resid 87 and name HA) 3.171 1.257 1.257 weight 1.000 ! spec=13C_...spin, no=637, id=1675, vol=2.555173e+07 assign (segid " A" and resid 89 and name HA) (segid " A" and resid 89 and name HB2) 2.763 0.955 0.955 weight 1.000 ! spec=13C_...spin, no=650, id=1687, vol=4.227229e+07 assign (segid " A" and resid 89 and name HA) (segid " A" and resid 89 and name HB1) 3.271 1.338 1.338 weight 1.000 ! spec=13C_...spin, no=654, id=1691, vol=3.906288e+07 assign (segid " A" and resid 89 and name HB2) (segid " A" and resid 89 and name HB1) 2.311 0.668 0.668 weight 1.000 ! spec=13C_...spin, no=655, id=1692, vol=4.559780e+07 assign (segid " A" and resid 89 and name HB1) (segid " A" and resid 80 and name HD22) 3.983 1.983 1.983 weight 1.000 ! spec=13C_...spin, no=658, id=1695, vol=1.935381e+07 or (segid " A" and resid 89 and name HB1) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 89 and name HB1) (segid " A" and resid 80 and name HD23) assign (segid " A" and resid 89 and name HD1) (segid " A" and resid 93 and name HG) 4.441 2.466 2.466 weight 1.000 ! spec=13C_...spin, no=663, id=1699, vol=5.484088e+06 or (segid " A" and resid 89 and name HD2) (segid " A" and resid 93 and name HG) assign (segid " A" and resid 88 and name HA) (segid " A" and resid 91 and name HB1) 2.757 0.950 0.950 weight 1.000 ! spec=13C_...spin, no=678, id=1707, vol=3.386183e+07 assign (segid " A" and resid 86 and name HA) (segid " A" and resid 89 and name HB1) 3.778 1.784 1.784 weight 1.000 ! spec=13C_...spin, no=684, id=1710, vol=8.030061e+06 assign (segid " A" and resid 86 and name HA) (segid " A" and resid 89 and name HB2) 3.924 1.924 1.924 weight 1.000 ! spec=13C_...spin, no=685, id=1711, vol=8.097630e+06 assign (segid " A" and resid 86 and name HA) (segid " A" and resid 89 and name HD1) 4.679 2.736 2.736 weight 1.000 ! spec=13C_...spin, no=687, id=1713, vol=1.157361e+07 or (segid " A" and resid 86 and name HA) (segid " A" and resid 89 and name HD2) assign (segid " A" and resid 86 and name HB2) (segid " A" and resid 89 and name HB2) 3.967 1.967 1.967 weight 1.000 ! spec=13C_...spin, no=688, id=1714, vol=1.994093e+07 or (segid " A" and resid 86 and name HB1) (segid " A" and resid 89 and name HB2) or (segid " A" and resid 86 and name HB3) (segid " A" and resid 89 and name HB2) assign (segid " A" and resid 86 and name HA) (segid " A" and resid 86 and name HB2) 2.505 0.784 0.784 weight 1.000 ! spec=13C_...spin, no=691, id=1715, vol=5.320573e+07 or (segid " A" and resid 86 and name HA) (segid " A" and resid 86 and name HB1) or (segid " A" and resid 86 and name HA) (segid " A" and resid 86 and name HB3) assign (segid " A" and resid 85 and name HA2) (segid " A" and resid 85 and name HA1) 2.191 0.600 0.600 weight 1.000 ! spec=13C_...spin, no=696, id=1717, vol=5.963681e+07 assign (segid " A" and resid 85 and name HA2) (segid " A" and resid 80 and name HD22) 3.393 1.439 1.439 weight 1.000 ! spec=13C_...spin, no=697, id=1718, vol=1.759117e+07 or (segid " A" and resid 85 and name HA2) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 85 and name HA2) (segid " A" and resid 80 and name HD23) assign (segid " A" and resid 85 and name HA1) (segid " A" and resid 80 and name HD22) 4.221 2.227 2.227 weight 1.000 ! spec=13C_...spin, no=698, id=1719, vol=4.220340e+06 or (segid " A" and resid 85 and name HA1) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 85 and name HA1) (segid " A" and resid 80 and name HD23) assign (segid " A" and resid 84 and name HA) (segid " A" and resid 84 and name HB2) 3.443 1.482 1.482 weight 1.000 ! spec=13C_...spin, no=699, id=1720, vol=2.795204e+07 assign (segid " A" and resid 84 and name HA) (segid " A" and resid 84 and name HB1) 3.108 1.207 1.207 weight 1.000 ! spec=13C_...spin, no=700, id=1721, vol=2.809902e+07 assign (segid " A" and resid 84 and name HB2) (segid " A" and resid 84 and name HB1) 1.801 0.406 0.406 weight 1.000 ! spec=13C_...spin, no=707, id=1723, vol=2.793143e+08 assign (segid " A" and resid 83 and name HA) (segid " A" and resid 84 and name HA) 4.920 3.025 3.025 weight 1.000 ! spec=13C_...spin, no=714, id=1730, vol=3.145426e+06 assign (segid " A" and resid 83 and name HB2) (segid " A" and resid 83 and name HA) 2.315 0.670 0.670 weight 1.000 ! spec=13C_...spin, no=715, id=1731, vol=8.942723e+07 or (segid " A" and resid 83 and name HB1) (segid " A" and resid 83 and name HA) or (segid " A" and resid 83 and name HB3) (segid " A" and resid 83 and name HA) assign (segid " A" and resid 83 and name HB2) (segid " A" and resid 84 and name HA) 4.378 2.396 2.396 weight 1.000 ! spec=13C_...spin, no=716, id=1732, vol=5.532926e+06 or (segid " A" and resid 83 and name HB1) (segid " A" and resid 84 and name HA) or (segid " A" and resid 83 and name HB3) (segid " A" and resid 84 and name HA) assign (segid " A" and resid 82 and name HA) (segid " A" and resid 82 and name HB2) 3.769 1.776 1.776 weight 1.000 ! spec=13C_...spin, no=718, id=1734, vol=1.220641e+07 assign (segid " A" and resid 82 and name HB2) (segid " A" and resid 82 and name HB1) 1.745 0.381 0.381 weight 1.000 ! spec=13C_...spin, no=719, id=1735, vol=2.107726e+08 assign (segid " A" and resid 82 and name HA) (segid " A" and resid 82 and name HB1) 3.391 1.438 1.438 weight 1.000 ! spec=13C_...spin, no=721, id=1736, vol=1.397260e+07 assign (segid " A" and resid 82 and name HG2) (segid " A" and resid 82 and name HG1) 1.404 0.247 4.596 weight 1.000 ! spec=13C_...spin, no=722, id=1737, vol=8.525161e+08 assign (segid " A" and resid 82 and name HG2) (segid " A" and resid 82 and name HB2) 2.233 0.623 0.623 weight 1.000 ! spec=13C_...spin, no=724, id=1739, vol=1.572182e+08 assign (segid " A" and resid 82 and name HG1) (segid " A" and resid 82 and name HB2) 2.205 0.608 0.608 weight 1.000 ! spec=13C_...spin, no=725, id=1740, vol=1.673324e+08 assign (segid " A" and resid 82 and name HG1) (segid " A" and resid 82 and name HA) 3.660 1.675 1.675 weight 1.000 ! spec=13C_...spin, no=728, id=1741, vol=1.862777e+07 assign (segid " A" and resid 82 and name HA) (segid " A" and resid 82 and name HG2) 3.469 1.504 1.504 weight 1.000 ! spec=13C_...spin, no=729, id=1742, vol=1.817351e+07 assign (segid " A" and resid 81 and name HG1) (segid " A" and resid 81 and name HG2) 2.567 0.824 0.824 weight 1.000 ! spec=13C_...spin, no=731, id=1744, vol=2.228269e+07 assign (segid " A" and resid 81 and name HG1) (segid " A" and resid 81 and name HA) 7.028 6.173 6.173 weight 1.000 ! spec=13C_...spin, no=737, id=1748, vol=5.818496e+05 assign (segid " A" and resid 81 and name HG2) (segid " A" and resid 81 and name HA) 5.036 3.171 3.171 weight 1.000 ! spec=13C_...spin, no=738, id=1749, vol=1.526836e+06 assign (segid " A" and resid 81 and name HG1) (segid " A" and resid 78 and name HA) 3.201 1.281 1.281 weight 1.000 ! spec=13C_...spin, no=739, id=1750, vol=1.793714e+07 assign (segid " A" and resid 80 and name HA) (segid " A" and resid 85 and name HA1) 2.974 1.106 1.106 weight 1.000 ! spec=13C_...spin, no=741, id=1751, vol=1.837866e+07 assign (segid " A" and resid 80 and name HB2) (segid " A" and resid 80 and name HB1) 2.582 0.833 0.833 weight 1.000 ! spec=13C_...spin, no=746, id=1756, vol=1.950840e+07 assign (segid " A" and resid 80 and name HB1) (segid " A" and resid 80 and name HD22) 3.275 1.341 1.341 weight 1.000 ! spec=13C_...spin, no=748, id=1758, vol=1.164785e+07 or (segid " A" and resid 80 and name HB1) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 80 and name HB1) (segid " A" and resid 80 and name HD23) assign (segid " A" and resid 80 and name HA) (segid " A" and resid 80 and name HB2) 3.868 1.870 1.870 weight 1.000 ! spec=13C_...spin, no=752, id=1761, vol=1.079177e+07 assign (segid " A" and resid 80 and name HG) (segid " A" and resid 80 and name HD22) 3.070 1.178 1.178 weight 1.000 ! spec=13C_...spin, no=754, id=1762, vol=7.992636e+06 or (segid " A" and resid 80 and name HG) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 80 and name HG) (segid " A" and resid 80 and name HD23) assign (segid " A" and resid 80 and name HD12) (segid " A" and resid 77 and name HA) 2.567 0.824 0.824 weight 1.000 ! spec=13C_...spin, no=764, id=1770, vol=5.543411e+07 or (segid " A" and resid 80 and name HD11) (segid " A" and resid 77 and name HA) or (segid " A" and resid 80 and name HD13) (segid " A" and resid 77 and name HA) assign (segid " A" and resid 80 and name HB2) (segid " A" and resid 80 and name HD22) 2.920 1.065 1.065 weight 1.000 ! spec=13C_...spin, no=765, id=1771, vol=8.005724e+07 or (segid " A" and resid 80 and name HB2) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 80 and name HB2) (segid " A" and resid 80 and name HD23) assign (segid " A" and resid 80 and name HD22) (segid " A" and resid 88 and name HB1) 3.320 1.378 1.378 weight 1.000 ! spec=13C_...spin, no=768, id=1774, vol=9.700073e+06 or (segid " A" and resid 80 and name HD21) (segid " A" and resid 88 and name HB1) or (segid " A" and resid 80 and name HD23) (segid " A" and resid 88 and name HB1) assign (segid " A" and resid 89 and name HA) (segid " A" and resid 80 and name HD22) 3.930 1.930 1.930 weight 1.000 ! spec=13C_...spin, no=770, id=1776, vol=7.185144e+06 or (segid " A" and resid 89 and name HA) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 89 and name HA) (segid " A" and resid 80 and name HD23) assign (segid " A" and resid 80 and name HD22) (segid " A" and resid 128 and name HE1) 4.141 2.143 2.143 weight 1.000 ! spec=13C_...spin, no=771, id=1777, vol=9.083646e+06 or (segid " A" and resid 80 and name HD22) (segid " A" and resid 128 and name HE2) or (segid " A" and resid 80 and name HD21) (segid " A" and resid 128 and name HE1) or (segid " A" and resid 80 and name HD21) (segid " A" and resid 128 and name HE2) or (segid " A" and resid 80 and name HD23) (segid " A" and resid 128 and name HE1) or (segid " A" and resid 80 and name HD23) (segid " A" and resid 128 and name HE2) assign (segid " A" and resid 80 and name HD22) (segid " A" and resid 128 and name HD1) 3.277 1.343 1.343 weight 1.000 ! spec=13C_...spin, no=772, id=1778, vol=3.194710e+07 or (segid " A" and resid 80 and name HD22) (segid " A" and resid 128 and name HD2) or (segid " A" and resid 80 and name HD21) (segid " A" and resid 128 and name HD1) or (segid " A" and resid 80 and name HD21) (segid " A" and resid 128 and name HD2) or (segid " A" and resid 80 and name HD23) (segid " A" and resid 128 and name HD1) or (segid " A" and resid 80 and name HD23) (segid " A" and resid 128 and name HD2) assign (segid " A" and resid 89 and name HD1) (segid " A" and resid 80 and name HD22) 3.939 1.939 1.939 weight 1.000 ! spec=13C_...spin, no=773, id=1779, vol=1.642019e+07 or (segid " A" and resid 89 and name HD1) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 89 and name HD1) (segid " A" and resid 80 and name HD23) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 80 and name HD22) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 80 and name HD23) assign (segid " A" and resid 81 and name HG2) (segid " A" and resid 78 and name HA) 3.821 1.825 1.825 weight 1.000 ! spec=13C_...spin, no=785, id=1782, vol=1.084632e+07 assign (segid " A" and resid 78 and name HA) (segid " A" and resid 78 and name HG2) 4.250 2.258 2.258 weight 1.000 ! spec=13C_...spin, no=786, id=1783, vol=1.394535e+07 assign (segid " A" and resid 78 and name HA) (segid " A" and resid 78 and name HB1) 3.178 1.262 1.262 weight 1.000 ! spec=13C_...spin, no=788, id=1785, vol=3.997183e+07 assign (segid " A" and resid 78 and name HA) (segid " A" and resid 9 and name HG21) 3.132 1.227 1.227 weight 1.000 ! spec=13C_...spin, no=789, id=1786, vol=1.518135e+07 or (segid " A" and resid 78 and name HA) (segid " A" and resid 9 and name HG22) or (segid " A" and resid 78 and name HA) (segid " A" and resid 9 and name HG23) assign (segid " A" and resid 78 and name HA) (segid " A" and resid 77 and name HG22) 4.665 2.721 2.721 weight 1.000 ! spec=13C_...spin, no=790, id=1787, vol=2.086504e+06 or (segid " A" and resid 78 and name HA) (segid " A" and resid 77 and name HG21) or (segid " A" and resid 78 and name HA) (segid " A" and resid 77 and name HG23) assign (segid " A" and resid 78 and name HB2) (segid " A" and resid 78 and name HA) 2.926 1.070 1.070 weight 1.000 ! spec=13C_...spin, no=791, id=1788, vol=3.077821e+07 assign (segid " A" and resid 78 and name HA) (segid " A" and resid 78 and name HG1) 2.797 0.978 0.978 weight 1.000 ! spec=13C_...spin, no=796, id=1789, vol=5.102288e+07 assign (segid " A" and resid 77 and name HA) (segid " A" and resid 77 and name HG11) 4.121 2.122 2.122 weight 1.000 ! spec=13C_...spin, no=800, id=1791, vol=7.840946e+06 assign (segid " A" and resid 77 and name HB) (segid " A" and resid 77 and name HD12) 2.869 1.029 1.029 weight 1.000 ! spec=13C_...spin, no=806, id=1797, vol=2.835126e+07 or (segid " A" and resid 77 and name HB) (segid " A" and resid 77 and name HD11) or (segid " A" and resid 77 and name HB) (segid " A" and resid 77 and name HD13) assign (segid " A" and resid 77 and name HG12) (segid " A" and resid 77 and name HG11) 2.648 0.876 0.876 weight 1.000 ! spec=13C_...spin, no=809, id=1799, vol=1.087627e+07 assign (segid " A" and resid 77 and name HG11) (segid " A" and resid 128 and name HZ) 4.918 3.024 3.024 weight 1.000 ! spec=13C_...spin, no=813, id=1801, vol=3.538918e+06 assign (segid " A" and resid 77 and name HB) (segid " A" and resid 77 and name HG22) 2.740 0.938 0.938 weight 1.000 ! spec=13C_...spin, no=816, id=1803, vol=1.776511e+07 or (segid " A" and resid 77 and name HB) (segid " A" and resid 77 and name HG21) or (segid " A" and resid 77 and name HB) (segid " A" and resid 77 and name HG23) assign (segid " A" and resid 77 and name HG22) (segid " A" and resid 13 and name HB2) 2.596 0.843 0.843 weight 1.000 ! spec=13C_...spin, no=818, id=1804, vol=3.907045e+07 or (segid " A" and resid 77 and name HG21) (segid " A" and resid 13 and name HB2) or (segid " A" and resid 77 and name HG23) (segid " A" and resid 13 and name HB2) assign (segid " A" and resid 77 and name HG22) (segid " A" and resid 10 and name HA) 4.064 2.064 2.064 weight 1.000 ! spec=13C_...spin, no=820, id=1806, vol=3.694234e+06 or (segid " A" and resid 77 and name HG21) (segid " A" and resid 10 and name HA) or (segid " A" and resid 77 and name HG23) (segid " A" and resid 10 and name HA) assign (segid " A" and resid 77 and name HG22) (segid " A" and resid 13 and name HD1) 3.995 1.995 1.995 weight 1.000 ! spec=13C_...spin, no=821, id=1807, vol=9.104109e+06 or (segid " A" and resid 77 and name HG22) (segid " A" and resid 13 and name HD2) or (segid " A" and resid 77 and name HG21) (segid " A" and resid 13 and name HD1) or (segid " A" and resid 77 and name HG21) (segid " A" and resid 13 and name HD2) or (segid " A" and resid 77 and name HG23) (segid " A" and resid 13 and name HD1) or (segid " A" and resid 77 and name HG23) (segid " A" and resid 13 and name HD2) assign (segid " A" and resid 77 and name HD12) (segid " A" and resid 77 and name HG11) 2.477 0.767 0.767 weight 1.000 ! spec=13C_...spin, no=825, id=1810, vol=3.598529e+07 or (segid " A" and resid 77 and name HD11) (segid " A" and resid 77 and name HG11) or (segid " A" and resid 77 and name HD13) (segid " A" and resid 77 and name HG11) assign (segid " A" and resid 77 and name HD12) (segid " A" and resid 72 and name HB2) 3.845 1.848 1.848 weight 1.000 ! spec=13C_...spin, no=826, id=1811, vol=4.970031e+06 or (segid " A" and resid 77 and name HD11) (segid " A" and resid 72 and name HB2) or (segid " A" and resid 77 and name HD13) (segid " A" and resid 72 and name HB2) assign (segid " A" and resid 77 and name HB) (segid " A" and resid 74 and name HA) 2.454 0.753 0.753 weight 1.000 ! spec=13C_...spin, no=839, id=1817, vol=7.754411e+07 assign (segid " A" and resid 74 and name HA) (segid " A" and resid 74 and name HG21) 2.965 1.099 1.099 weight 1.000 ! spec=13C_...spin, no=840, id=1818, vol=2.022236e+07 or (segid " A" and resid 74 and name HA) (segid " A" and resid 74 and name HG22) or (segid " A" and resid 74 and name HA) (segid " A" and resid 74 and name HG23) assign (segid " A" and resid 77 and name HD12) (segid " A" and resid 74 and name HA) 3.292 1.355 1.355 weight 1.000 ! spec=13C_...spin, no=841, id=1819, vol=1.213884e+07 or (segid " A" and resid 77 and name HD11) (segid " A" and resid 74 and name HA) or (segid " A" and resid 77 and name HD13) (segid " A" and resid 74 and name HA) assign (segid " A" and resid 74 and name HA) (segid " A" and resid 74 and name HB) 3.260 1.329 1.329 weight 1.000 ! spec=13C_...spin, no=842, id=1820, vol=2.142920e+07 assign (segid " A" and resid 74 and name HB) (segid " A" and resid 74 and name HG21) 2.095 0.549 0.549 weight 1.000 ! spec=13C_...spin, no=843, id=1821, vol=1.322425e+08 or (segid " A" and resid 74 and name HB) (segid " A" and resid 74 and name HG22) or (segid " A" and resid 74 and name HB) (segid " A" and resid 74 and name HG23) assign (segid " A" and resid 77 and name HD12) (segid " A" and resid 74 and name HG21) 3.331 1.387 1.387 weight 1.000 ! spec=13C_...spin, no=845, id=1822, vol=1.465888e+07 or (segid " A" and resid 77 and name HD12) (segid " A" and resid 74 and name HG22) or (segid " A" and resid 77 and name HD12) (segid " A" and resid 74 and name HG23) or (segid " A" and resid 77 and name HD11) (segid " A" and resid 74 and name HG21) or (segid " A" and resid 77 and name HD11) (segid " A" and resid 74 and name HG22) or (segid " A" and resid 77 and name HD11) (segid " A" and resid 74 and name HG23) or (segid " A" and resid 77 and name HD13) (segid " A" and resid 74 and name HG21) or (segid " A" and resid 77 and name HD13) (segid " A" and resid 74 and name HG22) or (segid " A" and resid 77 and name HD13) (segid " A" and resid 74 and name HG23) assign (segid " A" and resid 73 and name HA) (segid " A" and resid 73 and name HB1) 2.292 0.657 0.657 weight 1.000 ! spec=13C_...spin, no=852, id=1826, vol=1.174989e+08 assign (segid " A" and resid 72 and name HA) (segid " A" and resid 126 and name HD22) 5.606 3.929 3.929 weight 1.000 ! spec=13C_...spin, no=855, id=1828, vol=2.318630e+06 or (segid " A" and resid 72 and name HA) (segid " A" and resid 126 and name HD21) or (segid " A" and resid 72 and name HA) (segid " A" and resid 126 and name HD23) assign (segid " A" and resid 72 and name HB2) (segid " A" and resid 72 and name HB1) 2.531 0.801 0.801 weight 1.000 ! spec=13C_...spin, no=857, id=1830, vol=2.771283e+07 assign (segid " A" and resid 77 and name HD12) (segid " A" and resid 72 and name HB1) 4.117 2.118 2.118 weight 1.000 ! spec=13C_...spin, no=858, id=1831, vol=1.022729e+07 or (segid " A" and resid 77 and name HD11) (segid " A" and resid 72 and name HB1) or (segid " A" and resid 77 and name HD13) (segid " A" and resid 72 and name HB1) assign (segid " A" and resid 72 and name HB2) (segid " A" and resid 72 and name HA) 6.683 5.582 5.582 weight 1.000 ! spec=13C_...spin, no=860, id=1833, vol=4.744904e+05 assign (segid " A" and resid 72 and name HB1) (segid " A" and resid 72 and name HE3) 4.585 2.627 2.627 weight 1.000 ! spec=13C_...spin, no=861, id=1834, vol=2.049953e+07 assign (segid " A" and resid 72 and name HD1) (segid " A" and resid 72 and name HA) 3.804 1.809 1.809 weight 1.000 ! spec=13C_...spin, no=862, id=1835, vol=8.747050e+06 assign (segid " A" and resid 72 and name HZ2) (segid " A" and resid 72 and name HH2) 1.627 0.331 4.373 weight 1.000 ! spec=13C_...spin, no=864, id=1837, vol=1.183017e+09 assign (segid " A" and resid 72 and name HZ2) (segid " A" and resid 126 and name HD12) 5.221 3.407 3.407 weight 1.000 ! spec=13C_...spin, no=868, id=1841, vol=2.249559e+06 or (segid " A" and resid 72 and name HZ2) (segid " A" and resid 126 and name HD11) or (segid " A" and resid 72 and name HZ2) (segid " A" and resid 126 and name HD13) assign (segid " A" and resid 72 and name HZ2) (segid " A" and resid 72 and name HZ3) 7.855 7.712 7.712 weight 1.000 ! spec=13C_...spin, no=869, id=1842, vol=4.435113e+05 assign (segid " A" and resid 72 and name HH2) (segid " A" and resid 49 and name HG12) 2.779 0.965 0.965 weight 1.000 ! spec=13C_...spin, no=878, id=1845, vol=2.469702e+07 or (segid " A" and resid 72 and name HH2) (segid " A" and resid 49 and name HG11) or (segid " A" and resid 72 and name HH2) (segid " A" and resid 49 and name HG13) assign (segid " A" and resid 71 and name HA) (segid " A" and resid 71 and name HG21) 3.312 1.372 1.372 weight 1.000 ! spec=13C_...spin, no=883, id=1848, vol=1.422197e+07 or (segid " A" and resid 71 and name HA) (segid " A" and resid 71 and name HG22) or (segid " A" and resid 71 and name HA) (segid " A" and resid 71 and name HG23) assign (segid " A" and resid 71 and name HA) (segid " A" and resid 72 and name HE3) 3.642 1.658 1.658 weight 1.000 ! spec=13C_...spin, no=884, id=1849, vol=1.314540e+07 assign (segid " A" and resid 71 and name HA) (segid " A" and resid 71 and name HB) 3.091 1.194 1.194 weight 1.000 ! spec=13C_...spin, no=886, id=1850, vol=1.919854e+07 assign (segid " A" and resid 71 and name HB) (segid " A" and resid 71 and name HG21) 2.392 0.715 0.715 weight 1.000 ! spec=13C_...spin, no=892, id=1852, vol=5.370786e+07 or (segid " A" and resid 71 and name HB) (segid " A" and resid 71 and name HG22) or (segid " A" and resid 71 and name HB) (segid " A" and resid 71 and name HG23) assign (segid " A" and resid 35 and name HG21) (segid " A" and resid 35 and name HA) 1.728 0.373 4.272 weight 1.000 ! spec=13C_...spin, no=893, id=1853, vol=7.056710e+08 or (segid " A" and resid 35 and name HG22) (segid " A" and resid 35 and name HA) or (segid " A" and resid 35 and name HG23) (segid " A" and resid 35 and name HA) assign (segid " A" and resid 70 and name HB1) (segid " A" and resid 70 and name HB2) 1.952 0.477 0.477 weight 1.000 ! spec=13C_...spin, no=897, id=1855, vol=7.828321e+07 assign (segid " A" and resid 70 and name HB1) (segid " A" and resid 70 and name HG) 3.558 1.583 1.583 weight 1.000 ! spec=13C_...spin, no=898, id=1856, vol=1.135546e+07 assign (segid " A" and resid 70 and name HB1) (segid " A" and resid 70 and name HD22) 4.091 2.092 2.092 weight 1.000 ! spec=13C_...spin, no=900, id=1857, vol=1.938522e+06 or (segid " A" and resid 70 and name HB1) (segid " A" and resid 70 and name HD21) or (segid " A" and resid 70 and name HB1) (segid " A" and resid 70 and name HD23) assign (segid " A" and resid 70 and name HB1) (segid " A" and resid 126 and name HD12) 3.329 1.386 1.386 weight 1.000 ! spec=13C_...spin, no=902, id=1859, vol=1.686223e+07 or (segid " A" and resid 70 and name HB1) (segid " A" and resid 126 and name HD11) or (segid " A" and resid 70 and name HB1) (segid " A" and resid 126 and name HD13) assign (segid " A" and resid 70 and name HB1) (segid " A" and resid 70 and name HA) 3.608 1.627 1.627 weight 1.000 ! spec=13C_...spin, no=904, id=1860, vol=5.781275e+06 assign (segid " A" and resid 70 and name HB2) (segid " A" and resid 70 and name HA) 4.653 2.706 2.706 weight 1.000 ! spec=13C_...spin, no=905, id=1861, vol=2.815162e+06 assign (segid " A" and resid 70 and name HG) (segid " A" and resid 69 and name HA) 5.233 3.423 3.423 weight 1.000 ! spec=13C_...spin, no=906, id=1862, vol=2.060988e+06 assign (segid " A" and resid 70 and name HG) (segid " A" and resid 70 and name HA) 4.264 2.272 2.272 weight 1.000 ! spec=13C_...spin, no=907, id=1863, vol=2.373174e+06 assign (segid " A" and resid 70 and name HG) (segid " A" and resid 70 and name HD12) 1.664 0.346 4.336 weight 1.000 ! spec=13C_...spin, no=908, id=1864, vol=2.741016e+08 or (segid " A" and resid 70 and name HG) (segid " A" and resid 70 and name HD11) or (segid " A" and resid 70 and name HG) (segid " A" and resid 70 and name HD13) assign (segid " A" and resid 70 and name HD22) (segid " A" and resid 123 and name HD12) 1.484 0.275 4.516 weight 1.000 ! spec=13C_...spin, no=910, id=1865, vol=2.267584e+08 or (segid " A" and resid 70 and name HD22) (segid " A" and resid 123 and name HD11) or (segid " A" and resid 70 and name HD22) (segid " A" and resid 123 and name HD13) or (segid " A" and resid 70 and name HD21) (segid " A" and resid 123 and name HD12) or (segid " A" and resid 70 and name HD21) (segid " A" and resid 123 and name HD11) or (segid " A" and resid 70 and name HD21) (segid " A" and resid 123 and name HD13) or (segid " A" and resid 70 and name HD23) (segid " A" and resid 123 and name HD12) or (segid " A" and resid 70 and name HD23) (segid " A" and resid 123 and name HD11) or (segid " A" and resid 70 and name HD23) (segid " A" and resid 123 and name HD13) assign (segid " A" and resid 70 and name HD22) (segid " A" and resid 70 and name HD12) 1.511 0.285 4.489 weight 1.000 ! spec=13C_...spin, no=911, id=1866, vol=3.629195e+08 or (segid " A" and resid 70 and name HD22) (segid " A" and resid 70 and name HD11) or (segid " A" and resid 70 and name HD22) (segid " A" and resid 70 and name HD13) or (segid " A" and resid 70 and name HD21) (segid " A" and resid 70 and name HD12) or (segid " A" and resid 70 and name HD21) (segid " A" and resid 70 and name HD11) or (segid " A" and resid 70 and name HD21) (segid " A" and resid 70 and name HD13) or (segid " A" and resid 70 and name HD23) (segid " A" and resid 70 and name HD12) or (segid " A" and resid 70 and name HD23) (segid " A" and resid 70 and name HD11) or (segid " A" and resid 70 and name HD23) (segid " A" and resid 70 and name HD13) assign (segid " A" and resid 70 and name HD22) (segid " A" and resid 123 and name HG) 2.282 0.651 3.718 weight 1.000 ! spec=13C_...spin, no=912, id=1867, vol=9.955720e+07 or (segid " A" and resid 70 and name HD21) (segid " A" and resid 123 and name HG) or (segid " A" and resid 70 and name HD23) (segid " A" and resid 123 and name HG) assign (segid " A" and resid 70 and name HB2) (segid " A" and resid 70 and name HD22) 2.647 0.876 0.876 weight 1.000 ! spec=13C_...spin, no=913, id=1868, vol=1.102686e+08 or (segid " A" and resid 70 and name HB2) (segid " A" and resid 70 and name HD21) or (segid " A" and resid 70 and name HB2) (segid " A" and resid 70 and name HD23) assign (segid " A" and resid 70 and name HD22) (segid " A" and resid 70 and name HA) 3.420 1.462 1.462 weight 1.000 ! spec=13C_...spin, no=914, id=1869, vol=7.243766e+06 or (segid " A" and resid 70 and name HD21) (segid " A" and resid 70 and name HA) or (segid " A" and resid 70 and name HD23) (segid " A" and resid 70 and name HA) assign (segid " A" and resid 70 and name HD22) (segid " A" and resid 103 and name HZ3) 2.720 0.925 0.925 weight 1.000 ! spec=13C_...spin, no=915, id=1870, vol=4.425543e+07 or (segid " A" and resid 70 and name HD21) (segid " A" and resid 103 and name HZ3) or (segid " A" and resid 70 and name HD23) (segid " A" and resid 103 and name HZ3) assign (segid " A" and resid 70 and name HD12) (segid " A" and resid 68 and name HD22) 2.237 0.625 0.625 weight 1.000 ! spec=13C_...spin, no=920, id=1875, vol=4.286893e+07 or (segid " A" and resid 70 and name HD12) (segid " A" and resid 68 and name HD21) or (segid " A" and resid 70 and name HD12) (segid " A" and resid 68 and name HD23) or (segid " A" and resid 70 and name HD11) (segid " A" and resid 68 and name HD22) or (segid " A" and resid 70 and name HD11) (segid " A" and resid 68 and name HD21) or (segid " A" and resid 70 and name HD11) (segid " A" and resid 68 and name HD23) or (segid " A" and resid 70 and name HD13) (segid " A" and resid 68 and name HD22) or (segid " A" and resid 70 and name HD13) (segid " A" and resid 68 and name HD21) or (segid " A" and resid 70 and name HD13) (segid " A" and resid 68 and name HD23) assign (segid " A" and resid 70 and name HD12) (segid " A" and resid 103 and name HH2) 4.489 2.519 2.519 weight 1.000 ! spec=13C_...spin, no=921, id=1876, vol=2.648972e+06 or (segid " A" and resid 70 and name HD11) (segid " A" and resid 103 and name HH2) or (segid " A" and resid 70 and name HD13) (segid " A" and resid 103 and name HH2) assign (segid " A" and resid 69 and name HA) (segid " A" and resid 69 and name HB2) 2.223 0.618 0.618 weight 1.000 ! spec=13C_...spin, no=924, id=1878, vol=7.119966e+07 or (segid " A" and resid 69 and name HA) (segid " A" and resid 69 and name HB1) or (segid " A" and resid 69 and name HA) (segid " A" and resid 69 and name HB3) assign (segid " A" and resid 68 and name HA) (segid " A" and resid 69 and name HB2) 4.603 2.649 2.649 weight 1.000 ! spec=13C_...spin, no=927, id=1880, vol=5.615657e+06 or (segid " A" and resid 68 and name HA) (segid " A" and resid 69 and name HB1) or (segid " A" and resid 68 and name HA) (segid " A" and resid 69 and name HB3) assign (segid " A" and resid 68 and name HA) (segid " A" and resid 68 and name HG) 3.186 1.268 1.268 weight 1.000 ! spec=13C_...spin, no=929, id=1882, vol=1.991608e+07 assign (segid " A" and resid 68 and name HD12) (segid " A" and resid 68 and name HA) 2.847 1.013 1.013 weight 1.000 ! spec=13C_...spin, no=930, id=1883, vol=2.503214e+07 or (segid " A" and resid 68 and name HD11) (segid " A" and resid 68 and name HA) or (segid " A" and resid 68 and name HD13) (segid " A" and resid 68 and name HA) assign (segid " A" and resid 68 and name HD22) (segid " A" and resid 68 and name HA) 4.006 2.006 2.006 weight 1.000 ! spec=13C_...spin, no=931, id=1884, vol=1.559615e+07 or (segid " A" and resid 68 and name HD21) (segid " A" and resid 68 and name HA) or (segid " A" and resid 68 and name HD23) (segid " A" and resid 68 and name HA) assign (segid " A" and resid 68 and name HB2) (segid " A" and resid 68 and name HD12) 2.103 0.553 0.553 weight 1.000 ! spec=13C_...spin, no=933, id=1886, vol=1.482959e+08 or (segid " A" and resid 68 and name HB2) (segid " A" and resid 68 and name HD11) or (segid " A" and resid 68 and name HB2) (segid " A" and resid 68 and name HD13) assign (segid " A" and resid 68 and name HB1) (segid " A" and resid 51 and name HB) 2.903 1.053 1.053 weight 1.000 ! spec=13C_...spin, no=934, id=1887, vol=2.314912e+07 assign (segid " A" and resid 68 and name HA) (segid " A" and resid 68 and name HB1) 3.542 1.569 1.569 weight 1.000 ! spec=13C_...spin, no=935, id=1888, vol=1.537896e+07 assign (segid " A" and resid 68 and name HA) (segid " A" and resid 68 and name HB2) 2.774 0.962 0.962 weight 1.000 ! spec=13C_...spin, no=936, id=1889, vol=2.164754e+07 assign (segid " A" and resid 68 and name HG) (segid " A" and resid 68 and name HD12) 1.971 0.486 0.486 weight 1.000 ! spec=13C_...spin, no=940, id=1893, vol=9.773643e+07 or (segid " A" and resid 68 and name HG) (segid " A" and resid 68 and name HD11) or (segid " A" and resid 68 and name HG) (segid " A" and resid 68 and name HD13) assign (segid " A" and resid 68 and name HD12) (segid " A" and resid 123 and name HD22) 2.618 0.857 0.857 weight 1.000 ! spec=13C_...spin, no=941, id=1894, vol=4.992197e+07 or (segid " A" and resid 68 and name HD12) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 68 and name HD12) (segid " A" and resid 123 and name HD23) or (segid " A" and resid 68 and name HD11) (segid " A" and resid 123 and name HD22) or (segid " A" and resid 68 and name HD11) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 68 and name HD11) (segid " A" and resid 123 and name HD23) or (segid " A" and resid 68 and name HD13) (segid " A" and resid 123 and name HD22) or (segid " A" and resid 68 and name HD13) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 68 and name HD13) (segid " A" and resid 123 and name HD23) assign (segid " A" and resid 68 and name HD12) (segid " A" and resid 123 and name HD12) 2.380 0.708 0.708 weight 1.000 ! spec=13C_...spin, no=942, id=1895, vol=2.648894e+07 or (segid " A" and resid 68 and name HD12) (segid " A" and resid 123 and name HD11) or (segid " A" and resid 68 and name HD12) (segid " A" and resid 123 and name HD13) or (segid " A" and resid 68 and name HD11) (segid " A" and resid 123 and name HD12) or (segid " A" and resid 68 and name HD11) (segid " A" and resid 123 and name HD11) or (segid " A" and resid 68 and name HD11) (segid " A" and resid 123 and name HD13) or (segid " A" and resid 68 and name HD13) (segid " A" and resid 123 and name HD12) or (segid " A" and resid 68 and name HD13) (segid " A" and resid 123 and name HD11) or (segid " A" and resid 68 and name HD13) (segid " A" and resid 123 and name HD13) assign (segid " A" and resid 68 and name HD22) (segid " A" and resid 111 and name HE1) 4.197 2.202 2.202 weight 1.000 ! spec=13C_...spin, no=947, id=1897, vol=1.411922e+07 or (segid " A" and resid 68 and name HD22) (segid " A" and resid 111 and name HE2) or (segid " A" and resid 68 and name HD21) (segid " A" and resid 111 and name HE1) or (segid " A" and resid 68 and name HD21) (segid " A" and resid 111 and name HE2) or (segid " A" and resid 68 and name HD23) (segid " A" and resid 111 and name HE1) or (segid " A" and resid 68 and name HD23) (segid " A" and resid 111 and name HE2) assign (segid " A" and resid 68 and name HD22) (segid " A" and resid 51 and name HB) 2.923 1.068 1.068 weight 1.000 ! spec=13C_...spin, no=950, id=1900, vol=3.467945e+07 or (segid " A" and resid 68 and name HD21) (segid " A" and resid 51 and name HB) or (segid " A" and resid 68 and name HD23) (segid " A" and resid 51 and name HB) assign (segid " A" and resid 68 and name HB1) (segid " A" and resid 68 and name HD22) 2.067 0.534 0.534 weight 1.000 ! spec=13C_...spin, no=951, id=1901, vol=1.129688e+08 or (segid " A" and resid 68 and name HB1) (segid " A" and resid 68 and name HD21) or (segid " A" and resid 68 and name HB1) (segid " A" and resid 68 and name HD23) assign (segid " A" and resid 67 and name HA) (segid " A" and resid 67 and name HB1) 3.591 1.612 1.612 weight 1.000 ! spec=13C_...spin, no=955, id=1905, vol=1.704202e+07 assign (segid " A" and resid 67 and name HB2) (segid " A" and resid 67 and name HB1) 1.995 0.497 0.497 weight 1.000 ! spec=13C_...spin, no=957, id=1907, vol=1.102900e+08 assign (segid " A" and resid 67 and name HA) (segid " A" and resid 67 and name HB2) 2.968 1.101 1.101 weight 1.000 ! spec=13C_...spin, no=958, id=1908, vol=2.498133e+07 assign (segid " A" and resid 66 and name HB2) (segid " A" and resid 66 and name HB1) 1.849 0.427 0.427 weight 1.000 ! spec=13C_...spin, no=964, id=1911, vol=1.075666e+08 assign (segid " A" and resid 66 and name HA) (segid " A" and resid 66 and name HB1) 2.981 1.111 1.111 weight 1.000 ! spec=13C_...spin, no=969, id=1915, vol=4.789352e+07 assign (segid " A" and resid 66 and name HB1) (segid " A" and resid 66 and name HD22) 2.057 0.529 0.529 weight 1.000 ! spec=13C_...spin, no=983, id=1919, vol=1.136602e+08 or (segid " A" and resid 66 and name HB1) (segid " A" and resid 66 and name HD21) or (segid " A" and resid 66 and name HB1) (segid " A" and resid 66 and name HD23) assign (segid " A" and resid 66 and name HD12) (segid " A" and resid 111 and name HD1) 3.718 1.728 1.728 weight 1.000 ! spec=13C_...spin, no=985, id=1920, vol=1.506511e+07 or (segid " A" and resid 66 and name HD12) (segid " A" and resid 111 and name HD2) or (segid " A" and resid 66 and name HD11) (segid " A" and resid 111 and name HD1) or (segid " A" and resid 66 and name HD11) (segid " A" and resid 111 and name HD2) or (segid " A" and resid 66 and name HD13) (segid " A" and resid 111 and name HD1) or (segid " A" and resid 66 and name HD13) (segid " A" and resid 111 and name HD2) assign (segid " A" and resid 66 and name HD12) (segid " A" and resid 111 and name HA) 3.411 1.455 1.455 weight 1.000 ! spec=13C_...spin, no=986, id=1921, vol=9.610893e+06 or (segid " A" and resid 66 and name HD11) (segid " A" and resid 111 and name HA) or (segid " A" and resid 66 and name HD13) (segid " A" and resid 111 and name HA) assign (segid " A" and resid 66 and name HD12) (segid " A" and resid 66 and name HA) 3.309 1.369 1.369 weight 1.000 ! spec=13C_...spin, no=987, id=1922, vol=1.281352e+07 or (segid " A" and resid 66 and name HD11) (segid " A" and resid 66 and name HA) or (segid " A" and resid 66 and name HD13) (segid " A" and resid 66 and name HA) assign (segid " A" and resid 64 and name HB1) (segid " A" and resid 64 and name HB2) 2.034 0.517 0.517 weight 1.000 ! spec=13C_...spin, no=1002, id=1930, vol=1.008932e+08 assign (segid " A" and resid 64 and name HB2) (segid " A" and resid 64 and name HA) 4.240 2.247 2.247 weight 1.000 ! spec=13C_...spin, no=1003, id=1931, vol=6.754356e+06 assign (segid " A" and resid 64 and name HA) (segid " A" and resid 64 and name HB1) 2.365 0.699 0.699 weight 1.000 ! spec=13C_...spin, no=1004, id=1932, vol=8.959188e+07 assign (segid " A" and resid 64 and name HD2) (segid " A" and resid 119 and name HA) 5.045 3.181 3.181 weight 1.000 ! spec=13C_...spin, no=1005, id=1933, vol=3.779340e+06 assign (segid " A" and resid 64 and name HD2) (segid " A" and resid 64 and name HB2) 3.028 1.146 1.146 weight 1.000 ! spec=13C_...spin, no=1006, id=1934, vol=2.234720e+07 assign (segid " A" and resid 64 and name HD2) (segid " A" and resid 63 and name HB2) 3.564 1.588 1.588 weight 1.000 ! spec=13C_...spin, no=1007, id=1935, vol=2.627281e+07 or (segid " A" and resid 64 and name HD2) (segid " A" and resid 63 and name HB1) or (segid " A" and resid 64 and name HD2) (segid " A" and resid 63 and name HB3) assign (segid " A" and resid 63 and name HA) (segid " A" and resid 63 and name HB2) 1.902 0.452 0.452 weight 1.000 ! spec=13C_...spin, no=1011, id=1939, vol=2.798256e+08 or (segid " A" and resid 63 and name HA) (segid " A" and resid 63 and name HB1) or (segid " A" and resid 63 and name HA) (segid " A" and resid 63 and name HB3) assign (segid " A" and resid 62 and name HA) (segid " A" and resid 62 and name HB2) 4.172 2.176 2.176 weight 1.000 ! spec=13C_...spin, no=1013, id=1941, vol=9.442443e+06 assign (segid " A" and resid 62 and name HB1) (segid " A" and resid 62 and name HB2) 2.126 0.565 0.565 weight 1.000 ! spec=13C_...spin, no=1018, id=1945, vol=6.899938e+07 assign (segid " A" and resid 62 and name HB1) (segid " A" and resid 62 and name HA) 3.252 1.322 1.322 weight 1.000 ! spec=13C_...spin, no=1019, id=1946, vol=1.417283e+07 assign (segid " A" and resid 62 and name HD1) (segid " A" and resid 117 and name HA) 3.394 1.440 1.440 weight 1.000 ! spec=13C_...spin, no=1026, id=1951, vol=4.008890e+07 or (segid " A" and resid 62 and name HD2) (segid " A" and resid 117 and name HA) assign (segid " A" and resid 62 and name HD1) (segid " A" and resid 117 and name HB2) 4.959 3.074 3.074 weight 1.000 ! spec=13C_...spin, no=1034, id=1955, vol=3.950756e+06 or (segid " A" and resid 62 and name HD1) (segid " A" and resid 117 and name HB1) or (segid " A" and resid 62 and name HD1) (segid " A" and resid 117 and name HB3) or (segid " A" and resid 62 and name HD2) (segid " A" and resid 117 and name HB2) or (segid " A" and resid 62 and name HD2) (segid " A" and resid 117 and name HB1) or (segid " A" and resid 62 and name HD2) (segid " A" and resid 117 and name HB3) assign (segid " A" and resid 61 and name HA2) (segid " A" and resid 61 and name HA1) 1.903 0.453 0.453 weight 1.000 ! spec=13C_...spin, no=1037, id=1956, vol=2.031414e+08 assign (segid " A" and resid 60 and name HB1) (segid " A" and resid 60 and name HG1) 1.668 0.348 4.332 weight 1.000 ! spec=13C_...spin, no=1041, id=1960, vol=9.339794e+08 assign (segid " A" and resid 60 and name HB2) (segid " A" and resid 60 and name HG1) 2.127 0.565 0.565 weight 1.000 ! spec=13C_...spin, no=1042, id=1961, vol=1.713814e+08 assign (segid " A" and resid 60 and name HA) (segid " A" and resid 60 and name HB1) 3.018 1.138 1.138 weight 1.000 ! spec=13C_...spin, no=1045, id=1964, vol=2.508325e+07 assign (segid " A" and resid 60 and name HA) (segid " A" and resid 60 and name HB2) 2.976 1.107 1.107 weight 1.000 ! spec=13C_...spin, no=1046, id=1965, vol=3.791798e+07 assign (segid " A" and resid 38 and name HA) (segid " A" and resid 38 and name HG22) 2.359 0.696 0.696 weight 1.000 ! spec=13C_...spin, no=1053, id=1969, vol=7.572089e+07 or (segid " A" and resid 38 and name HA) (segid " A" and resid 38 and name HG21) or (segid " A" and resid 38 and name HA) (segid " A" and resid 38 and name HG23) assign (segid " A" and resid 38 and name HB) (segid " A" and resid 38 and name HG22) 1.983 0.491 0.491 weight 1.000 ! spec=13C_...spin, no=1055, id=1971, vol=9.593534e+07 or (segid " A" and resid 38 and name HB) (segid " A" and resid 38 and name HG21) or (segid " A" and resid 38 and name HB) (segid " A" and resid 38 and name HG23) assign (segid " A" and resid 58 and name HE1) (segid " A" and resid 58 and name HD2) 4.422 2.445 2.445 weight 1.000 ! spec=13C_...spin, no=1064, id=1978, vol=1.238510e+07 assign (segid " A" and resid 56 and name HA) (segid " A" and resid 56 and name HB2) 1.673 0.350 4.327 weight 1.000 ! spec=13C_...spin, no=1071, id=1984, vol=5.593786e+08 or (segid " A" and resid 56 and name HA) (segid " A" and resid 56 and name HB1) or (segid " A" and resid 56 and name HA) (segid " A" and resid 56 and name HB3) assign (segid " A" and resid 54 and name HA) (segid " A" and resid 54 and name HB1) 2.533 0.802 0.802 weight 1.000 ! spec=13C_...spin, no=1076, id=1989, vol=6.154080e+07 assign (segid " A" and resid 54 and name HB2) (segid " A" and resid 54 and name HB1) 2.026 0.513 0.513 weight 1.000 ! spec=13C_...spin, no=1078, id=1991, vol=8.835902e+07 assign (segid " A" and resid 54 and name HA) (segid " A" and resid 54 and name HB2) 3.481 1.515 1.515 weight 1.000 ! spec=13C_...spin, no=1082, id=1995, vol=2.605466e+07 assign (segid " A" and resid 53 and name HA) (segid " A" and resid 33 and name HA) 2.330 0.678 0.678 weight 1.000 ! spec=13C_...spin, no=1087, id=2000, vol=1.141428e+08 assign (segid " A" and resid 52 and name HA) (segid " A" and resid 52 and name HB) 3.386 1.433 1.433 weight 1.000 ! spec=13C_...spin, no=1103, id=2006, vol=1.244940e+07 assign (segid " A" and resid 52 and name HB) (segid " A" and resid 51 and name HA) 5.246 3.440 3.440 weight 1.000 ! spec=13C_...spin, no=1104, id=2007, vol=6.000571e+06 assign (segid " A" and resid 52 and name HB) (segid " A" and resid 52 and name HG22) 1.846 0.426 0.426 weight 1.000 ! spec=13C_...spin, no=1105, id=2008, vol=2.199057e+08 or (segid " A" and resid 52 and name HB) (segid " A" and resid 52 and name HG21) or (segid " A" and resid 52 and name HB) (segid " A" and resid 52 and name HG23) assign (segid " A" and resid 52 and name HA) (segid " A" and resid 52 and name HG22) 2.729 0.931 0.931 weight 1.000 ! spec=13C_...spin, no=1107, id=2009, vol=2.965509e+07 or (segid " A" and resid 52 and name HA) (segid " A" and resid 52 and name HG21) or (segid " A" and resid 52 and name HA) (segid " A" and resid 52 and name HG23) assign (segid " A" and resid 67 and name HA) (segid " A" and resid 52 and name HG22) 2.881 1.038 1.038 weight 1.000 ! spec=13C_...spin, no=1108, id=2010, vol=2.905169e+07 or (segid " A" and resid 67 and name HA) (segid " A" and resid 52 and name HG21) or (segid " A" and resid 67 and name HA) (segid " A" and resid 52 and name HG23) assign (segid " A" and resid 52 and name HA) (segid " A" and resid 52 and name HG12) 3.132 1.226 1.226 weight 1.000 ! spec=13C_...spin, no=1111, id=2011, vol=1.468245e+07 or (segid " A" and resid 52 and name HA) (segid " A" and resid 52 and name HG11) or (segid " A" and resid 52 and name HA) (segid " A" and resid 52 and name HG13) assign (segid " A" and resid 67 and name HA) (segid " A" and resid 52 and name HG12) 4.120 2.122 2.122 weight 1.000 ! spec=13C_...spin, no=1112, id=2012, vol=5.960869e+06 or (segid " A" and resid 67 and name HA) (segid " A" and resid 52 and name HG11) or (segid " A" and resid 67 and name HA) (segid " A" and resid 52 and name HG13) assign (segid " A" and resid 51 and name HG12) (segid " A" and resid 51 and name HA) 2.663 0.886 0.886 weight 1.000 ! spec=13C_...spin, no=1117, id=2014, vol=2.845632e+07 assign (segid " A" and resid 68 and name HB2) (segid " A" and resid 51 and name HB) 3.528 1.556 1.556 weight 1.000 ! spec=13C_...spin, no=1120, id=2017, vol=4.639577e+07 assign (segid " A" and resid 51 and name HG12) (segid " A" and resid 51 and name HB) 4.660 2.714 2.714 weight 1.000 ! spec=13C_...spin, no=1125, id=2019, vol=2.226599e+06 assign (segid " A" and resid 111 and name HE1) (segid " A" and resid 51 and name HG22) 3.391 1.437 1.437 weight 1.000 ! spec=13C_...spin, no=1128, id=2021, vol=8.460429e+06 or (segid " A" and resid 111 and name HE1) (segid " A" and resid 51 and name HG21) or (segid " A" and resid 111 and name HE1) (segid " A" and resid 51 and name HG23) or (segid " A" and resid 111 and name HE2) (segid " A" and resid 51 and name HG22) or (segid " A" and resid 111 and name HE2) (segid " A" and resid 51 and name HG21) or (segid " A" and resid 111 and name HE2) (segid " A" and resid 51 and name HG23) assign (segid " A" and resid 51 and name HB) (segid " A" and resid 51 and name HG22) 2.513 0.790 0.790 weight 1.000 ! spec=13C_...spin, no=1131, id=2024, vol=2.913406e+07 or (segid " A" and resid 51 and name HB) (segid " A" and resid 51 and name HG21) or (segid " A" and resid 51 and name HB) (segid " A" and resid 51 and name HG23) assign (segid " A" and resid 51 and name HG22) (segid " A" and resid 53 and name HB2) 2.154 0.580 3.846 weight 1.000 ! spec=13C_...spin, no=1132, id=2025, vol=4.812461e+07 or (segid " A" and resid 51 and name HG22) (segid " A" and resid 53 and name HB1) or (segid " A" and resid 51 and name HG22) (segid " A" and resid 53 and name HB3) or (segid " A" and resid 51 and name HG21) (segid " A" and resid 53 and name HB2) or (segid " A" and resid 51 and name HG21) (segid " A" and resid 53 and name HB1) or (segid " A" and resid 51 and name HG21) (segid " A" and resid 53 and name HB3) or (segid " A" and resid 51 and name HG23) (segid " A" and resid 53 and name HB2) or (segid " A" and resid 51 and name HG23) (segid " A" and resid 53 and name HB1) or (segid " A" and resid 51 and name HG23) (segid " A" and resid 53 and name HB3) assign (segid " A" and resid 51 and name HG12) (segid " A" and resid 51 and name HG22) 1.908 0.455 0.455 weight 1.000 ! spec=13C_...spin, no=1133, id=2026, vol=1.491670e+08 or (segid " A" and resid 51 and name HG12) (segid " A" and resid 51 and name HG21) or (segid " A" and resid 51 and name HG12) (segid " A" and resid 51 and name HG23) assign (segid " A" and resid 69 and name HA) (segid " A" and resid 50 and name HA) 2.437 0.742 0.742 weight 1.000 ! spec=13C_...spin, no=1134, id=2027, vol=7.857629e+07 assign (segid " A" and resid 50 and name HA) (segid " A" and resid 51 and name HG11) 3.201 1.281 1.281 weight 1.000 ! spec=13C_...spin, no=1139, id=2030, vol=1.973351e+07 assign (segid " A" and resid 50 and name HA) (segid " A" and resid 69 and name HB2) 4.846 2.935 2.935 weight 1.000 ! spec=13C_...spin, no=1140, id=2031, vol=5.454292e+06 or (segid " A" and resid 50 and name HA) (segid " A" and resid 69 and name HB1) or (segid " A" and resid 50 and name HA) (segid " A" and resid 69 and name HB3) assign (segid " A" and resid 49 and name HA) (segid " A" and resid 49 and name HB) 4.193 2.198 2.198 weight 1.000 ! spec=13C_...spin, no=1145, id=2035, vol=2.359543e+06 assign (segid " A" and resid 49 and name HB) (segid " A" and resid 49 and name HG22) 2.683 0.900 0.900 weight 1.000 ! spec=13C_...spin, no=1150, id=2039, vol=2.056136e+07 or (segid " A" and resid 49 and name HB) (segid " A" and resid 49 and name HG21) or (segid " A" and resid 49 and name HB) (segid " A" and resid 49 and name HG23) assign (segid " A" and resid 49 and name HA) (segid " A" and resid 49 and name HG22) 2.203 0.606 0.606 weight 1.000 ! spec=13C_...spin, no=1153, id=2042, vol=1.110506e+08 or (segid " A" and resid 49 and name HA) (segid " A" and resid 49 and name HG21) or (segid " A" and resid 49 and name HA) (segid " A" and resid 49 and name HG23) assign (segid " A" and resid 49 and name HG22) (segid " A" and resid 22 and name HA) 3.050 1.163 1.163 weight 1.000 ! spec=13C_...spin, no=1155, id=2043, vol=1.541283e+07 or (segid " A" and resid 49 and name HG21) (segid " A" and resid 22 and name HA) or (segid " A" and resid 49 and name HG23) (segid " A" and resid 22 and name HA) assign (segid " A" and resid 49 and name HG22) (segid " A" and resid 49 and name HG12) 1.701 0.361 0.361 weight 1.000 ! spec=13C_...spin, no=1158, id=2045, vol=1.739448e+08 or (segid " A" and resid 49 and name HG22) (segid " A" and resid 49 and name HG11) or (segid " A" and resid 49 and name HG22) (segid " A" and resid 49 and name HG13) or (segid " A" and resid 49 and name HG21) (segid " A" and resid 49 and name HG12) or (segid " A" and resid 49 and name HG21) (segid " A" and resid 49 and name HG11) or (segid " A" and resid 49 and name HG21) (segid " A" and resid 49 and name HG13) or (segid " A" and resid 49 and name HG23) (segid " A" and resid 49 and name HG12) or (segid " A" and resid 49 and name HG23) (segid " A" and resid 49 and name HG11) or (segid " A" and resid 49 and name HG23) (segid " A" and resid 49 and name HG13) assign (segid " A" and resid 49 and name HA) (segid " A" and resid 49 and name HG12) 3.381 1.429 1.429 weight 1.000 ! spec=13C_...spin, no=1159, id=2046, vol=1.788690e+07 or (segid " A" and resid 49 and name HA) (segid " A" and resid 49 and name HG11) or (segid " A" and resid 49 and name HA) (segid " A" and resid 49 and name HG13) assign (segid " A" and resid 49 and name HB) (segid " A" and resid 49 and name HG12) 2.745 0.942 0.942 weight 1.000 ! spec=13C_...spin, no=1160, id=2047, vol=1.714687e+07 or (segid " A" and resid 49 and name HB) (segid " A" and resid 49 and name HG11) or (segid " A" and resid 49 and name HB) (segid " A" and resid 49 and name HG13) assign (segid " A" and resid 49 and name HG12) (segid " A" and resid 70 and name HB1) 2.873 1.032 1.032 weight 1.000 ! spec=13C_...spin, no=1162, id=2049, vol=7.753122e+07 or (segid " A" and resid 49 and name HG11) (segid " A" and resid 70 and name HB1) or (segid " A" and resid 49 and name HG13) (segid " A" and resid 70 and name HB1) assign (segid " A" and resid 48 and name HA) (segid " A" and resid 70 and name HB2) 4.876 2.972 2.972 weight 1.000 ! spec=13C_...spin, no=1169, id=2053, vol=4.076330e+06 assign (segid " A" and resid 71 and name HG21) (segid " A" and resid 48 and name HA) 4.072 2.073 2.073 weight 1.000 ! spec=13C_...spin, no=1170, id=2054, vol=1.589193e+07 or (segid " A" and resid 71 and name HG22) (segid " A" and resid 48 and name HA) or (segid " A" and resid 71 and name HG23) (segid " A" and resid 48 and name HA) assign (segid " A" and resid 47 and name HA) (segid " A" and resid 47 and name HG21) 2.946 1.085 1.085 weight 1.000 ! spec=13C_...spin, no=1174, id=2057, vol=2.479225e+07 or (segid " A" and resid 47 and name HA) (segid " A" and resid 47 and name HG22) or (segid " A" and resid 47 and name HA) (segid " A" and resid 47 and name HG23) assign (segid " A" and resid 47 and name HB) (segid " A" and resid 47 and name HG21) 2.698 0.910 0.910 weight 1.000 ! spec=13C_...spin, no=1177, id=2058, vol=2.901228e+07 or (segid " A" and resid 47 and name HB) (segid " A" and resid 47 and name HG22) or (segid " A" and resid 47 and name HB) (segid " A" and resid 47 and name HG23) assign (segid " A" and resid 47 and name HG21) (segid " A" and resid 18 and name HB2) 1.491 0.278 4.509 weight 1.000 ! spec=13C_...spin, no=1183, id=2062, vol=2.620271e+08 or (segid " A" and resid 47 and name HG21) (segid " A" and resid 18 and name HB1) or (segid " A" and resid 47 and name HG21) (segid " A" and resid 18 and name HB3) or (segid " A" and resid 47 and name HG22) (segid " A" and resid 18 and name HB2) or (segid " A" and resid 47 and name HG22) (segid " A" and resid 18 and name HB1) or (segid " A" and resid 47 and name HG22) (segid " A" and resid 18 and name HB3) or (segid " A" and resid 47 and name HG23) (segid " A" and resid 18 and name HB2) or (segid " A" and resid 47 and name HG23) (segid " A" and resid 18 and name HB1) or (segid " A" and resid 47 and name HG23) (segid " A" and resid 18 and name HB3) assign (segid " A" and resid 47 and name HG21) (segid " A" and resid 37 and name HG12) 1.502 0.282 4.498 weight 1.000 ! spec=13C_...spin, no=1188, id=2064, vol=1.534252e+08 or (segid " A" and resid 47 and name HG21) (segid " A" and resid 37 and name HG11) or (segid " A" and resid 47 and name HG21) (segid " A" and resid 37 and name HG13) or (segid " A" and resid 47 and name HG22) (segid " A" and resid 37 and name HG12) or (segid " A" and resid 47 and name HG22) (segid " A" and resid 37 and name HG11) or (segid " A" and resid 47 and name HG22) (segid " A" and resid 37 and name HG13) or (segid " A" and resid 47 and name HG23) (segid " A" and resid 37 and name HG12) or (segid " A" and resid 47 and name HG23) (segid " A" and resid 37 and name HG11) or (segid " A" and resid 47 and name HG23) (segid " A" and resid 37 and name HG13) assign (segid " A" and resid 46 and name HA) (segid " A" and resid 46 and name HB1) 3.404 1.448 1.448 weight 1.000 ! spec=13C_...spin, no=1189, id=2065, vol=9.871935e+06 assign (segid " A" and resid 46 and name HA) (segid " A" and resid 46 and name HG2) 5.369 3.604 3.604 weight 1.000 ! spec=13C_...spin, no=1192, id=2067, vol=4.321026e+06 assign (segid " A" and resid 40 and name HD1) (segid " A" and resid 40 and name HA) 3.151 1.241 1.241 weight 1.000 ! spec=13C_...spin, no=1199, id=2070, vol=6.770986e+07 or (segid " A" and resid 40 and name HD2) (segid " A" and resid 40 and name HA) assign (segid " A" and resid 46 and name HB1) (segid " A" and resid 46 and name HB2) 2.372 0.703 0.703 weight 1.000 ! spec=13C_...spin, no=1204, id=2074, vol=3.861708e+07 assign (segid " A" and resid 46 and name HB1) (segid " A" and resid 71 and name HG21) 6.175 4.767 4.767 weight 1.000 ! spec=13C_...spin, no=1205, id=2075, vol=1.203691e+06 or (segid " A" and resid 46 and name HB1) (segid " A" and resid 71 and name HG22) or (segid " A" and resid 46 and name HB1) (segid " A" and resid 71 and name HG23) assign (segid " A" and resid 46 and name HB2) (segid " A" and resid 71 and name HG21) 3.752 1.759 1.759 weight 1.000 ! spec=13C_...spin, no=1208, id=2076, vol=8.138876e+06 or (segid " A" and resid 46 and name HB2) (segid " A" and resid 71 and name HG22) or (segid " A" and resid 46 and name HB2) (segid " A" and resid 71 and name HG23) assign (segid " A" and resid 46 and name HB1) (segid " A" and resid 46 and name HG2) 2.981 1.111 1.111 weight 1.000 ! spec=13C_...spin, no=1210, id=2078, vol=6.644294e+07 assign (segid " A" and resid 46 and name HA) (segid " A" and resid 46 and name HB2) 3.210 1.288 1.288 weight 1.000 ! spec=13C_...spin, no=1212, id=2080, vol=3.699976e+07 assign (segid " A" and resid 46 and name HB1) (segid " A" and resid 46 and name HG1) 2.874 1.033 1.033 weight 1.000 ! spec=13C_...spin, no=1214, id=2081, vol=2.616563e+07 assign (segid " A" and resid 43 and name HA) (segid " A" and resid 43 and name HE1) 5.210 3.393 3.393 weight 1.000 ! spec=13C_...spin, no=1221, id=2084, vol=4.786680e+06 assign (segid " A" and resid 43 and name HB2) (segid " A" and resid 43 and name HB1) 2.005 0.503 0.503 weight 1.000 ! spec=13C_...spin, no=1224, id=2086, vol=1.395481e+08 assign (segid " A" and resid 43 and name HB2) (segid " A" and resid 43 and name HA) 3.799 1.804 1.804 weight 1.000 ! spec=13C_...spin, no=1225, id=2087, vol=1.096430e+07 assign (segid " A" and resid 43 and name HA) (segid " A" and resid 43 and name HB1) 3.861 1.864 1.864 weight 1.000 ! spec=13C_...spin, no=1226, id=2088, vol=6.523368e+06 assign (segid " A" and resid 42 and name HA1) (segid " A" and resid 42 and name HA2) 2.026 0.513 0.513 weight 1.000 ! spec=13C_...spin, no=1235, id=2092, vol=1.390924e+08 assign (segid " A" and resid 45 and name HD2) (segid " A" and resid 45 and name HE1) 4.480 2.509 2.509 weight 1.000 ! spec=13C_...spin, no=1240, id=2096, vol=1.056532e+07 assign (segid " A" and resid 45 and name HD2) (segid " A" and resid 45 and name HA) 5.317 3.534 3.534 weight 1.000 ! spec=13C_...spin, no=1242, id=2097, vol=2.241768e+06 assign (segid " A" and resid 45 and name HB2) (segid " A" and resid 45 and name HD2) 3.771 1.778 1.778 weight 1.000 ! spec=13C_...spin, no=1243, id=2098, vol=8.244607e+06 assign (segid " A" and resid 44 and name HA1) (segid " A" and resid 44 and name HA2) 1.487 0.277 0.277 weight 1.000 ! spec=13C_...spin, no=1246, id=2100, vol=8.694051e+08 assign (segid " A" and resid 41 and name HA2) (segid " A" and resid 41 and name HA1) 2.403 0.722 0.722 weight 1.000 ! spec=13C_...spin, no=1249, id=2101, vol=5.043556e+07 assign (segid " A" and resid 40 and name HA) (segid " A" and resid 40 and name HB2) 2.976 1.107 1.107 weight 1.000 ! spec=13C_...spin, no=1251, id=2103, vol=2.601325e+07 assign (segid " A" and resid 40 and name HB2) (segid " A" and resid 40 and name HB1) 2.451 0.751 0.751 weight 1.000 ! spec=13C_...spin, no=1258, id=2108, vol=3.790406e+07 assign (segid " A" and resid 40 and name HA) (segid " A" and resid 40 and name HB1) 2.978 1.108 1.108 weight 1.000 ! spec=13C_...spin, no=1260, id=2109, vol=6.364812e+07 assign (segid " A" and resid 38 and name HB) (segid " A" and resid 38 and name HG12) 1.517 0.288 4.483 weight 1.000 ! spec=13C_...spin, no=1275, id=2117, vol=4.494064e+08 or (segid " A" and resid 38 and name HB) (segid " A" and resid 38 and name HG11) or (segid " A" and resid 38 and name HB) (segid " A" and resid 38 and name HG13) assign (segid " A" and resid 38 and name HG22) (segid " A" and resid 38 and name HG12) 1.487 0.276 4.513 weight 1.000 ! spec=13C_...spin, no=1277, id=2119, vol=4.040397e+08 or (segid " A" and resid 38 and name HG22) (segid " A" and resid 38 and name HG11) or (segid " A" and resid 38 and name HG22) (segid " A" and resid 38 and name HG13) or (segid " A" and resid 38 and name HG21) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 38 and name HG21) (segid " A" and resid 38 and name HG11) or (segid " A" and resid 38 and name HG21) (segid " A" and resid 38 and name HG13) or (segid " A" and resid 38 and name HG23) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 38 and name HG23) (segid " A" and resid 38 and name HG11) or (segid " A" and resid 38 and name HG23) (segid " A" and resid 38 and name HG13) assign (segid " A" and resid 38 and name HA) (segid " A" and resid 38 and name HG12) 2.441 0.745 0.745 weight 1.000 ! spec=13C_...spin, no=1279, id=2121, vol=6.428747e+07 or (segid " A" and resid 38 and name HA) (segid " A" and resid 38 and name HG11) or (segid " A" and resid 38 and name HA) (segid " A" and resid 38 and name HG13) assign (segid " A" and resid 37 and name HG22) (segid " A" and resid 22 and name HB2) 1.495 0.279 4.505 weight 1.000 ! spec=13C_...spin, no=1284, id=2126, vol=1.175803e+08 or (segid " A" and resid 37 and name HG22) (segid " A" and resid 22 and name HB1) or (segid " A" and resid 37 and name HG22) (segid " A" and resid 22 and name HB3) or (segid " A" and resid 37 and name HG21) (segid " A" and resid 22 and name HB2) or (segid " A" and resid 37 and name HG21) (segid " A" and resid 22 and name HB1) or (segid " A" and resid 37 and name HG21) (segid " A" and resid 22 and name HB3) or (segid " A" and resid 37 and name HG23) (segid " A" and resid 22 and name HB2) or (segid " A" and resid 37 and name HG23) (segid " A" and resid 22 and name HB1) or (segid " A" and resid 37 and name HG23) (segid " A" and resid 22 and name HB3) assign (segid " A" and resid 37 and name HB) (segid " A" and resid 37 and name HG22) 1.997 0.498 0.498 weight 1.000 ! spec=13C_...spin, no=1285, id=2127, vol=1.402527e+08 or (segid " A" and resid 37 and name HB) (segid " A" and resid 37 and name HG21) or (segid " A" and resid 37 and name HB) (segid " A" and resid 37 and name HG23) assign (segid " A" and resid 37 and name HG22) (segid " A" and resid 19 and name HA) 2.566 0.823 0.823 weight 1.000 ! spec=13C_...spin, no=1286, id=2128, vol=4.565569e+07 or (segid " A" and resid 37 and name HG21) (segid " A" and resid 19 and name HA) or (segid " A" and resid 37 and name HG23) (segid " A" and resid 19 and name HA) assign (segid " A" and resid 37 and name HA) (segid " A" and resid 37 and name HG22) 2.572 0.827 0.827 weight 1.000 ! spec=13C_...spin, no=1287, id=2129, vol=3.637146e+07 or (segid " A" and resid 37 and name HA) (segid " A" and resid 37 and name HG21) or (segid " A" and resid 37 and name HA) (segid " A" and resid 37 and name HG23) assign (segid " A" and resid 36 and name HA) (segid " A" and resid 36 and name HB1) 3.450 1.488 1.488 weight 1.000 ! spec=13C_...spin, no=1289, id=2131, vol=2.312704e+07 assign (segid " A" and resid 36 and name HA) (segid " A" and resid 36 and name HB2) 3.303 1.364 1.364 weight 1.000 ! spec=13C_...spin, no=1290, id=2132, vol=1.692222e+07 assign (segid " A" and resid 35 and name HB) (segid " A" and resid 22 and name HA) 3.621 1.639 1.639 weight 1.000 ! spec=13C_...spin, no=1293, id=2134, vol=9.375056e+06 assign (segid " A" and resid 35 and name HB) (segid " A" and resid 22 and name HB2) 2.912 1.060 1.060 weight 1.000 ! spec=13C_...spin, no=1294, id=2135, vol=2.268504e+07 or (segid " A" and resid 35 and name HB) (segid " A" and resid 22 and name HB1) or (segid " A" and resid 35 and name HB) (segid " A" and resid 22 and name HB3) assign (segid " A" and resid 35 and name HB) (segid " A" and resid 35 and name HG21) 2.528 0.799 0.799 weight 1.000 ! spec=13C_...spin, no=1295, id=2136, vol=3.500616e+07 or (segid " A" and resid 35 and name HB) (segid " A" and resid 35 and name HG22) or (segid " A" and resid 35 and name HB) (segid " A" and resid 35 and name HG23) assign (segid " A" and resid 35 and name HG21) (segid " A" and resid 34 and name HA) 2.828 1.000 1.000 weight 1.000 ! spec=13C_...spin, no=1297, id=2137, vol=1.131546e+08 or (segid " A" and resid 35 and name HG22) (segid " A" and resid 34 and name HA) or (segid " A" and resid 35 and name HG23) (segid " A" and resid 34 and name HA) assign (segid " A" and resid 34 and name HA) (segid " A" and resid 34 and name HB2) 3.386 1.433 1.433 weight 1.000 ! spec=13C_...spin, no=1300, id=2140, vol=1.224666e+07 assign (segid " A" and resid 34 and name HA) (segid " A" and resid 34 and name HB1) 3.983 1.983 1.983 weight 1.000 ! spec=13C_...spin, no=1301, id=2141, vol=1.171689e+07 assign (segid " A" and resid 33 and name HA) (segid " A" and resid 53 and name HB2) 3.802 1.807 1.807 weight 1.000 ! spec=13C_...spin, no=1313, id=2144, vol=9.215773e+06 or (segid " A" and resid 33 and name HA) (segid " A" and resid 53 and name HB1) or (segid " A" and resid 33 and name HA) (segid " A" and resid 53 and name HB3) assign (segid " A" and resid 32 and name HB1) (segid " A" and resid 32 and name HA) 3.245 1.317 1.317 weight 1.000 ! spec=13C_...spin, no=1321, id=2148, vol=1.734382e+07 assign (segid " A" and resid 32 and name HA) (segid " A" and resid 32 and name HB2) 3.110 1.209 1.209 weight 1.000 ! spec=13C_...spin, no=1322, id=2149, vol=4.783888e+07 assign (segid " A" and resid 32 and name HG2) (segid " A" and resid 32 and name HA) 2.760 0.952 0.952 weight 1.000 ! spec=13C_...spin, no=1328, id=2152, vol=4.604427e+07 assign (segid " A" and resid 32 and name HG1) (segid " A" and resid 32 and name HA) 4.143 2.146 2.146 weight 1.000 ! spec=13C_...spin, no=1329, id=2153, vol=1.459682e+07 assign (segid " A" and resid 31 and name HA) (segid " A" and resid 32 and name HA) 3.750 1.758 1.758 weight 1.000 ! spec=13C_...spin, no=1335, id=2155, vol=1.463013e+07 assign (segid " A" and resid 31 and name HA) (segid " A" and resid 31 and name HB2) 3.547 1.573 1.573 weight 1.000 ! spec=13C_...spin, no=1337, id=2157, vol=2.520808e+07 assign (segid " A" and resid 31 and name HB2) (segid " A" and resid 27 and name HA) 5.205 3.387 3.387 weight 1.000 ! spec=13C_...spin, no=1339, id=2158, vol=2.871786e+06 assign (segid " A" and resid 31 and name HA) (segid " A" and resid 31 and name HB1) 2.890 1.044 1.044 weight 1.000 ! spec=13C_...spin, no=1341, id=2160, vol=3.353067e+07 assign (segid " A" and resid 31 and name HB2) (segid " A" and resid 31 and name HB1) 1.748 0.382 0.382 weight 1.000 ! spec=13C_...spin, no=1343, id=2162, vol=3.361199e+08 assign (segid " A" and resid 31 and name HD2) (segid " A" and resid 31 and name HA) 3.685 1.698 1.698 weight 1.000 ! spec=13C_...spin, no=1345, id=2164, vol=1.639637e+07 assign (segid " A" and resid 31 and name HE1) (segid " A" and resid 27 and name HA) 4.813 2.895 2.895 weight 1.000 ! spec=13C_...spin, no=1348, id=2167, vol=3.877456e+06 assign (segid " A" and resid 30 and name HA) (segid " A" and resid 31 and name HD2) 4.061 2.062 2.062 weight 1.000 ! spec=13C_...spin, no=1349, id=2168, vol=6.627273e+06 assign (segid " A" and resid 30 and name HB2) (segid " A" and resid 30 and name HB1) 1.558 0.303 0.303 weight 1.000 ! spec=13C_...spin, no=1354, id=2171, vol=5.752214e+08 assign (segid " A" and resid 30 and name HB2) (segid " A" and resid 32 and name HG1) 3.379 1.427 1.427 weight 1.000 ! spec=13C_...spin, no=1359, id=2173, vol=1.299106e+07 assign (segid " A" and resid 30 and name HB1) (segid " A" and resid 32 and name HG2) 5.068 3.211 3.211 weight 1.000 ! spec=13C_...spin, no=1362, id=2174, vol=4.560367e+06 assign (segid " A" and resid 30 and name HA) (segid " A" and resid 30 and name HB2) 3.653 1.668 1.668 weight 1.000 ! spec=13C_...spin, no=1364, id=2176, vol=2.129995e+07 assign (segid " A" and resid 29 and name HA) (segid " A" and resid 29 and name HG) 2.893 1.046 1.046 weight 1.000 ! spec=13C_...spin, no=1365, id=2177, vol=3.972049e+07 assign (segid " A" and resid 29 and name HB2) (segid " A" and resid 29 and name HG) 1.988 0.494 0.494 weight 1.000 ! spec=13C_...spin, no=1366, id=2178, vol=1.793328e+08 assign (segid " A" and resid 29 and name HA) (segid " A" and resid 29 and name HB1) 3.850 1.853 1.853 weight 1.000 ! spec=13C_...spin, no=1368, id=2180, vol=4.405790e+06 assign (segid " A" and resid 29 and name HA) (segid " A" and resid 29 and name HB2) 4.303 2.314 2.314 weight 1.000 ! spec=13C_...spin, no=1369, id=2181, vol=6.285218e+06 assign (segid " A" and resid 29 and name HB1) (segid " A" and resid 29 and name HG) 2.549 0.812 0.812 weight 1.000 ! spec=13C_...spin, no=1374, id=2183, vol=9.133125e+07 assign (segid " A" and resid 29 and name HD22) (segid " A" and resid 29 and name HA) 2.915 1.062 1.062 weight 1.000 ! spec=13C_...spin, no=1375, id=2184, vol=3.421088e+07 or (segid " A" and resid 29 and name HD21) (segid " A" and resid 29 and name HA) or (segid " A" and resid 29 and name HD23) (segid " A" and resid 29 and name HA) assign (segid " A" and resid 28 and name HB2) (segid " A" and resid 28 and name HA) 3.133 1.227 1.227 weight 1.000 ! spec=13C_...spin, no=1380, id=2187, vol=2.078098e+07 assign (segid " A" and resid 28 and name HB1) (segid " A" and resid 28 and name HA) 3.672 1.685 1.685 weight 1.000 ! spec=13C_...spin, no=1381, id=2188, vol=1.109728e+07 assign (segid " A" and resid 28 and name HB2) (segid " A" and resid 28 and name HB1) 1.637 0.335 0.335 weight 1.000 ! spec=13C_...spin, no=1383, id=2190, vol=2.624936e+08 assign (segid " A" and resid 28 and name HB2) (segid " A" and resid 28 and name HD12) 2.332 0.680 0.680 weight 1.000 ! spec=13C_...spin, no=1384, id=2191, vol=7.188208e+07 or (segid " A" and resid 28 and name HB2) (segid " A" and resid 28 and name HD11) or (segid " A" and resid 28 and name HB2) (segid " A" and resid 28 and name HD13) assign (segid " A" and resid 28 and name HB1) (segid " A" and resid 28 and name HD22) 2.508 0.786 0.786 weight 1.000 ! spec=13C_...spin, no=1386, id=2192, vol=4.628473e+07 or (segid " A" and resid 28 and name HB1) (segid " A" and resid 28 and name HD21) or (segid " A" and resid 28 and name HB1) (segid " A" and resid 28 and name HD23) assign (segid " A" and resid 28 and name HG) (segid " A" and resid 28 and name HD12) 2.071 0.536 0.536 weight 1.000 ! spec=13C_...spin, no=1387, id=2193, vol=9.668711e+07 or (segid " A" and resid 28 and name HG) (segid " A" and resid 28 and name HD11) or (segid " A" and resid 28 and name HG) (segid " A" and resid 28 and name HD13) assign (segid " A" and resid 28 and name HG) (segid " A" and resid 28 and name HD22) 2.942 1.082 1.082 weight 1.000 ! spec=13C_...spin, no=1388, id=2194, vol=1.175801e+07 or (segid " A" and resid 28 and name HG) (segid " A" and resid 28 and name HD21) or (segid " A" and resid 28 and name HG) (segid " A" and resid 28 and name HD23) assign (segid " A" and resid 28 and name HG) (segid " A" and resid 28 and name HA) 3.472 1.507 1.507 weight 1.000 ! spec=13C_...spin, no=1389, id=2195, vol=1.509179e+07 assign (segid " A" and resid 28 and name HA) (segid " A" and resid 28 and name HD12) 2.848 1.014 1.014 weight 1.000 ! spec=13C_...spin, no=1395, id=2198, vol=3.514347e+07 or (segid " A" and resid 28 and name HA) (segid " A" and resid 28 and name HD11) or (segid " A" and resid 28 and name HA) (segid " A" and resid 28 and name HD13) assign (segid " A" and resid 31 and name HD2) (segid " A" and resid 27 and name HA) 4.127 2.129 2.129 weight 1.000 ! spec=13C_...spin, no=1397, id=2200, vol=7.482690e+06 assign (segid " A" and resid 27 and name HB1) (segid " A" and resid 27 and name HB2) 1.535 0.294 0.294 weight 1.000 ! spec=13C_...spin, no=1401, id=2203, vol=6.292728e+08 assign (segid " A" and resid 27 and name HA) (segid " A" and resid 27 and name HB1) 3.512 1.542 1.542 weight 1.000 ! spec=13C_...spin, no=1402, id=2204, vol=3.192180e+07 assign (segid " A" and resid 27 and name HA) (segid " A" and resid 27 and name HB2) 2.510 0.787 0.787 weight 1.000 ! spec=13C_...spin, no=1405, id=2205, vol=8.797142e+07 assign (segid " A" and resid 26 and name HA) (segid " A" and resid 26 and name HB2) 2.058 0.529 0.529 weight 1.000 ! spec=13C_...spin, no=1406, id=2206, vol=1.537312e+08 or (segid " A" and resid 26 and name HA) (segid " A" and resid 26 and name HB1) or (segid " A" and resid 26 and name HA) (segid " A" and resid 26 and name HB3) assign (segid " A" and resid 25 and name HA) (segid " A" and resid 24 and name HB2) 3.027 1.145 1.145 weight 1.000 ! spec=13C_...spin, no=1410, id=2209, vol=3.543078e+07 or (segid " A" and resid 25 and name HA) (segid " A" and resid 24 and name HB1) or (segid " A" and resid 25 and name HA) (segid " A" and resid 24 and name HB3) assign (segid " A" and resid 25 and name HG22) (segid " A" and resid 25 and name HA) 2.416 0.730 0.730 weight 1.000 ! spec=13C_...spin, no=1412, id=2211, vol=6.973320e+07 or (segid " A" and resid 25 and name HG21) (segid " A" and resid 25 and name HA) or (segid " A" and resid 25 and name HG23) (segid " A" and resid 25 and name HA) assign (segid " A" and resid 25 and name HA) (segid " A" and resid 25 and name HB) 3.641 1.657 1.657 weight 1.000 ! spec=13C_...spin, no=1420, id=2214, vol=9.555222e+06 assign (segid " A" and resid 25 and name HD12) (segid " A" and resid 25 and name HG22) 1.669 0.348 0.348 weight 1.000 ! spec=13C_...spin, no=1434, id=2220, vol=3.208620e+08 or (segid " A" and resid 25 and name HD12) (segid " A" and resid 25 and name HG21) or (segid " A" and resid 25 and name HD12) (segid " A" and resid 25 and name HG23) or (segid " A" and resid 25 and name HD11) (segid " A" and resid 25 and name HG22) or (segid " A" and resid 25 and name HD11) (segid " A" and resid 25 and name HG21) or (segid " A" and resid 25 and name HD11) (segid " A" and resid 25 and name HG23) or (segid " A" and resid 25 and name HD13) (segid " A" and resid 25 and name HG22) or (segid " A" and resid 25 and name HD13) (segid " A" and resid 25 and name HG21) or (segid " A" and resid 25 and name HD13) (segid " A" and resid 25 and name HG23) assign (segid " A" and resid 25 and name HB) (segid " A" and resid 25 and name HG22) 2.158 0.582 0.582 weight 1.000 ! spec=13C_...spin, no=1435, id=2221, vol=7.182141e+07 or (segid " A" and resid 25 and name HB) (segid " A" and resid 25 and name HG21) or (segid " A" and resid 25 and name HB) (segid " A" and resid 25 and name HG23) assign (segid " A" and resid 24 and name HA) (segid " A" and resid 24 and name HB2) 2.038 0.519 0.519 weight 1.000 ! spec=13C_...spin, no=1438, id=2224, vol=1.833474e+08 or (segid " A" and resid 24 and name HA) (segid " A" and resid 24 and name HB1) or (segid " A" and resid 24 and name HA) (segid " A" and resid 24 and name HB3) assign (segid " A" and resid 22 and name HB2) (segid " A" and resid 35 and name HA) 5.731 4.106 4.106 weight 1.000 ! spec=13C_...spin, no=1443, id=2226, vol=1.776007e+06 or (segid " A" and resid 22 and name HB1) (segid " A" and resid 35 and name HA) or (segid " A" and resid 22 and name HB3) (segid " A" and resid 35 and name HA) assign (segid " A" and resid 21 and name HA) (segid " A" and resid 24 and name HB2) 2.690 0.904 0.904 weight 1.000 ! spec=13C_...spin, no=1447, id=2230, vol=3.721444e+07 or (segid " A" and resid 21 and name HA) (segid " A" and resid 24 and name HB1) or (segid " A" and resid 21 and name HA) (segid " A" and resid 24 and name HB3) assign (segid " A" and resid 21 and name HB) (segid " A" and resid 21 and name HG22) 2.361 0.697 0.697 weight 1.000 ! spec=13C_...spin, no=1452, id=2235, vol=4.327540e+07 or (segid " A" and resid 21 and name HB) (segid " A" and resid 21 and name HG21) or (segid " A" and resid 21 and name HB) (segid " A" and resid 21 and name HG23) assign (segid " A" and resid 21 and name HB) (segid " A" and resid 21 and name HD12) 2.960 1.096 1.096 weight 1.000 ! spec=13C_...spin, no=1454, id=2237, vol=1.814487e+07 or (segid " A" and resid 21 and name HB) (segid " A" and resid 21 and name HD11) or (segid " A" and resid 21 and name HB) (segid " A" and resid 21 and name HD13) assign (segid " A" and resid 21 and name HG12) (segid " A" and resid 21 and name HG22) 1.972 0.486 0.486 weight 1.000 ! spec=13C_...spin, no=1457, id=2240, vol=2.426195e+08 or (segid " A" and resid 21 and name HG12) (segid " A" and resid 21 and name HG21) or (segid " A" and resid 21 and name HG12) (segid " A" and resid 21 and name HG23) assign (segid " A" and resid 21 and name HD12) (segid " A" and resid 89 and name HZ) 3.236 1.309 1.309 weight 1.000 ! spec=13C_...spin, no=1459, id=2242, vol=3.069430e+07 or (segid " A" and resid 21 and name HD11) (segid " A" and resid 89 and name HZ) or (segid " A" and resid 21 and name HD13) (segid " A" and resid 89 and name HZ) assign (segid " A" and resid 89 and name HE1) (segid " A" and resid 21 and name HD12) 3.593 1.614 1.614 weight 1.000 ! spec=13C_...spin, no=1460, id=2243, vol=3.156792e+07 or (segid " A" and resid 89 and name HE1) (segid " A" and resid 21 and name HD11) or (segid " A" and resid 89 and name HE1) (segid " A" and resid 21 and name HD13) or (segid " A" and resid 89 and name HE2) (segid " A" and resid 21 and name HD12) or (segid " A" and resid 89 and name HE2) (segid " A" and resid 21 and name HD11) or (segid " A" and resid 89 and name HE2) (segid " A" and resid 21 and name HD13) assign (segid " A" and resid 21 and name HD12) (segid " A" and resid 13 and name HZ) 3.961 1.961 1.961 weight 1.000 ! spec=13C_...spin, no=1461, id=2244, vol=3.990522e+06 or (segid " A" and resid 21 and name HD11) (segid " A" and resid 13 and name HZ) or (segid " A" and resid 21 and name HD13) (segid " A" and resid 13 and name HZ) assign (segid " A" and resid 128 and name HE1) (segid " A" and resid 21 and name HD12) 4.159 2.162 2.162 weight 1.000 ! spec=13C_...spin, no=1462, id=2245, vol=8.981809e+06 or (segid " A" and resid 128 and name HE1) (segid " A" and resid 21 and name HD11) or (segid " A" and resid 128 and name HE1) (segid " A" and resid 21 and name HD13) or (segid " A" and resid 128 and name HE2) (segid " A" and resid 21 and name HD12) or (segid " A" and resid 128 and name HE2) (segid " A" and resid 21 and name HD11) or (segid " A" and resid 128 and name HE2) (segid " A" and resid 21 and name HD13) assign (segid " A" and resid 21 and name HA) (segid " A" and resid 21 and name HD12) 4.996 3.120 3.120 weight 1.000 ! spec=13C_...spin, no=1463, id=2246, vol=5.943071e+06 or (segid " A" and resid 21 and name HA) (segid " A" and resid 21 and name HD11) or (segid " A" and resid 21 and name HA) (segid " A" and resid 21 and name HD13) assign (segid " A" and resid 21 and name HD12) (segid " A" and resid 21 and name HG22) 2.721 0.925 0.925 weight 1.000 ! spec=13C_...spin, no=1465, id=2248, vol=2.308062e+07 or (segid " A" and resid 21 and name HD12) (segid " A" and resid 21 and name HG21) or (segid " A" and resid 21 and name HD12) (segid " A" and resid 21 and name HG23) or (segid " A" and resid 21 and name HD11) (segid " A" and resid 21 and name HG22) or (segid " A" and resid 21 and name HD11) (segid " A" and resid 21 and name HG21) or (segid " A" and resid 21 and name HD11) (segid " A" and resid 21 and name HG23) or (segid " A" and resid 21 and name HD13) (segid " A" and resid 21 and name HG22) or (segid " A" and resid 21 and name HD13) (segid " A" and resid 21 and name HG21) or (segid " A" and resid 21 and name HD13) (segid " A" and resid 21 and name HG23) assign (segid " A" and resid 72 and name HZ2) (segid " A" and resid 21 and name HG22) 2.787 0.971 0.971 weight 1.000 ! spec=13C_...spin, no=1467, id=2250, vol=5.383199e+07 or (segid " A" and resid 72 and name HZ2) (segid " A" and resid 21 and name HG21) or (segid " A" and resid 72 and name HZ2) (segid " A" and resid 21 and name HG23) assign (segid " A" and resid 21 and name HG22) (segid " A" and resid 72 and name HH2) 2.433 0.740 0.740 weight 1.000 ! spec=13C_...spin, no=1468, id=2251, vol=5.491874e+07 or (segid " A" and resid 21 and name HG21) (segid " A" and resid 72 and name HH2) or (segid " A" and resid 21 and name HG23) (segid " A" and resid 72 and name HH2) assign (segid " A" and resid 21 and name HG22) (segid " A" and resid 92 and name HE1) 3.338 1.393 1.393 weight 1.000 ! spec=13C_...spin, no=1469, id=2252, vol=5.576356e+06 or (segid " A" and resid 21 and name HG22) (segid " A" and resid 92 and name HE2) or (segid " A" and resid 21 and name HG21) (segid " A" and resid 92 and name HE1) or (segid " A" and resid 21 and name HG21) (segid " A" and resid 92 and name HE2) or (segid " A" and resid 21 and name HG23) (segid " A" and resid 92 and name HE1) or (segid " A" and resid 21 and name HG23) (segid " A" and resid 92 and name HE2) assign (segid " A" and resid 21 and name HA) (segid " A" and resid 21 and name HG22) 3.036 1.152 1.152 weight 1.000 ! spec=13C_...spin, no=1470, id=2253, vol=1.948607e+07 or (segid " A" and resid 21 and name HA) (segid " A" and resid 21 and name HG21) or (segid " A" and resid 21 and name HA) (segid " A" and resid 21 and name HG23) assign (segid " A" and resid 22 and name HB2) (segid " A" and resid 19 and name HA) 2.976 1.107 1.107 weight 1.000 ! spec=13C_...spin, no=1473, id=2255, vol=2.105005e+07 or (segid " A" and resid 22 and name HB1) (segid " A" and resid 19 and name HA) or (segid " A" and resid 22 and name HB3) (segid " A" and resid 19 and name HA) assign (segid " A" and resid 19 and name HA) (segid " A" and resid 19 and name HB1) 3.017 1.138 1.138 weight 1.000 ! spec=13C_...spin, no=1474, id=2256, vol=2.078807e+07 assign (segid " A" and resid 19 and name HA) (segid " A" and resid 19 and name HB2) 4.005 2.005 2.005 weight 1.000 ! spec=13C_...spin, no=1475, id=2257, vol=1.215910e+07 assign (segid " A" and resid 19 and name HB1) (segid " A" and resid 19 and name HB2) 2.185 0.597 0.597 weight 1.000 ! spec=13C_...spin, no=1478, id=2260, vol=6.092745e+07 assign (segid " A" and resid 18 and name HA) (segid " A" and resid 18 and name HB2) 2.468 0.761 0.761 weight 1.000 ! spec=13C_...spin, no=1481, id=2261, vol=4.668980e+07 or (segid " A" and resid 18 and name HA) (segid " A" and resid 18 and name HB1) or (segid " A" and resid 18 and name HA) (segid " A" and resid 18 and name HB3) assign (segid " A" and resid 18 and name HB2) (segid " A" and resid 14 and name HA) 3.037 1.153 1.153 weight 1.000 ! spec=13C_...spin, no=1482, id=2262, vol=1.245575e+07 or (segid " A" and resid 18 and name HB1) (segid " A" and resid 14 and name HA) or (segid " A" and resid 18 and name HB3) (segid " A" and resid 14 and name HA) assign (segid " A" and resid 17 and name HA) (segid " A" and resid 17 and name HB2) 3.304 1.364 1.364 weight 1.000 ! spec=13C_...spin, no=1491, id=2268, vol=2.782672e+07 assign (segid " A" and resid 17 and name HB1) (segid " A" and resid 13 and name HD1) 3.896 1.897 1.897 weight 1.000 ! spec=13C_...spin, no=1492, id=2269, vol=4.021398e+07 or (segid " A" and resid 17 and name HB1) (segid " A" and resid 13 and name HD2) assign (segid " A" and resid 17 and name HB2) (segid " A" and resid 17 and name HZ) 4.256 2.265 2.265 weight 1.000 ! spec=13C_...spin, no=1493, id=2270, vol=9.939313e+06 assign (segid " A" and resid 17 and name HB1) (segid " A" and resid 17 and name HE1) 5.282 3.488 3.488 weight 1.000 ! spec=13C_...spin, no=1494, id=2271, vol=3.996524e+06 or (segid " A" and resid 17 and name HB1) (segid " A" and resid 17 and name HE2) assign (segid " A" and resid 17 and name HB1) (segid " A" and resid 17 and name HA) 4.673 2.729 2.729 weight 1.000 ! spec=13C_...spin, no=1497, id=2274, vol=1.831344e+06 assign (segid " A" and resid 17 and name HD1) (segid " A" and resid 13 and name HD1) 4.232 2.239 2.239 weight 1.000 ! spec=13C_...spin, no=1503, id=2277, vol=3.067295e+07 or (segid " A" and resid 17 and name HD1) (segid " A" and resid 13 and name HD2) or (segid " A" and resid 17 and name HD2) (segid " A" and resid 13 and name HD1) or (segid " A" and resid 17 and name HD2) (segid " A" and resid 13 and name HD2) assign (segid " A" and resid 16 and name HA) (segid " A" and resid 16 and name HG1) 2.225 0.619 0.619 weight 1.000 ! spec=13C_...spin, no=1506, id=2280, vol=1.979536e+08 assign (segid " A" and resid 16 and name HA) (segid " A" and resid 16 and name HB2) 2.778 0.965 0.965 weight 1.000 ! spec=13C_...spin, no=1508, id=2282, vol=4.277713e+07 assign (segid " A" and resid 16 and name HB2) (segid " A" and resid 16 and name HB1) 1.761 0.387 0.387 weight 1.000 ! spec=13C_...spin, no=1511, id=2284, vol=2.585505e+08 assign (segid " A" and resid 16 and name HB2) (segid " A" and resid 16 and name HG1) 3.418 1.461 1.461 weight 1.000 ! spec=13C_...spin, no=1512, id=2285, vol=2.074828e+07 assign (segid " A" and resid 16 and name HG2) (segid " A" and resid 16 and name HG1) 1.905 0.453 0.453 weight 1.000 ! spec=13C_...spin, no=1514, id=2287, vol=2.090358e+08 assign (segid " A" and resid 16 and name HB2) (segid " A" and resid 16 and name HG2) 2.627 0.863 0.863 weight 1.000 ! spec=13C_...spin, no=1515, id=2288, vol=8.855472e+07 assign (segid " A" and resid 16 and name HA) (segid " A" and resid 16 and name HG2) 3.748 1.756 1.756 weight 1.000 ! spec=13C_...spin, no=1517, id=2290, vol=3.104370e+07 assign (segid " A" and resid 15 and name HB) (segid " A" and resid 15 and name HG21) 2.000 0.500 0.500 weight 1.000 ! spec=13C_...spin, no=1525, id=2293, vol=1.850467e+08 or (segid " A" and resid 15 and name HB) (segid " A" and resid 15 and name HG22) or (segid " A" and resid 15 and name HB) (segid " A" and resid 15 and name HG23) assign (segid " A" and resid 14 and name HB2) (segid " A" and resid 14 and name HB1) 1.780 0.396 0.396 weight 1.000 ! spec=13C_...spin, no=1535, id=2298, vol=2.229651e+08 assign (segid " A" and resid 13 and name HD1) (segid " A" and resid 13 and name HA) 3.360 1.411 1.411 weight 1.000 ! spec=13C_...spin, no=1538, id=2301, vol=4.749913e+07 or (segid " A" and resid 13 and name HD2) (segid " A" and resid 13 and name HA) assign (segid " A" and resid 17 and name HD1) (segid " A" and resid 13 and name HA) 4.214 2.220 2.220 weight 1.000 ! spec=13C_...spin, no=1541, id=2302, vol=1.515461e+07 or (segid " A" and resid 17 and name HD2) (segid " A" and resid 13 and name HA) assign (segid " A" and resid 13 and name HA) (segid " A" and resid 13 and name HB1) 3.940 1.940 1.940 weight 1.000 ! spec=13C_...spin, no=1542, id=2303, vol=1.240983e+07 assign (segid " A" and resid 13 and name HA) (segid " A" and resid 13 and name HB2) 3.647 1.662 1.662 weight 1.000 ! spec=13C_...spin, no=1543, id=2304, vol=7.291115e+06 assign (segid " A" and resid 13 and name HA) (segid " A" and resid 17 and name HB2) 2.829 1.000 1.000 weight 1.000 ! spec=13C_...spin, no=1544, id=2305, vol=3.587286e+07 assign (segid " A" and resid 13 and name HA) (segid " A" and resid 17 and name HB1) 4.941 3.052 3.052 weight 1.000 ! spec=13C_...spin, no=1545, id=2306, vol=1.224430e+07 assign (segid " A" and resid 13 and name HB1) (segid " A" and resid 13 and name HB2) 1.347 0.227 4.653 weight 1.000 ! spec=13C_...spin, no=1551, id=2308, vol=1.122992e+09 assign (segid " A" and resid 12 and name HA) (segid " A" and resid 12 and name HB2) 2.590 0.839 0.839 weight 1.000 ! spec=13C_...spin, no=1560, id=2312, vol=7.163146e+07 assign (segid " A" and resid 12 and name HA) (segid " A" and resid 12 and name HB1) 2.851 1.016 1.016 weight 1.000 ! spec=13C_...spin, no=1561, id=2313, vol=4.667057e+07 assign (segid " A" and resid 11 and name HA) (segid " A" and resid 11 and name HB1) 2.821 0.995 0.995 weight 1.000 ! spec=13C_...spin, no=1568, id=2317, vol=8.196734e+07 assign (segid " A" and resid 11 and name HA) (segid " A" and resid 11 and name HB2) 1.592 0.317 4.408 weight 1.000 ! spec=13C_...spin, no=1569, id=2318, vol=9.133327e+08 assign (segid " A" and resid 114 and name HG1) (segid " A" and resid 111 and name HA) 3.743 1.751 1.751 weight 1.000 ! spec=13C_...spin, no=1575, id=2321, vol=1.874075e+07 assign (segid " A" and resid 10 and name HA) (segid " A" and resid 13 and name HB1) 3.798 1.804 1.804 weight 1.000 ! spec=13C_...spin, no=1581, id=2323, vol=5.833490e+06 assign (segid " A" and resid 10 and name HA) (segid " A" and resid 13 and name HB2) 5.798 4.203 4.203 weight 1.000 ! spec=13C_...spin, no=1582, id=2324, vol=2.003523e+06 assign (segid " A" and resid 10 and name HB2) (segid " A" and resid 7 and name HA) 3.184 1.267 1.267 weight 1.000 ! spec=13C_...spin, no=1585, id=2326, vol=1.844889e+07 or (segid " A" and resid 10 and name HB1) (segid " A" and resid 7 and name HA) or (segid " A" and resid 10 and name HB3) (segid " A" and resid 7 and name HA) assign (segid " A" and resid 9 and name HA) (segid " A" and resid 12 and name HB2) 2.661 0.885 0.885 weight 1.000 ! spec=13C_...spin, no=1594, id=2328, vol=5.136798e+07 assign (segid " A" and resid 9 and name HA) (segid " A" and resid 9 and name HB) 2.640 0.871 0.871 weight 1.000 ! spec=13C_...spin, no=1599, id=2331, vol=7.716186e+07 assign (segid " A" and resid 9 and name HB) (segid " A" and resid 9 and name HG21) 2.425 0.735 0.735 weight 1.000 ! spec=13C_...spin, no=1610, id=2333, vol=4.819796e+07 or (segid " A" and resid 9 and name HB) (segid " A" and resid 9 and name HG22) or (segid " A" and resid 9 and name HB) (segid " A" and resid 9 and name HG23) assign (segid " A" and resid 8 and name HA) (segid " A" and resid 8 and name HB2) 2.786 0.971 0.971 weight 1.000 ! spec=13C_...spin, no=1611, id=2334, vol=6.013292e+07 assign (segid " A" and resid 8 and name HA) (segid " A" and resid 11 and name HB1) 2.395 0.717 0.717 weight 1.000 ! spec=13C_...spin, no=1612, id=2335, vol=7.367150e+07 assign (segid " A" and resid 7 and name HA) (segid " A" and resid 7 and name HG1) 3.265 1.333 1.333 weight 1.000 ! spec=13C_...spin, no=1621, id=2339, vol=7.786657e+07 assign (segid " A" and resid 7 and name HA) (segid " A" and resid 7 and name HB2) 2.893 1.046 1.046 weight 1.000 ! spec=13C_...spin, no=1622, id=2340, vol=7.968965e+07 assign (segid " A" and resid 7 and name HA) (segid " A" and resid 6 and name HA) 3.659 1.673 1.673 weight 1.000 ! spec=13C_...spin, no=1626, id=2342, vol=2.351944e+07 assign (segid " A" and resid 6 and name HA) (segid " A" and resid 6 and name HB2) 3.112 1.210 1.210 weight 1.000 ! spec=13C_...spin, no=1627, id=2343, vol=3.262494e+07 assign (segid " A" and resid 6 and name HA) (segid " A" and resid 7 and name HG1) 5.926 4.390 4.390 weight 1.000 ! spec=13C_...spin, no=1629, id=2345, vol=5.424968e+06 assign (segid " A" and resid 7 and name HB2) (segid " A" and resid 7 and name HB1) 1.613 0.325 0.325 weight 1.000 ! spec=13C_...spin, no=1631, id=2346, vol=3.986457e+08 assign (segid " A" and resid 7 and name HA) (segid " A" and resid 7 and name HB1) 2.376 0.706 0.706 weight 1.000 ! spec=13C_...spin, no=1637, id=2348, vol=1.014901e+08 assign (segid " A" and resid 6 and name HB2) (segid " A" and resid 6 and name HB1) 1.158 0.167 4.842 weight 1.000 ! spec=13C_...spin, no=1650, id=2357, vol=3.429539e+09 assign (segid " A" and resid 6 and name HA) (segid " A" and resid 6 and name HB1) 3.594 1.615 1.615 weight 1.000 ! spec=13C_...spin, no=1653, id=2359, vol=1.049148e+07 assign (segid " A" and resid 6 and name HB2) (segid " A" and resid 7 and name HG1) 6.080 4.621 4.621 weight 1.000 ! spec=13C_...spin, no=1655, id=2361, vol=4.560719e+06 assign (segid " A" and resid 6 and name HB1) (segid " A" and resid 7 and name HG1) 7.657 7.329 7.329 weight 1.000 ! spec=13C_...spin, no=1656, id=2362, vol=1.274790e+06 assign (segid " A" and resid 3 and name HA) (segid " A" and resid 3 and name HG2) 4.075 2.076 2.076 weight 1.000 ! spec=13C_...spin, no=1667, id=2368, vol=7.487239e+06 assign (segid " A" and resid 3 and name HA) (segid " A" and resid 3 and name HB2) 3.475 1.510 1.510 weight 1.000 ! spec=13C_...spin, no=1671, id=2370, vol=3.002418e+07 assign (segid " A" and resid 3 and name HA) (segid " A" and resid 3 and name HB1) 2.954 1.091 1.091 weight 1.000 ! spec=13C_...spin, no=1672, id=2371, vol=3.290992e+07 assign (segid " A" and resid 3 and name HA) (segid " A" and resid 3 and name HG1) 4.155 2.158 2.158 weight 1.000 ! spec=13C_...spin, no=1675, id=2373, vol=8.980372e+06 assign (segid " A" and resid 2 and name HA) (segid " A" and resid 2 and name HB2) 2.595 0.842 0.842 weight 1.000 ! spec=13C_...spin, no=1680, id=2374, vol=4.222599e+07 or (segid " A" and resid 2 and name HA) (segid " A" and resid 2 and name HB1) or (segid " A" and resid 2 and name HA) (segid " A" and resid 2 and name HB3) assign (segid " A" and resid 89 and name HB2) (segid " A" and resid 80 and name HD22) 2.862 1.024 1.024 weight 1.000 ! spec=13C_...spin, no=1730, id=2377, vol=1.639608e+07 or (segid " A" and resid 89 and name HB2) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 89 and name HB2) (segid " A" and resid 80 and name HD23) assign (segid " A" and resid 80 and name HD22) (segid " A" and resid 128 and name HB1) 4.235 2.242 2.242 weight 1.000 ! spec=13C_...spin, no=1750, id=2380, vol=3.651220e+06 or (segid " A" and resid 80 and name HD21) (segid " A" and resid 128 and name HB1) or (segid " A" and resid 80 and name HD23) (segid " A" and resid 128 and name HB1) assign (segid " A" and resid 100 and name HD12) (segid " A" and resid 100 and name HG) 1.857 0.431 0.431 weight 1.000 ! spec=13C_...spin, no=1755, id=2382, vol=1.947757e+08 or (segid " A" and resid 100 and name HD11) (segid " A" and resid 100 and name HG) or (segid " A" and resid 100 and name HD13) (segid " A" and resid 100 and name HG) assign (segid " A" and resid 96 and name HD22) (segid " A" and resid 103 and name HZ3) 4.780 2.856 2.856 weight 1.000 ! spec=13C_...spin, no=1786, id=2383, vol=1.525421e+06 or (segid " A" and resid 96 and name HD21) (segid " A" and resid 103 and name HZ3) or (segid " A" and resid 96 and name HD23) (segid " A" and resid 103 and name HZ3) assign (segid " A" and resid 25 and name HB) (segid " A" and resid 22 and name HA) 2.464 0.759 0.759 weight 1.000 ! spec=13C_...spin, no=1863, id=2387, vol=7.010088e+07 assign (segid " A" and resid 13 and name HB1) (segid " A" and resid 77 and name HG22) 3.383 1.431 1.431 weight 1.000 ! spec=13C_...spin, no=1866, id=2389, vol=1.227758e+07 or (segid " A" and resid 13 and name HB1) (segid " A" and resid 77 and name HG21) or (segid " A" and resid 13 and name HB1) (segid " A" and resid 77 and name HG23) assign (segid " A" and resid 80 and name HD12) (segid " A" and resid 77 and name HG12) 3.629 1.647 1.647 weight 1.000 ! spec=13C_...spin, no=1867, id=2390, vol=7.237150e+06 or (segid " A" and resid 80 and name HD11) (segid " A" and resid 77 and name HG12) or (segid " A" and resid 80 and name HD13) (segid " A" and resid 77 and name HG12) assign (segid " A" and resid 127 and name HB1) (segid " A" and resid 127 and name HA) 3.242 1.314 1.314 weight 1.000 ! spec=13C_...spin, no=1869, id=2391, vol=1.637817e+07 assign (segid " A" and resid 122 and name HD22) (segid " A" and resid 122 and name HA) 2.652 0.879 0.879 weight 1.000 ! spec=13C_...spin, no=1917, id=2393, vol=3.494278e+07 or (segid " A" and resid 122 and name HD21) (segid " A" and resid 122 and name HA) or (segid " A" and resid 122 and name HD23) (segid " A" and resid 122 and name HA) assign (segid " A" and resid 122 and name HB1) (segid " A" and resid 122 and name HA) 2.697 0.909 0.909 weight 1.000 ! spec=13C_...spin, no=1918, id=2394, vol=3.407769e+07 assign (segid " A" and resid 116 and name HA) (segid " A" and resid 116 and name HB1) 4.102 2.103 2.103 weight 1.000 ! spec=13C_...spin, no=1921, id=2397, vol=3.454983e+06 assign (segid " A" and resid 51 and name HG22) (segid " A" and resid 35 and name HG21) 1.871 0.438 0.438 weight 1.000 ! spec=13C_...spin, no=1926, id=2398, vol=1.036996e+08 or (segid " A" and resid 51 and name HG22) (segid " A" and resid 35 and name HG22) or (segid " A" and resid 51 and name HG22) (segid " A" and resid 35 and name HG23) or (segid " A" and resid 51 and name HG21) (segid " A" and resid 35 and name HG21) or (segid " A" and resid 51 and name HG21) (segid " A" and resid 35 and name HG22) or (segid " A" and resid 51 and name HG21) (segid " A" and resid 35 and name HG23) or (segid " A" and resid 51 and name HG23) (segid " A" and resid 35 and name HG21) or (segid " A" and resid 51 and name HG23) (segid " A" and resid 35 and name HG22) or (segid " A" and resid 51 and name HG23) (segid " A" and resid 35 and name HG23) assign (segid " A" and resid 96 and name HG) (segid " A" and resid 93 and name HD22) 3.266 1.333 1.333 weight 1.000 ! spec=13C_...spin, no=1935, id=2399, vol=3.248598e+07 or (segid " A" and resid 96 and name HG) (segid " A" and resid 93 and name HD21) or (segid " A" and resid 96 and name HG) (segid " A" and resid 93 and name HD23) assign (segid " A" and resid 28 and name HB2) (segid " A" and resid 25 and name HA) 3.565 1.588 1.588 weight 1.000 ! spec=13C_...spin, no=1944, id=2400, vol=1.371448e+07 assign (segid " A" and resid 70 and name HD22) (segid " A" and resid 68 and name HG) 3.324 1.381 1.381 weight 1.000 ! spec=13C_...spin, no=1947, id=2401, vol=1.768935e+07 or (segid " A" and resid 70 and name HD21) (segid " A" and resid 68 and name HG) or (segid " A" and resid 70 and name HD23) (segid " A" and resid 68 and name HG) assign (segid " A" and resid 62 and name HE1) (segid " A" and resid 117 and name HB2) 4.234 2.241 2.241 weight 1.000 ! spec=13C_...spin, no=1955, id=2403, vol=7.670180e+06 or (segid " A" and resid 62 and name HE1) (segid " A" and resid 117 and name HB1) or (segid " A" and resid 62 and name HE1) (segid " A" and resid 117 and name HB3) or (segid " A" and resid 62 and name HE2) (segid " A" and resid 117 and name HB2) or (segid " A" and resid 62 and name HE2) (segid " A" and resid 117 and name HB1) or (segid " A" and resid 62 and name HE2) (segid " A" and resid 117 and name HB3) assign (segid " A" and resid 68 and name HB2) (segid " A" and resid 121 and name HG12) 2.162 0.584 0.584 weight 1.000 ! spec=13C_...spin, no=1974, id=2406, vol=6.813658e+07 or (segid " A" and resid 68 and name HB2) (segid " A" and resid 121 and name HG11) or (segid " A" and resid 68 and name HB2) (segid " A" and resid 121 and name HG13) assign (segid " A" and resid 123 and name HB2) (segid " A" and resid 70 and name HA) 4.136 2.139 2.139 weight 1.000 ! spec=13C_...spin, no=1977, id=2407, vol=2.359096e+06 assign (segid " A" and resid 120 and name HG) (segid " A" and resid 120 and name HD22) 1.632 0.333 4.368 weight 1.000 ! spec=13C_...spin, no=1982, id=2408, vol=2.786274e+08 or (segid " A" and resid 120 and name HG) (segid " A" and resid 120 and name HD21) or (segid " A" and resid 120 and name HG) (segid " A" and resid 120 and name HD23) assign (segid " A" and resid 99 and name HB2) (segid " A" and resid 96 and name HA) 3.703 1.714 1.714 weight 1.000 ! spec=13C_...spin, no=1995, id=2410, vol=6.351988e+06 assign (segid " A" and resid 19 and name HG1) (segid " A" and resid 37 and name HG12) 3.181 1.264 1.264 weight 1.000 ! spec=13C_...spin, no=1996, id=2411, vol=1.591876e+07 or (segid " A" and resid 19 and name HG1) (segid " A" and resid 37 and name HG11) or (segid " A" and resid 19 and name HG1) (segid " A" and resid 37 and name HG13) assign (segid " A" and resid 93 and name HB2) (segid " A" and resid 90 and name HA) 4.465 2.492 2.492 weight 1.000 ! spec=13C_...spin, no=1997, id=2412, vol=2.095176e+06 assign (segid " A" and resid 93 and name HB1) (segid " A" and resid 90 and name HA) 5.652 3.993 3.993 weight 1.000 ! spec=13C_...spin, no=1999, id=2413, vol=3.310166e+06 assign (segid " A" and resid 123 and name HB1) (segid " A" and resid 70 and name HD22) 4.654 2.707 2.707 weight 1.000 ! spec=13C_...spin, no=2003, id=2415, vol=4.095029e+06 or (segid " A" and resid 123 and name HB1) (segid " A" and resid 70 and name HD21) or (segid " A" and resid 123 and name HB1) (segid " A" and resid 70 and name HD23) assign (segid " A" and resid 49 and name HB) (segid " A" and resid 72 and name HZ3) 3.859 1.861 1.861 weight 1.000 ! spec=13C_...spin, no=2008, id=2416, vol=7.702484e+06 assign (segid " A" and resid 35 and name HB) (segid " A" and resid 37 and name HG22) 4.343 2.357 2.357 weight 1.000 ! spec=13C_...spin, no=2010, id=2417, vol=2.717252e+06 or (segid " A" and resid 35 and name HB) (segid " A" and resid 37 and name HG21) or (segid " A" and resid 35 and name HB) (segid " A" and resid 37 and name HG23) assign (segid " A" and resid 19 and name HA) (segid " A" and resid 37 and name HB) 4.141 2.143 2.143 weight 1.000 ! spec=13C_...spin, no=2015, id=2418, vol=6.405162e+06 assign (segid " A" and resid 18 and name HB2) (segid " A" and resid 49 and name HB) 3.363 1.414 1.414 weight 1.000 ! spec=13C_...spin, no=2016, id=2419, vol=7.414198e+06 or (segid " A" and resid 18 and name HB1) (segid " A" and resid 49 and name HB) or (segid " A" and resid 18 and name HB3) (segid " A" and resid 49 and name HB) assign (segid " A" and resid 69 and name HB2) (segid " A" and resid 122 and name HD22) 1.653 0.342 0.342 weight 1.000 ! spec=13C_...spin, no=2037, id=2420, vol=7.187932e+07 or (segid " A" and resid 69 and name HB2) (segid " A" and resid 122 and name HD21) or (segid " A" and resid 69 and name HB2) (segid " A" and resid 122 and name HD23) or (segid " A" and resid 69 and name HB1) (segid " A" and resid 122 and name HD22) or (segid " A" and resid 69 and name HB1) (segid " A" and resid 122 and name HD21) or (segid " A" and resid 69 and name HB1) (segid " A" and resid 122 and name HD23) or (segid " A" and resid 69 and name HB3) (segid " A" and resid 122 and name HD22) or (segid " A" and resid 69 and name HB3) (segid " A" and resid 122 and name HD21) or (segid " A" and resid 69 and name HB3) (segid " A" and resid 122 and name HD23) assign (segid " A" and resid 104 and name HG2) (segid " A" and resid 109 and name HB) 4.382 2.400 2.400 weight 1.000 ! spec=13C_...spin, no=2039, id=2421, vol=2.976499e+06 assign (segid " A" and resid 16 and name HB1) (segid " A" and resid 17 and name HA) 4.748 2.818 2.818 weight 1.000 ! spec=13C_...spin, no=2049, id=2423, vol=3.732660e+06 assign (segid " A" and resid 9 and name HA) (segid " A" and resid 81 and name HG1) 4.234 2.241 2.241 weight 1.000 ! spec=13C_...spin, no=2076, id=2424, vol=6.354426e+06 assign (segid " A" and resid 9 and name HA) (segid " A" and resid 81 and name HG2) 3.999 1.999 1.999 weight 1.000 ! spec=13C_...spin, no=2078, id=2425, vol=7.403453e+06 assign (segid " A" and resid 93 and name HG) (segid " A" and resid 89 and name HA) 4.399 2.419 2.419 weight 1.000 ! spec=13C_...spin, no=2084, id=2426, vol=3.964651e+06 assign (segid " A" and resid 123 and name HG) (segid " A" and resid 121 and name HG22) 2.318 0.672 0.672 weight 1.000 ! spec=13C_...spin, no=2104, id=2429, vol=3.056462e+07 or (segid " A" and resid 123 and name HG) (segid " A" and resid 121 and name HG21) or (segid " A" and resid 123 and name HG) (segid " A" and resid 121 and name HG23) assign (segid " A" and resid 101 and name HB2) (segid " A" and resid 98 and name HA) 1.717 0.368 4.283 weight 1.000 ! spec=13C_...spin, no=2110, id=2430, vol=5.569267e+08 or (segid " A" and resid 101 and name HB1) (segid " A" and resid 98 and name HA) or (segid " A" and resid 101 and name HB3) (segid " A" and resid 98 and name HA) assign (segid " A" and resid 28 and name HD22) (segid " A" and resid 25 and name HA) 3.364 1.414 1.414 weight 1.000 ! spec=13C_...spin, no=2118, id=2431, vol=2.422522e+07 or (segid " A" and resid 28 and name HD21) (segid " A" and resid 25 and name HA) or (segid " A" and resid 28 and name HD23) (segid " A" and resid 25 and name HA) assign (segid " A" and resid 120 and name HG) (segid " A" and resid 122 and name HG) 1.883 0.443 0.443 weight 1.000 ! spec=13C_...spin, no=2122, id=2432, vol=1.090939e+08 assign (segid " A" and resid 111 and name HZ) (segid " A" and resid 68 and name HD12) 4.046 2.047 2.047 weight 1.000 ! spec=13C_...spin, no=2140, id=2434, vol=4.766295e+06 or (segid " A" and resid 111 and name HZ) (segid " A" and resid 68 and name HD11) or (segid " A" and resid 111 and name HZ) (segid " A" and resid 68 and name HD13) assign (segid " A" and resid 99 and name HB2) (segid " A" and resid 103 and name HZ2) 6.448 5.197 5.197 weight 1.000 ! spec=13C_...spin, no=2144, id=2435, vol=1.682341e+06 assign (segid " A" and resid 99 and name HB2) (segid " A" and resid 103 and name HE3) 4.938 3.048 3.048 weight 1.000 ! spec=13C_...spin, no=2145, id=2436, vol=5.429464e+06 assign (segid " A" and resid 99 and name HB2) (segid " A" and resid 103 and name HH2) 6.444 5.191 5.191 weight 1.000 ! spec=13C_...spin, no=2146, id=2437, vol=9.726060e+05 assign (segid " A" and resid 8 and name HB2) (segid " A" and resid 9 and name HA) 5.209 3.392 3.392 weight 1.000 ! spec=13C_...spin, no=2171, id=2439, vol=2.449524e+06 assign (segid " A" and resid 9 and name HG21) (segid " A" and resid 81 and name HG2) 3.040 1.156 1.156 weight 1.000 ! spec=13C_...spin, no=2190, id=2440, vol=1.910282e+07 or (segid " A" and resid 9 and name HG22) (segid " A" and resid 81 and name HG2) or (segid " A" and resid 9 and name HG23) (segid " A" and resid 81 and name HG2) assign (segid " A" and resid 9 and name HG21) (segid " A" and resid 81 and name HG1) 3.957 1.957 1.957 weight 1.000 ! spec=13C_...spin, no=2192, id=2441, vol=4.435004e+06 or (segid " A" and resid 9 and name HG22) (segid " A" and resid 81 and name HG1) or (segid " A" and resid 9 and name HG23) (segid " A" and resid 81 and name HG1) assign (segid " A" and resid 10 and name HB2) (segid " A" and resid 7 and name HB2) 3.918 1.919 1.919 weight 1.000 ! spec=13C_...spin, no=2198, id=2442, vol=8.335859e+06 or (segid " A" and resid 10 and name HB1) (segid " A" and resid 7 and name HB2) or (segid " A" and resid 10 and name HB3) (segid " A" and resid 7 and name HB2) assign (segid " A" and resid 10 and name HB2) (segid " A" and resid 40 and name HB1) 4.180 2.184 2.184 weight 1.000 ! spec=13C_...spin, no=2209, id=2445, vol=8.044131e+06 or (segid " A" and resid 10 and name HB1) (segid " A" and resid 40 and name HB1) or (segid " A" and resid 10 and name HB3) (segid " A" and resid 40 and name HB1) assign (segid " A" and resid 103 and name HZ3) (segid " A" and resid 99 and name HB1) 4.301 2.312 2.312 weight 1.000 ! spec=13C_...spin, no=2219, id=2446, vol=3.652805e+06 assign (segid " A" and resid 68 and name HA) (segid " A" and resid 122 and name HD22) 3.531 1.559 1.559 weight 1.000 ! spec=13C_...spin, no=2222, id=2447, vol=1.162963e+07 or (segid " A" and resid 68 and name HA) (segid " A" and resid 122 and name HD21) or (segid " A" and resid 68 and name HA) (segid " A" and resid 122 and name HD23) assign (segid " A" and resid 68 and name HA) (segid " A" and resid 121 and name HG22) 3.409 1.452 1.452 weight 1.000 ! spec=13C_...spin, no=2224, id=2448, vol=1.201843e+07 or (segid " A" and resid 68 and name HA) (segid " A" and resid 121 and name HG21) or (segid " A" and resid 68 and name HA) (segid " A" and resid 121 and name HG23) assign (segid " A" and resid 40 and name HD1) (segid " A" and resid 46 and name HA) 4.502 2.533 2.533 weight 1.000 ! spec=13C_...spin, no=2233, id=2451, vol=6.972677e+06 or (segid " A" and resid 40 and name HD2) (segid " A" and resid 46 and name HA) assign (segid " A" and resid 52 and name HB) (segid " A" and resid 34 and name HB1) 3.364 1.415 1.415 weight 1.000 ! spec=13C_...spin, no=2241, id=2452, vol=9.811716e+06 assign (segid " A" and resid 52 and name HG22) (segid " A" and resid 50 and name HA) 4.560 2.599 2.599 weight 1.000 ! spec=13C_...spin, no=2248, id=2453, vol=7.111718e+06 or (segid " A" and resid 52 and name HG21) (segid " A" and resid 50 and name HA) or (segid " A" and resid 52 and name HG23) (segid " A" and resid 50 and name HA) assign (segid " A" and resid 34 and name HB1) (segid " A" and resid 52 and name HG12) 3.613 1.632 1.632 weight 1.000 ! spec=13C_...spin, no=2250, id=2454, vol=1.471810e+07 or (segid " A" and resid 34 and name HB1) (segid " A" and resid 52 and name HG11) or (segid " A" and resid 34 and name HB1) (segid " A" and resid 52 and name HG13) assign (segid " A" and resid 52 and name HG22) (segid " A" and resid 50 and name HG1) 2.778 0.965 0.965 weight 1.000 ! spec=13C_...spin, no=2252, id=2455, vol=4.217193e+07 or (segid " A" and resid 52 and name HG21) (segid " A" and resid 50 and name HG1) or (segid " A" and resid 52 and name HG23) (segid " A" and resid 50 and name HG1) assign (segid " A" and resid 36 and name HB1) (segid " A" and resid 34 and name HE1) 7.801 7.607 7.607 weight 1.000 ! spec=13C_...spin, no=2257, id=2457, vol=8.834174e+05 assign (segid " A" and resid 10 and name HB2) (segid " A" and resid 40 and name HA) 4.542 2.579 2.579 weight 1.000 ! spec=13C_...spin, no=2281, id=2459, vol=5.884693e+06 or (segid " A" and resid 10 and name HB1) (segid " A" and resid 40 and name HA) or (segid " A" and resid 10 and name HB3) (segid " A" and resid 40 and name HA) assign (segid " A" and resid 10 and name HB2) (segid " A" and resid 40 and name HE1) 3.259 1.328 1.328 weight 1.000 ! spec=13C_...spin, no=2288, id=2460, vol=5.966259e+06 or (segid " A" and resid 10 and name HB2) (segid " A" and resid 40 and name HE2) or (segid " A" and resid 10 and name HB1) (segid " A" and resid 40 and name HE1) or (segid " A" and resid 10 and name HB1) (segid " A" and resid 40 and name HE2) or (segid " A" and resid 10 and name HB3) (segid " A" and resid 40 and name HE1) or (segid " A" and resid 10 and name HB3) (segid " A" and resid 40 and name HE2) assign (segid " A" and resid 111 and name HA) (segid " A" and resid 114 and name HA) 3.660 1.674 1.674 weight 1.000 ! spec=13C_...spin, no=2314, id=2461, vol=1.077837e+07 assign (segid " A" and resid 34 and name HB2) (segid " A" and resid 34 and name HD2) 4.876 2.971 2.971 weight 1.000 ! spec=13C_...spin, no=2330, id=2465, vol=7.056786e+06 assign (segid " A" and resid 34 and name HB1) (segid " A" and resid 34 and name HD2) 3.025 1.143 1.143 weight 1.000 ! spec=13C_...spin, no=2332, id=2466, vol=4.183192e+07 assign (segid " A" and resid 35 and name HA) (segid " A" and resid 51 and name HA) 2.329 0.678 0.678 weight 1.000 ! spec=13C_...spin, no=2338, id=2467, vol=9.399170e+07 assign (segid " A" and resid 35 and name HA) (segid " A" and resid 51 and name HG11) 4.481 2.510 2.510 weight 1.000 ! spec=13C_...spin, no=2342, id=2469, vol=9.125401e+06 assign (segid " A" and resid 35 and name HA) (segid " A" and resid 51 and name HG12) 3.542 1.568 1.568 weight 1.000 ! spec=13C_...spin, no=2344, id=2471, vol=1.567570e+07 assign (segid " A" and resid 51 and name HG22) (segid " A" and resid 35 and name HA) 4.309 2.321 2.321 weight 1.000 ! spec=13C_...spin, no=2345, id=2472, vol=7.113242e+06 or (segid " A" and resid 51 and name HG21) (segid " A" and resid 35 and name HA) or (segid " A" and resid 51 and name HG23) (segid " A" and resid 35 and name HA) assign (segid " A" and resid 52 and name HA) (segid " A" and resid 66 and name HB2) 6.049 4.573 4.573 weight 1.000 ! spec=13C_...spin, no=2348, id=2474, vol=3.241694e+06 assign (segid " A" and resid 11 and name HA) (segid " A" and resid 14 and name HB1) 3.257 1.326 1.326 weight 1.000 ! spec=13C_...spin, no=2363, id=2475, vol=1.375060e+07 assign (segid " A" and resid 10 and name HB2) (segid " A" and resid 40 and name HB2) 2.817 0.992 0.992 weight 1.000 ! spec=13C_...spin, no=2369, id=2477, vol=2.135308e+07 or (segid " A" and resid 10 and name HB1) (segid " A" and resid 40 and name HB2) or (segid " A" and resid 10 and name HB3) (segid " A" and resid 40 and name HB2) assign (segid " A" and resid 10 and name HB2) (segid " A" and resid 40 and name HD1) 3.753 1.761 1.761 weight 1.000 ! spec=13C_...spin, no=2372, id=2478, vol=1.664642e+07 or (segid " A" and resid 10 and name HB2) (segid " A" and resid 40 and name HD2) or (segid " A" and resid 10 and name HB1) (segid " A" and resid 40 and name HD1) or (segid " A" and resid 10 and name HB1) (segid " A" and resid 40 and name HD2) or (segid " A" and resid 10 and name HB3) (segid " A" and resid 40 and name HD1) or (segid " A" and resid 10 and name HB3) (segid " A" and resid 40 and name HD2) assign (segid " A" and resid 40 and name HE1) (segid " A" and resid 44 and name HA2) 5.210 3.393 3.393 weight 1.000 ! spec=13C_...spin, no=2379, id=2479, vol=7.145802e+06 or (segid " A" and resid 40 and name HE2) (segid " A" and resid 44 and name HA2) assign (segid " A" and resid 34 and name HD2) (segid " A" and resid 52 and name HG22) 3.901 1.903 1.903 weight 1.000 ! spec=13C_...spin, no=2381, id=2480, vol=8.788711e+06 or (segid " A" and resid 34 and name HD2) (segid " A" and resid 52 and name HG21) or (segid " A" and resid 34 and name HD2) (segid " A" and resid 52 and name HG23) assign (segid " A" and resid 46 and name HA) (segid " A" and resid 40 and name HE1) 2.966 1.100 3.034 weight 1.000 ! spec=13C_...spin, no=2398, id=2483, vol=1.264920e+07 or (segid " A" and resid 46 and name HA) (segid " A" and resid 40 and name HE2) assign (segid " A" and resid 44 and name HA1) (segid " A" and resid 40 and name HE1) 5.305 3.518 3.518 weight 1.000 ! spec=13C_...spin, no=2400, id=2485, vol=8.435666e+06 or (segid " A" and resid 44 and name HA1) (segid " A" and resid 40 and name HE2) assign (segid " A" and resid 109 and name HG22) (segid " A" and resid 111 and name HZ) 4.093 2.094 2.094 weight 1.000 ! spec=13C_...spin, no=2401, id=2486, vol=5.778123e+06 or (segid " A" and resid 109 and name HG21) (segid " A" and resid 111 and name HZ) or (segid " A" and resid 109 and name HG23) (segid " A" and resid 111 and name HZ) assign (segid " A" and resid 100 and name HG) (segid " A" and resid 97 and name HA) 4.715 2.778 2.778 weight 1.000 ! spec=13C_...spin, no=2405, id=2487, vol=6.217858e+06 assign (segid " A" and resid 29 and name HG) (segid " A" and resid 26 and name HA) 4.455 2.480 2.480 weight 1.000 ! spec=13C_...spin, no=2415, id=2490, vol=3.161692e+06 assign (segid " A" and resid 29 and name HG) (segid " A" and resid 25 and name HA) 3.714 1.724 1.724 weight 1.000 ! spec=13C_...spin, no=2421, id=2491, vol=7.918293e+06 assign (segid " A" and resid 111 and name HB1) (segid " A" and resid 29 and name HD22) 2.974 1.105 1.105 weight 1.000 ! spec=13C_...spin, no=2423, id=2492, vol=1.422735e+07 or (segid " A" and resid 111 and name HB1) (segid " A" and resid 29 and name HD21) or (segid " A" and resid 111 and name HB1) (segid " A" and resid 29 and name HD23) assign (segid " A" and resid 23 and name HA) (segid " A" and resid 26 and name HB2) 2.262 0.639 0.639 weight 1.000 ! spec=13C_...spin, no=2444, id=2493, vol=9.657766e+07 or (segid " A" and resid 23 and name HA) (segid " A" and resid 26 and name HB1) or (segid " A" and resid 23 and name HA) (segid " A" and resid 26 and name HB3) assign (segid " A" and resid 15 and name HA) (segid " A" and resid 19 and name HG2) 3.765 1.772 1.772 weight 1.000 ! spec=13C_...spin, no=2449, id=2494, vol=6.513884e+06 assign (segid " A" and resid 15 and name HA) (segid " A" and resid 19 and name HG1) 3.830 1.834 1.834 weight 1.000 ! spec=13C_...spin, no=2450, id=2495, vol=7.754007e+06 assign (segid " A" and resid 30 and name HB1) (segid " A" and resid 32 and name HG1) 5.254 3.451 3.451 weight 1.000 ! spec=13C_...spin, no=2452, id=2496, vol=5.247150e+06 assign (segid " A" and resid 111 and name HD1) (segid " A" and resid 66 and name HD22) 3.618 1.636 1.636 weight 1.000 ! spec=13C_...spin, no=2468, id=2497, vol=1.727081e+07 or (segid " A" and resid 111 and name HD1) (segid " A" and resid 66 and name HD21) or (segid " A" and resid 111 and name HD1) (segid " A" and resid 66 and name HD23) or (segid " A" and resid 111 and name HD2) (segid " A" and resid 66 and name HD22) or (segid " A" and resid 111 and name HD2) (segid " A" and resid 66 and name HD21) or (segid " A" and resid 111 and name HD2) (segid " A" and resid 66 and name HD23) assign (segid " A" and resid 115 and name HA) (segid " A" and resid 65 and name HA) 3.267 1.334 1.334 weight 1.000 ! spec=13C_...spin, no=2469, id=2498, vol=2.230747e+07 assign (segid " A" and resid 25 and name HD12) (segid " A" and resid 70 and name HD22) 2.096 0.549 3.904 weight 1.000 ! spec=13C_...spin, no=2477, id=2500, vol=7.285265e+07 or (segid " A" and resid 25 and name HD12) (segid " A" and resid 70 and name HD21) or (segid " A" and resid 25 and name HD12) (segid " A" and resid 70 and name HD23) or (segid " A" and resid 25 and name HD11) (segid " A" and resid 70 and name HD22) or (segid " A" and resid 25 and name HD11) (segid " A" and resid 70 and name HD21) or (segid " A" and resid 25 and name HD11) (segid " A" and resid 70 and name HD23) or (segid " A" and resid 25 and name HD13) (segid " A" and resid 70 and name HD22) or (segid " A" and resid 25 and name HD13) (segid " A" and resid 70 and name HD21) or (segid " A" and resid 25 and name HD13) (segid " A" and resid 70 and name HD23) assign (segid " A" and resid 115 and name HB) (segid " A" and resid 62 and name HB1) 5.117 3.272 3.272 weight 1.000 ! spec=13C_...spin, no=2480, id=2501, vol=4.485856e+06 assign (segid " A" and resid 115 and name HB) (segid " A" and resid 62 and name HB2) 3.156 1.245 1.245 weight 1.000 ! spec=13C_...spin, no=2482, id=2502, vol=1.265564e+07 assign (segid " A" and resid 78 and name HG1) (segid " A" and resid 75 and name HA) 4.779 2.855 2.855 weight 1.000 ! spec=13C_...spin, no=2490, id=2503, vol=1.221376e+07 assign (segid " A" and resid 53 and name HB2) (segid " A" and resid 34 and name HB2) 5.340 3.564 3.564 weight 1.000 ! spec=13C_...spin, no=2505, id=2504, vol=4.804672e+06 or (segid " A" and resid 53 and name HB1) (segid " A" and resid 34 and name HB2) or (segid " A" and resid 53 and name HB3) (segid " A" and resid 34 and name HB2) assign (segid " A" and resid 103 and name HA) (segid " A" and resid 106 and name HB2) 3.222 1.298 1.298 weight 1.000 ! spec=13C_...spin, no=2520, id=2505, vol=1.253662e+07 or (segid " A" and resid 103 and name HA) (segid " A" and resid 106 and name HB1) or (segid " A" and resid 103 and name HA) (segid " A" and resid 106 and name HB3) assign (segid " A" and resid 94 and name HA) (segid " A" and resid 94 and name HB2) 2.323 0.675 0.675 weight 1.000 ! spec=13C_...spin, no=2527, id=2507, vol=9.236891e+07 or (segid " A" and resid 94 and name HA) (segid " A" and resid 94 and name HB1) or (segid " A" and resid 94 and name HA) (segid " A" and resid 94 and name HB3) assign (segid " A" and resid 97 and name HA) (segid " A" and resid 28 and name HD12) 4.128 2.130 2.130 weight 1.000 ! spec=13C_...spin, no=2540, id=2508, vol=3.071356e+06 or (segid " A" and resid 97 and name HA) (segid " A" and resid 28 and name HD11) or (segid " A" and resid 97 and name HA) (segid " A" and resid 28 and name HD13) assign (segid " A" and resid 72 and name HA) (segid " A" and resid 126 and name HB2) 3.326 1.383 1.383 weight 1.000 ! spec=13C_...spin, no=2546, id=2509, vol=1.145720e+07 assign (segid " A" and resid 54 and name HD1) (segid " A" and resid 52 and name HG12) 3.702 1.713 1.713 weight 1.000 ! spec=13C_...spin, no=2547, id=2510, vol=8.479864e+06 or (segid " A" and resid 54 and name HD1) (segid " A" and resid 52 and name HG11) or (segid " A" and resid 54 and name HD1) (segid " A" and resid 52 and name HG13) assign (segid " A" and resid 72 and name HN) (segid " A" and resid 77 and name HD12) 3.501 1.532 1.532 weight 1.000 ! spec=15N_...last, no=2, id=447, vol=3.090533e+06 or (segid " A" and resid 72 and name HN) (segid " A" and resid 77 and name HD11) or (segid " A" and resid 72 and name HN) (segid " A" and resid 77 and name HD13) assign (segid " A" and resid 72 and name HN) (segid " A" and resid 71 and name HG21) 3.982 1.982 1.982 weight 1.000 ! spec=15N_...last, no=3, id=448, vol=6.126317e+06 or (segid " A" and resid 72 and name HN) (segid " A" and resid 71 and name HG22) or (segid " A" and resid 72 and name HN) (segid " A" and resid 71 and name HG23) assign (segid " A" and resid 72 and name HN) (segid " A" and resid 72 and name HB1) 4.091 2.092 2.092 weight 1.000 ! spec=15N_...last, no=4, id=449, vol=5.553966e+06 assign (segid " A" and resid 72 and name HN) (segid " A" and resid 72 and name HB2) 3.192 1.274 1.274 weight 1.000 ! spec=15N_...last, no=5, id=450, vol=4.452464e+06 assign (segid " A" and resid 72 and name HN) (segid " A" and resid 71 and name HB) 3.108 1.207 1.207 weight 1.000 ! spec=15N_...last, no=6, id=451, vol=6.913837e+06 assign (segid " A" and resid 72 and name HN) (segid " A" and resid 72 and name HE3) 3.008 1.131 1.131 weight 1.000 ! spec=15N_...last, no=7, id=452, vol=9.958705e+06 assign (segid " A" and resid 72 and name HN) (segid " A" and resid 71 and name HA) 2.467 0.761 0.761 weight 1.000 ! spec=15N_...last, no=8, id=453, vol=2.262583e+07 assign (segid " A" and resid 72 and name HN) (segid " A" and resid 72 and name HA) 3.332 1.388 1.388 weight 1.000 ! spec=15N_...last, no=9, id=454, vol=4.237603e+06 assign (segid " A" and resid 72 and name HE1) (segid " A" and resid 72 and name HB2) 4.843 2.932 2.932 weight 1.000 ! spec=15N_...last, no=10, id=455, vol=1.855329e+06 assign (segid " A" and resid 72 and name HE1) (segid " A" and resid 72 and name HH2) 3.986 1.986 1.986 weight 1.000 ! spec=15N_...last, no=11, id=456, vol=6.921308e+06 assign (segid " A" and resid 72 and name HE1) (segid " A" and resid 128 and name HD1) 4.258 2.266 2.266 weight 1.000 ! spec=15N_...last, no=14, id=458, vol=3.183164e+06 or (segid " A" and resid 72 and name HE1) (segid " A" and resid 128 and name HD2) assign (segid " A" and resid 72 and name HE1) (segid " A" and resid 126 and name HB2) 3.592 1.613 1.613 weight 1.000 ! spec=15N_...last, no=18, id=459, vol=5.043118e+06 assign (segid " A" and resid 72 and name HE1) (segid " A" and resid 126 and name HB1) 2.905 1.055 1.055 weight 1.000 ! spec=15N_...last, no=20, id=460, vol=8.208544e+06 assign (segid " A" and resid 72 and name HE1) (segid " A" and resid 128 and name HE1) 4.356 2.372 2.372 weight 1.000 ! spec=15N_...last, no=21, id=461, vol=3.026138e+06 or (segid " A" and resid 72 and name HE1) (segid " A" and resid 128 and name HE2) assign (segid " A" and resid 103 and name HN) (segid " A" and resid 103 and name HD1) 3.880 1.881 1.881 weight 1.000 ! spec=15N_...last, no=22, id=462, vol=5.166024e+06 assign (segid " A" and resid 103 and name HN) (segid " A" and resid 102 and name HN) 2.592 0.840 0.840 weight 1.000 ! spec=15N_...last, no=23, id=463, vol=1.631089e+07 assign (segid " A" and resid 103 and name HN) (segid " A" and resid 103 and name HA) 2.962 1.096 1.096 weight 1.000 ! spec=15N_...last, no=25, id=464, vol=8.285996e+06 assign (segid " A" and resid 103 and name HN) (segid " A" and resid 103 and name HB2) 2.729 0.931 0.931 weight 1.000 ! spec=15N_...last, no=26, id=465, vol=8.438981e+06 assign (segid " A" and resid 103 and name HN) (segid " A" and resid 103 and name HB1) 3.546 1.572 1.572 weight 1.000 ! spec=15N_...last, no=27, id=466, vol=1.661465e+07 assign (segid " A" and resid 103 and name HN) (segid " A" and resid 102 and name HB2) 2.521 0.794 0.794 weight 1.000 ! spec=15N_...last, no=28, id=467, vol=1.696601e+07 or (segid " A" and resid 103 and name HN) (segid " A" and resid 102 and name HB1) or (segid " A" and resid 103 and name HN) (segid " A" and resid 102 and name HB3) assign (segid " A" and resid 47 and name HN) (segid " A" and resid 47 and name HB) 2.607 0.850 0.850 weight 1.000 ! spec=15N_...last, no=29, id=468, vol=1.632452e+07 assign (segid " A" and resid 47 and name HN) (segid " A" and resid 46 and name HA) 2.335 0.681 0.681 weight 1.000 ! spec=15N_...last, no=30, id=469, vol=2.710470e+07 assign (segid " A" and resid 47 and name HN) (segid " A" and resid 46 and name HB1) 3.838 1.842 1.842 weight 1.000 ! spec=15N_...last, no=33, id=470, vol=5.570136e+06 assign (segid " A" and resid 47 and name HN) (segid " A" and resid 46 and name HB2) 3.641 1.657 1.657 weight 1.000 ! spec=15N_...last, no=34, id=471, vol=4.848132e+06 assign (segid " A" and resid 47 and name HN) (segid " A" and resid 47 and name HG21) 3.723 1.733 1.733 weight 1.000 ! spec=15N_...last, no=35, id=472, vol=8.651563e+06 or (segid " A" and resid 47 and name HN) (segid " A" and resid 47 and name HG22) or (segid " A" and resid 47 and name HN) (segid " A" and resid 47 and name HG23) assign (segid " A" and resid 48 and name HN) (segid " A" and resid 48 and name HA) 2.979 1.110 1.110 weight 1.000 ! spec=15N_...last, no=38, id=473, vol=6.035330e+06 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 48 and name HG1) 3.550 1.576 1.576 weight 1.000 ! spec=15N_...last, no=39, id=474, vol=6.255566e+06 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 37 and name HA) 4.177 2.181 2.181 weight 1.000 ! spec=15N_...last, no=41, id=476, vol=3.503292e+06 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 38 and name HN) 3.078 1.184 1.184 weight 1.000 ! spec=15N_...last, no=43, id=477, vol=7.162286e+06 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 47 and name HA) 2.276 0.648 0.648 weight 1.000 ! spec=15N_...last, no=44, id=478, vol=2.688150e+07 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 47 and name HG21) 2.533 0.802 0.802 weight 1.000 ! spec=15N_...last, no=46, id=479, vol=1.367580e+07 or (segid " A" and resid 48 and name HN) (segid " A" and resid 47 and name HG22) or (segid " A" and resid 48 and name HN) (segid " A" and resid 47 and name HG23) assign (segid " A" and resid 70 and name HN) (segid " A" and resid 48 and name HA) 4.735 2.803 2.803 weight 1.000 ! spec=15N_...last, no=48, id=480, vol=1.397221e+06 assign (segid " A" and resid 70 and name HN) (segid " A" and resid 48 and name HB1) 4.210 2.215 2.215 weight 1.000 ! spec=15N_...last, no=51, id=481, vol=4.069300e+06 assign (segid " A" and resid 70 and name HN) (segid " A" and resid 70 and name HB2) 2.423 0.734 0.734 weight 1.000 ! spec=15N_...last, no=52, id=482, vol=1.377441e+07 assign (segid " A" and resid 70 and name HN) (segid " A" and resid 70 and name HG) 2.700 0.911 0.911 weight 1.000 ! spec=15N_...last, no=53, id=483, vol=1.052166e+07 assign (segid " A" and resid 70 and name HN) (segid " A" and resid 69 and name HB2) 3.205 1.284 1.284 weight 1.000 ! spec=15N_...last, no=54, id=484, vol=1.331326e+07 or (segid " A" and resid 70 and name HN) (segid " A" and resid 69 and name HB1) or (segid " A" and resid 70 and name HN) (segid " A" and resid 69 and name HB3) assign (segid " A" and resid 70 and name HN) (segid " A" and resid 70 and name HD22) 4.253 2.261 2.261 weight 1.000 ! spec=15N_...last, no=57, id=486, vol=2.937030e+06 or (segid " A" and resid 70 and name HN) (segid " A" and resid 70 and name HD21) or (segid " A" and resid 70 and name HN) (segid " A" and resid 70 and name HD23) assign (segid " A" and resid 70 and name HN) (segid " A" and resid 50 and name HA) 3.254 1.324 1.324 weight 1.000 ! spec=15N_...last, no=59, id=487, vol=5.578278e+06 assign (segid " A" and resid 70 and name HN) (segid " A" and resid 69 and name HA) 2.189 0.599 0.599 weight 1.000 ! spec=15N_...last, no=60, id=488, vol=3.311293e+07 assign (segid " A" and resid 70 and name HN) (segid " A" and resid 70 and name HA) 2.918 1.064 1.064 weight 1.000 ! spec=15N_...last, no=61, id=489, vol=7.897650e+06 assign (segid " A" and resid 115 and name HN) (segid " A" and resid 115 and name HB) 3.102 1.203 1.203 weight 1.000 ! spec=15N_...last, no=63, id=490, vol=1.430015e+07 assign (segid " A" and resid 115 and name HN) (segid " A" and resid 110 and name HN) 3.764 1.771 1.771 weight 1.000 ! spec=15N_...last, no=65, id=492, vol=3.016334e+06 assign (segid " A" and resid 115 and name HN) (segid " A" and resid 115 and name HA) 3.168 1.255 1.255 weight 1.000 ! spec=15N_...last, no=67, id=493, vol=5.734897e+06 assign (segid " A" and resid 115 and name HN) (segid " A" and resid 110 and name HB1) 3.754 1.761 1.761 weight 1.000 ! spec=15N_...last, no=72, id=495, vol=3.346185e+06 assign (segid " A" and resid 4 and name HN) (segid " A" and resid 3 and name HG2) 4.655 2.709 2.709 weight 1.000 ! spec=15N_...last, no=73, id=496, vol=3.924584e+06 assign (segid " A" and resid 4 and name HN) (segid " A" and resid 3 and name HA) 3.386 1.433 1.433 weight 1.000 ! spec=15N_...last, no=74, id=497, vol=6.126368e+06 assign (segid " A" and resid 129 and name HN) (segid " A" and resid 127 and name HB2) 3.273 1.339 1.339 weight 1.000 ! spec=15N_...last, no=76, id=499, vol=6.386368e+06 assign (segid " A" and resid 129 and name HN) (segid " A" and resid 130 and name HN) 4.347 2.362 2.362 weight 1.000 ! spec=15N_...last, no=83, id=501, vol=3.332122e+06 assign (segid " A" and resid 129 and name HN) (segid " A" and resid 128 and name HA) 2.930 1.073 1.073 weight 1.000 ! spec=15N_...last, no=85, id=502, vol=1.007725e+07 assign (segid " A" and resid 129 and name HN) (segid " A" and resid 129 and name HB2) 2.996 1.122 1.122 weight 1.000 ! spec=15N_...last, no=87, id=503, vol=7.413727e+06 assign (segid " A" and resid 129 and name HN) (segid " A" and resid 129 and name HB1) 2.747 0.944 0.944 weight 1.000 ! spec=15N_...last, no=89, id=504, vol=2.259861e+07 assign (segid " A" and resid 89 and name HN) (segid " A" and resid 89 and name HB2) 2.642 0.873 0.873 weight 1.000 ! spec=15N_...last, no=94, id=505, vol=1.506279e+07 assign (segid " A" and resid 89 and name HN) (segid " A" and resid 89 and name HB1) 2.635 0.868 0.868 weight 1.000 ! spec=15N_...last, no=95, id=506, vol=1.836793e+07 assign (segid " A" and resid 89 and name HN) (segid " A" and resid 80 and name HD22) 3.528 1.556 1.556 weight 1.000 ! spec=15N_...last, no=98, id=507, vol=2.973943e+06 or (segid " A" and resid 89 and name HN) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 89 and name HN) (segid " A" and resid 80 and name HD23) assign (segid " A" and resid 89 and name HN) (segid " A" and resid 85 and name HA2) 3.860 1.862 1.862 weight 1.000 ! spec=15N_...last, no=100, id=508, vol=3.369233e+06 assign (segid " A" and resid 49 and name HN) (segid " A" and resid 48 and name HA) 2.282 0.651 0.651 weight 1.000 ! spec=15N_...last, no=102, id=509, vol=2.643315e+07 assign (segid " A" and resid 89 and name HN) (segid " A" and resid 89 and name HD1) 4.791 2.869 2.869 weight 1.000 ! spec=15N_...last, no=103, id=510, vol=4.147806e+06 or (segid " A" and resid 89 and name HN) (segid " A" and resid 89 and name HD2) assign (segid " A" and resid 89 and name HN) (segid " A" and resid 90 and name HN) 2.763 0.954 0.954 weight 1.000 ! spec=15N_...last, no=105, id=511, vol=1.053705e+07 assign (segid " A" and resid 89 and name HN) (segid " A" and resid 88 and name HN) 2.861 1.023 1.023 weight 1.000 ! spec=15N_...last, no=106, id=512, vol=8.866348e+06 assign (segid " A" and resid 8 and name HN) (segid " A" and resid 8 and name HA) 3.332 1.388 1.388 weight 1.000 ! spec=15N_...last, no=109, id=515, vol=5.127408e+06 assign (segid " A" and resid 8 and name HN) (segid " A" and resid 7 and name HA) 2.918 1.065 1.065 weight 1.000 ! spec=15N_...last, no=110, id=516, vol=1.168082e+07 assign (segid " A" and resid 8 and name HN) (segid " A" and resid 7 and name HD1) 3.725 1.734 1.734 weight 1.000 ! spec=15N_...last, no=111, id=517, vol=8.536197e+06 assign (segid " A" and resid 8 and name HN) (segid " A" and resid 8 and name HB2) 2.724 0.927 0.927 weight 1.000 ! spec=15N_...last, no=112, id=518, vol=1.534981e+07 assign (segid " A" and resid 8 and name HN) (segid " A" and resid 7 and name HB2) 3.137 1.230 1.230 weight 1.000 ! spec=15N_...last, no=113, id=519, vol=9.935945e+06 assign (segid " A" and resid 9 and name HN) (segid " A" and resid 10 and name HN) 2.696 0.909 0.909 weight 1.000 ! spec=15N_...last, no=114, id=520, vol=1.427722e+07 assign (segid " A" and resid 8 and name HN) (segid " A" and resid 9 and name HN) 2.923 1.068 1.068 weight 1.000 ! spec=15N_...last, no=115, id=521, vol=8.044751e+06 assign (segid " A" and resid 9 and name HN) (segid " A" and resid 11 and name HN) 3.046 1.159 1.159 weight 1.000 ! spec=15N_...last, no=116, id=522, vol=1.417170e+07 assign (segid " A" and resid 9 and name HN) (segid " A" and resid 8 and name HA) 3.604 1.623 1.623 weight 1.000 ! spec=15N_...last, no=119, id=524, vol=3.853761e+06 assign (segid " A" and resid 9 and name HN) (segid " A" and resid 9 and name HB) 2.544 0.809 0.809 weight 1.000 ! spec=15N_...last, no=120, id=525, vol=1.815659e+07 assign (segid " A" and resid 10 and name HN) (segid " A" and resid 8 and name HA) 4.426 2.448 2.448 weight 1.000 ! spec=15N_...last, no=134, id=528, vol=1.684697e+06 assign (segid " A" and resid 10 and name HN) (segid " A" and resid 9 and name HB) 2.573 0.827 0.827 weight 1.000 ! spec=15N_...last, no=135, id=529, vol=1.594085e+07 assign (segid " A" and resid 100 and name HN) (segid " A" and resid 98 and name HN) 3.678 1.691 1.691 weight 1.000 ! spec=15N_...last, no=142, id=532, vol=4.531044e+06 assign (segid " A" and resid 100 and name HN) (segid " A" and resid 101 and name HN) 2.857 1.020 1.020 weight 1.000 ! spec=15N_...last, no=143, id=533, vol=9.335508e+06 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 10 and name HB2) 2.523 0.796 0.796 weight 1.000 ! spec=15N_...last, no=148, id=535, vol=1.668980e+07 or (segid " A" and resid 11 and name HN) (segid " A" and resid 10 and name HB1) or (segid " A" and resid 11 and name HN) (segid " A" and resid 10 and name HB3) assign (segid " A" and resid 100 and name HN) (segid " A" and resid 100 and name HG) 3.811 1.816 1.816 weight 1.000 ! spec=15N_...last, no=150, id=537, vol=7.755250e+06 assign (segid " A" and resid 100 and name HN) (segid " A" and resid 100 and name HD12) 4.115 2.117 2.117 weight 1.000 ! spec=15N_...last, no=151, id=538, vol=4.641136e+06 or (segid " A" and resid 100 and name HN) (segid " A" and resid 100 and name HD11) or (segid " A" and resid 100 and name HN) (segid " A" and resid 100 and name HD13) assign (segid " A" and resid 100 and name HN) (segid " A" and resid 99 and name HA) 3.365 1.415 1.415 weight 1.000 ! spec=15N_...last, no=153, id=539, vol=5.040162e+06 assign (segid " A" and resid 100 and name HN) (segid " A" and resid 100 and name HA) 2.632 0.866 0.866 weight 1.000 ! spec=15N_...last, no=154, id=540, vol=1.575217e+07 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 11 and name HA) 2.766 0.957 0.957 weight 1.000 ! spec=15N_...last, no=155, id=541, vol=1.425038e+07 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 8 and name HA) 3.317 1.375 1.375 weight 1.000 ! spec=15N_...last, no=156, id=542, vol=6.467452e+06 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 12 and name HN) 2.643 0.873 0.873 weight 1.000 ! spec=15N_...last, no=158, id=543, vol=1.361328e+07 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 13 and name HN) 3.864 1.867 1.867 weight 1.000 ! spec=15N_...last, no=159, id=544, vol=3.609993e+06 assign (segid " A" and resid 12 and name HN) (segid " A" and resid 12 and name HB2) 2.031 0.516 0.516 weight 1.000 ! spec=15N_...last, no=166, id=548, vol=4.028756e+07 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 12 and name HN) 2.831 1.002 1.002 weight 1.000 ! spec=15N_...last, no=167, id=549, vol=9.262831e+06 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 13 and name HB1) 2.723 0.927 0.927 weight 1.000 ! spec=15N_...last, no=168, id=550, vol=1.280734e+07 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 13 and name HB2) 2.767 0.957 0.957 weight 1.000 ! spec=15N_...last, no=169, id=551, vol=1.252282e+07 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 13 and name HA) 3.008 1.131 1.131 weight 1.000 ! spec=15N_...last, no=174, id=552, vol=8.495520e+06 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 13 and name HN) 2.839 1.008 1.008 weight 1.000 ! spec=15N_...last, no=176, id=554, vol=8.974084e+06 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 13 and name HD1) 4.460 2.487 2.487 weight 1.000 ! spec=15N_...last, no=177, id=555, vol=3.372508e+06 or (segid " A" and resid 14 and name HN) (segid " A" and resid 13 and name HD2) assign (segid " A" and resid 14 and name HN) (segid " A" and resid 14 and name HA) 2.715 0.921 0.921 weight 1.000 ! spec=15N_...last, no=178, id=556, vol=1.496470e+07 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 14 and name HB1) 2.567 0.824 0.824 weight 1.000 ! spec=15N_...last, no=180, id=557, vol=1.747932e+07 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 14 and name HB2) 2.944 1.083 1.083 weight 1.000 ! spec=15N_...last, no=181, id=558, vol=1.000541e+07 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 13 and name HB1) 2.927 1.071 1.071 weight 1.000 ! spec=15N_...last, no=184, id=559, vol=6.882934e+06 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 13 and name HN) 3.971 1.971 1.971 weight 1.000 ! spec=15N_...last, no=186, id=560, vol=2.790543e+06 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 15 and name HN) 2.955 1.091 1.091 weight 1.000 ! spec=15N_...last, no=188, id=561, vol=6.652592e+06 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 15 and name HG21) 2.755 0.948 0.948 weight 1.000 ! spec=15N_...last, no=190, id=563, vol=1.029066e+07 or (segid " A" and resid 15 and name HN) (segid " A" and resid 15 and name HG22) or (segid " A" and resid 15 and name HN) (segid " A" and resid 15 and name HG23) assign (segid " A" and resid 15 and name HN) (segid " A" and resid 14 and name HB2) 4.184 2.188 2.188 weight 1.000 ! spec=15N_...last, no=194, id=564, vol=4.511406e+06 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 14 and name HB1) 3.035 1.151 1.151 weight 1.000 ! spec=15N_...last, no=195, id=565, vol=7.119058e+06 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 15 and name HA) 2.914 1.062 1.062 weight 1.000 ! spec=15N_...last, no=196, id=566, vol=8.813002e+06 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 15 and name HB) 2.908 1.057 1.057 weight 1.000 ! spec=15N_...last, no=197, id=567, vol=9.873157e+06 assign (segid " A" and resid 16 and name HN) (segid " A" and resid 16 and name HB2) 2.925 1.069 1.069 weight 1.000 ! spec=15N_...last, no=203, id=570, vol=9.144585e+06 assign (segid " A" and resid 16 and name HN) (segid " A" and resid 16 and name HB1) 2.462 0.758 0.758 weight 1.000 ! spec=15N_...last, no=204, id=571, vol=1.712333e+07 assign (segid " A" and resid 16 and name HN) (segid " A" and resid 12 and name HA) 3.620 1.638 1.638 weight 1.000 ! spec=15N_...last, no=211, id=573, vol=3.627169e+06 assign (segid " A" and resid 16 and name HN) (segid " A" and resid 17 and name HN) 2.437 0.743 0.743 weight 1.000 ! spec=15N_...last, no=215, id=575, vol=1.478544e+07 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 17 and name HN) 4.345 2.360 2.360 weight 1.000 ! spec=15N_...last, no=216, id=576, vol=3.713340e+06 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD1) 3.716 1.726 1.726 weight 1.000 ! spec=15N_...last, no=217, id=577, vol=7.530380e+06 or (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD2) assign (segid " A" and resid 17 and name HN) (segid " A" and resid 16 and name HA) 3.119 1.216 1.216 weight 1.000 ! spec=15N_...last, no=218, id=578, vol=1.105476e+07 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HA) 2.951 1.089 1.089 weight 1.000 ! spec=15N_...last, no=219, id=579, vol=7.929228e+06 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HB2) 2.629 0.864 0.864 weight 1.000 ! spec=15N_...last, no=222, id=580, vol=9.093017e+06 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HB1) 3.718 1.728 1.728 weight 1.000 ! spec=15N_...last, no=223, id=581, vol=1.024888e+07 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 16 and name HB1) 2.608 0.850 0.850 weight 1.000 ! spec=15N_...last, no=224, id=582, vol=1.037438e+07 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 16 and name HB2) 3.772 1.778 1.778 weight 1.000 ! spec=15N_...last, no=225, id=583, vol=9.269429e+06 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 18 and name HB2) 2.244 0.629 0.629 weight 1.000 ! spec=15N_...last, no=228, id=584, vol=2.196246e+07 or (segid " A" and resid 18 and name HN) (segid " A" and resid 18 and name HB1) or (segid " A" and resid 18 and name HN) (segid " A" and resid 18 and name HB3) assign (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HB2) 2.822 0.996 0.996 weight 1.000 ! spec=15N_...last, no=234, id=585, vol=1.015921e+07 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HB1) 3.492 1.524 1.524 weight 1.000 ! spec=15N_...last, no=235, id=586, vol=7.198512e+06 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 18 and name HA) 2.512 0.789 0.789 weight 1.000 ! spec=15N_...last, no=236, id=587, vol=1.725799e+07 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 14 and name HA) 3.046 1.159 1.159 weight 1.000 ! spec=15N_...last, no=237, id=588, vol=6.083839e+06 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HA) 3.617 1.636 1.636 weight 1.000 ! spec=15N_...last, no=238, id=589, vol=3.953666e+06 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HD1) 5.353 3.582 3.582 weight 1.000 ! spec=15N_...last, no=239, id=590, vol=1.855156e+06 or (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HD2) assign (segid " A" and resid 17 and name HN) (segid " A" and resid 18 and name HN) 2.468 0.761 0.761 weight 1.000 ! spec=15N_...last, no=240, id=591, vol=1.377292e+07 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 18 and name HA) 3.099 1.201 1.201 weight 1.000 ! spec=15N_...last, no=247, id=595, vol=7.637135e+06 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 18 and name HB2) 3.932 1.932 1.932 weight 1.000 ! spec=15N_...last, no=264, id=601, vol=3.111966e+06 or (segid " A" and resid 20 and name HN) (segid " A" and resid 18 and name HB1) or (segid " A" and resid 20 and name HN) (segid " A" and resid 18 and name HB3) assign (segid " A" and resid 21 and name HN) (segid " A" and resid 21 and name HB) 2.379 0.707 0.707 weight 1.000 ! spec=15N_...last, no=269, id=603, vol=3.172500e+07 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 21 and name HG11) 2.283 0.652 0.652 weight 1.000 ! spec=15N_...last, no=270, id=604, vol=2.030253e+07 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 22 and name HB2) 2.082 0.542 0.542 weight 1.000 ! spec=15N_...last, no=278, id=607, vol=3.451726e+07 or (segid " A" and resid 22 and name HN) (segid " A" and resid 22 and name HB1) or (segid " A" and resid 22 and name HN) (segid " A" and resid 22 and name HB3) assign (segid " A" and resid 22 and name HN) (segid " A" and resid 21 and name HN) 2.486 0.773 0.773 weight 1.000 ! spec=15N_...last, no=279, id=608, vol=1.597568e+07 assign (segid " A" and resid 88 and name HN) (segid " A" and resid 87 and name HN) 2.566 0.823 0.823 weight 1.000 ! spec=15N_...last, no=281, id=610, vol=1.730116e+07 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 19 and name HA) 2.836 1.006 1.006 weight 1.000 ! spec=15N_...last, no=282, id=611, vol=1.040456e+07 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 21 and name HA) 3.300 1.361 1.361 weight 1.000 ! 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spec=15N_...last, no=301, id=620, vol=2.064709e+07 assign (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HB2) 2.371 0.703 0.703 weight 1.000 ! spec=15N_...last, no=302, id=621, vol=1.794252e+07 or (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HB1) or (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HB3) assign (segid " A" and resid 25 and name HN) (segid " A" and resid 25 and name HG22) 3.091 1.194 1.194 weight 1.000 ! spec=15N_...last, no=305, id=622, vol=2.335660e+07 or (segid " A" and resid 25 and name HN) (segid " A" and resid 25 and name HG21) or (segid " A" and resid 25 and name HN) (segid " A" and resid 25 and name HG23) assign (segid " A" and resid 27 and name HN) (segid " A" and resid 31 and name HN) 4.195 2.200 2.200 weight 1.000 ! spec=15N_...last, no=307, id=623, vol=1.926735e+06 assign (segid " A" and resid 27 and name HN) (segid " A" and resid 26 and name HA) 3.306 1.366 1.366 weight 1.000 ! spec=15N_...last, no=310, id=625, vol=5.274774e+06 assign (segid " A" and resid 27 and name HN) (segid " A" and resid 25 and name HA) 3.747 1.755 1.755 weight 1.000 ! 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spec=15N_...last, no=403, id=694, vol=2.279230e+07 assign (segid " A" and resid 37 and name HN) (segid " A" and resid 36 and name HA) 2.474 0.765 0.765 weight 1.000 ! spec=15N_...last, no=404, id=695, vol=2.384300e+07 assign (segid " A" and resid 36 and name HN) (segid " A" and resid 35 and name HB) 2.594 0.841 0.841 weight 1.000 ! spec=15N_...last, no=407, id=696, vol=1.535587e+07 assign (segid " A" and resid 104 and name HN) (segid " A" and resid 103 and name HB1) 3.430 1.471 1.471 weight 1.000 ! spec=15N_...last, no=408, id=697, vol=8.832479e+06 assign (segid " A" and resid 104 and name HN) (segid " A" and resid 104 and name HG2) 3.358 1.410 1.410 weight 1.000 ! spec=15N_...last, no=409, id=698, vol=1.464448e+07 assign (segid " A" and resid 104 and name HN) (segid " A" and resid 103 and name HB2) 2.822 0.995 0.995 weight 1.000 ! spec=15N_...last, no=410, id=699, vol=1.017858e+07 assign (segid " A" and resid 104 and name HN) (segid " A" and resid 104 and name HB2) 2.653 0.880 0.880 weight 1.000 ! spec=15N_...last, no=411, id=700, vol=1.161455e+07 assign (segid " A" and resid 104 and name HN) (segid " A" and resid 104 and name HA) 2.728 0.930 0.930 weight 1.000 ! spec=15N_...last, no=412, id=701, vol=1.428432e+07 assign (segid " A" and resid 36 and name HN) (segid " A" and resid 35 and name HG21) 3.727 1.736 1.736 weight 1.000 ! spec=15N_...last, no=417, id=703, vol=8.866003e+06 or (segid " A" and resid 36 and name HN) (segid " A" and resid 35 and name HG22) or (segid " A" and resid 36 and name HN) (segid " A" and resid 35 and name HG23) assign (segid " A" and resid 36 and name HN) (segid " A" and resid 49 and name HG22) 2.707 0.916 0.916 weight 1.000 ! spec=15N_...last, no=418, id=704, vol=1.027080e+07 or (segid " A" and resid 36 and name HN) (segid " A" and resid 49 and name HG21) or (segid " A" and resid 36 and name HN) (segid " A" and resid 49 and name HG23) assign (segid " A" and resid 50 and name HN) (segid " A" and resid 50 and name HA) 3.013 1.135 1.135 weight 1.000 ! spec=15N_...last, no=423, id=706, vol=6.062004e+06 assign (segid " A" and resid 50 and name HN) (segid " A" and resid 50 and name HB1) 3.074 1.181 1.181 weight 1.000 ! spec=15N_...last, no=425, id=708, vol=7.478462e+06 assign (segid " A" and resid 50 and name HN) (segid " A" and resid 49 and name HG12) 3.055 1.167 1.167 weight 1.000 ! spec=15N_...last, no=427, id=709, vol=1.072541e+07 or (segid " A" and resid 50 and name HN) (segid " A" and resid 49 and name HG11) or (segid " A" and resid 50 and name HN) (segid " A" and resid 49 and name HG13) assign (segid " A" and resid 50 and name HN) (segid " A" and resid 49 and name HG22) 2.618 0.857 0.857 weight 1.000 ! spec=15N_...last, no=428, id=710, vol=1.243864e+07 or (segid " A" and resid 50 and name HN) (segid " A" and resid 49 and name HG21) or (segid " A" and resid 50 and name HN) (segid " A" and resid 49 and name HG23) assign (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HA) 3.119 1.216 1.216 weight 1.000 ! spec=15N_...last, no=435, id=713, vol=5.140432e+06 assign (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HB) 2.516 0.791 0.791 weight 1.000 ! spec=15N_...last, no=436, id=714, vol=1.319713e+07 assign (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HG12) 3.448 1.486 1.486 weight 1.000 ! spec=15N_...last, no=440, id=715, vol=7.983276e+06 or (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HG11) or (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HG13) assign (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HG22) 2.254 0.635 0.635 weight 1.000 ! spec=15N_...last, no=441, id=716, vol=2.561001e+07 or (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HG21) or (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HG23) assign (segid " A" and resid 39 and name HN) (segid " A" and resid 38 and name HN) 4.706 2.768 2.768 weight 1.000 ! spec=15N_...last, no=442, id=717, vol=2.016998e+06 assign (segid " A" and resid 39 and name HN) (segid " A" and resid 39 and name HA2) 2.878 1.035 1.035 weight 1.000 ! spec=15N_...last, no=445, id=720, vol=2.214551e+07 assign (segid " A" and resid 39 and name HN) (segid " A" and resid 38 and name HG12) 2.955 1.092 1.092 weight 1.000 ! spec=15N_...last, no=449, id=721, vol=1.145867e+07 or (segid " A" and resid 39 and name HN) (segid " A" and resid 38 and name HG11) or (segid " A" and resid 39 and name HN) (segid " A" and resid 38 and name HG13) assign (segid " A" and resid 39 and name HN) (segid " A" and resid 38 and name HG22) 3.912 1.913 1.913 weight 1.000 ! 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spec=15N_...last, no=457, id=727, vol=1.241333e+07 assign (segid " A" and resid 40 and name HN) (segid " A" and resid 40 and name HB2) 2.857 1.020 1.020 weight 1.000 ! spec=15N_...last, no=458, id=728, vol=1.172429e+07 assign (segid " A" and resid 40 and name HN) (segid " A" and resid 40 and name HB1) 2.878 1.035 1.035 weight 1.000 ! spec=15N_...last, no=459, id=729, vol=1.196958e+07 assign (segid " A" and resid 84 and name HN) (segid " A" and resid 83 and name HN) 3.874 1.876 1.876 weight 1.000 ! spec=15N_...last, no=464, id=730, vol=1.791967e+06 assign (segid " A" and resid 41 and name HN) (segid " A" and resid 40 and name HD1) 3.915 1.916 1.916 weight 1.000 ! spec=15N_...last, no=465, id=731, vol=5.152672e+06 or (segid " A" and resid 41 and name HN) (segid " A" and resid 40 and name HD2) assign (segid " A" and resid 41 and name HN) (segid " A" and resid 40 and name HA) 2.291 0.656 0.656 weight 1.000 ! spec=15N_...last, no=467, id=732, vol=2.211708e+07 assign (segid " A" and resid 41 and name HN) (segid " A" and resid 41 and name HA2) 2.981 1.111 1.111 weight 1.000 ! spec=15N_...last, no=468, id=733, vol=1.267186e+07 assign (segid " A" and resid 34 and name HN) (segid " A" and resid 34 and name HD2) 4.661 2.715 2.715 weight 1.000 ! spec=15N_...last, no=471, id=734, vol=2.496308e+06 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 38 and name HG12) 3.614 1.633 1.633 weight 1.000 ! spec=15N_...last, no=473, id=736, vol=6.658936e+06 or (segid " A" and resid 48 and name HN) (segid " A" and resid 38 and name HG11) or (segid " A" and resid 48 and name HN) (segid " A" and resid 38 and name HG13) assign (segid " A" and resid 48 and name HN) (segid " A" and resid 38 and name HG22) 3.793 1.798 1.798 weight 1.000 ! spec=15N_...last, no=474, id=737, vol=7.117889e+06 or (segid " A" and resid 48 and name HN) (segid " A" and resid 38 and name HG21) or (segid " A" and resid 48 and name HN) (segid " A" and resid 38 and name HG23) assign (segid " A" and resid 30 and name HD22) (segid " A" and resid 30 and name HD21) 1.678 0.352 0.352 weight 1.000 ! 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spec=15N_...last, no=496, id=746, vol=1.701476e+07 or (segid " A" and resid 49 and name HN) (segid " A" and resid 49 and name HG11) or (segid " A" and resid 49 and name HN) (segid " A" and resid 49 and name HG13) assign (segid " A" and resid 49 and name HN) (segid " A" and resid 49 and name HG22) 3.313 1.372 1.372 weight 1.000 ! spec=15N_...last, no=498, id=747, vol=8.690234e+06 or (segid " A" and resid 49 and name HN) (segid " A" and resid 49 and name HG21) or (segid " A" and resid 49 and name HN) (segid " A" and resid 49 and name HG23) assign (segid " A" and resid 49 and name HN) (segid " A" and resid 70 and name HB1) 3.480 1.514 1.514 weight 1.000 ! spec=15N_...last, no=499, id=748, vol=8.567258e+06 assign (segid " A" and resid 51 and name HN) (segid " A" and resid 68 and name HN) 2.884 1.040 1.040 weight 1.000 ! spec=15N_...last, no=501, id=749, vol=7.860808e+06 assign (segid " A" and resid 51 and name HN) (segid " A" and resid 52 and name HN) 3.929 1.929 1.929 weight 1.000 ! spec=15N_...last, no=502, id=750, vol=4.181485e+06 assign (segid " A" and resid 51 and name HN) (segid " A" and resid 50 and name HA) 2.300 0.661 0.661 weight 1.000 ! spec=15N_...last, no=503, id=751, vol=2.535165e+07 assign (segid " A" and resid 51 and name HN) (segid " A" and resid 69 and name HA) 3.431 1.471 1.471 weight 1.000 ! spec=15N_...last, no=504, id=752, vol=8.514305e+06 assign (segid " A" and resid 51 and name HN) (segid " A" and resid 51 and name HG22) 3.525 1.554 1.554 weight 1.000 ! spec=15N_...last, no=507, id=754, vol=7.904554e+06 or (segid " A" and resid 51 and name HN) (segid " A" and resid 51 and name HG21) or (segid " A" and resid 51 and name HN) (segid " A" and resid 51 and name HG23) assign (segid " A" and resid 67 and name HN) (segid " A" and resid 68 and name HN) 3.495 1.527 1.527 weight 1.000 ! spec=15N_...last, no=508, id=755, vol=6.811194e+06 assign (segid " A" and resid 52 and name HN) (segid " A" and resid 35 and name HA) 3.335 1.390 1.390 weight 1.000 ! spec=15N_...last, no=513, id=759, vol=5.948020e+06 assign (segid " A" and resid 52 and name HN) (segid " A" and resid 52 and name HA) 2.768 0.958 0.958 weight 1.000 ! spec=15N_...last, no=514, id=760, vol=1.066411e+07 assign (segid " A" and resid 52 and name HN) (segid " A" and resid 51 and name HA) 2.141 0.573 0.573 weight 1.000 ! spec=15N_...last, no=515, id=761, vol=3.659676e+07 assign (segid " A" and resid 67 and name HN) (segid " A" and resid 67 and name HB1) 2.842 1.010 1.010 weight 1.000 ! spec=15N_...last, no=516, id=762, vol=8.693709e+06 assign (segid " A" and resid 52 and name HN) (segid " A" and resid 52 and name HB) 2.739 0.938 0.938 weight 1.000 ! spec=15N_...last, no=517, id=763, vol=9.948246e+06 assign (segid " A" and resid 52 and name HN) (segid " A" and resid 35 and name HG21) 2.952 1.090 1.090 weight 1.000 ! spec=15N_...last, no=518, id=764, vol=1.920395e+07 or (segid " A" and resid 52 and name HN) (segid " A" and resid 35 and name HG22) or (segid " A" and resid 52 and name HN) (segid " A" and resid 35 and name HG23) assign (segid " A" and resid 52 and name HN) (segid " A" and resid 52 and name HG22) 2.465 0.759 0.759 weight 1.000 ! spec=15N_...last, no=519, id=765, vol=2.748618e+07 or (segid " A" and resid 52 and name HN) (segid " A" and resid 52 and name HG21) or (segid " A" and resid 52 and name HN) (segid " A" and resid 52 and name HG23) assign (segid " A" and resid 52 and name HN) (segid " A" and resid 51 and name HG22) 2.519 0.793 0.793 weight 1.000 ! spec=15N_...last, no=520, id=766, vol=2.414946e+07 or (segid " A" and resid 52 and name HN) (segid " A" and resid 51 and name HG21) or (segid " A" and resid 52 and name HN) (segid " A" and resid 51 and name HG23) assign (segid " A" and resid 53 and name HN) (segid " A" and resid 53 and name HB2) 2.490 0.775 0.775 weight 1.000 ! spec=15N_...last, no=524, id=767, vol=1.382012e+07 or (segid " A" and resid 53 and name HN) (segid " A" and resid 53 and name HB1) or (segid " A" and resid 53 and name HN) (segid " A" and resid 53 and name HB3) assign (segid " A" and resid 53 and name HN) (segid " A" and resid 52 and name HB) 3.432 1.472 1.472 weight 1.000 ! spec=15N_...last, no=526, id=768, vol=7.119266e+06 assign (segid " A" and resid 53 and name HN) (segid " A" and resid 67 and name HA) 3.964 1.964 1.964 weight 1.000 ! spec=15N_...last, no=529, id=769, vol=4.275232e+06 assign (segid " A" and resid 56 and name HN) (segid " A" and resid 56 and name HB2) 2.603 0.847 0.847 weight 1.000 ! spec=15N_...last, no=540, id=772, vol=1.015236e+07 or (segid " A" and resid 56 and name HN) (segid " A" and resid 56 and name HB1) or (segid " A" and resid 56 and name HN) (segid " A" and resid 56 and name HB3) assign (segid " A" and resid 56 and name HN) (segid " A" and resid 56 and name HA) 2.844 1.011 1.011 weight 1.000 ! spec=15N_...last, no=541, id=773, vol=8.491575e+06 assign (segid " A" and resid 56 and name HN) (segid " A" and resid 55 and name HA) 2.567 0.824 0.824 weight 1.000 ! spec=15N_...last, no=542, id=774, vol=1.438055e+07 assign (segid " A" and resid 57 and name HN) (segid " A" and resid 57 and name HA) 3.390 1.437 1.437 weight 1.000 ! spec=15N_...last, no=544, id=776, vol=4.770824e+06 assign (segid " A" and resid 57 and name HN) (segid " A" and resid 56 and name HA) 2.722 0.926 0.926 weight 1.000 ! spec=15N_...last, no=545, id=777, vol=1.247714e+07 assign (segid " A" and resid 57 and name HN) (segid " A" and resid 57 and name HB2) 2.465 0.760 0.760 weight 1.000 ! spec=15N_...last, no=548, id=779, vol=2.510133e+07 assign (segid " A" and resid 57 and name HN) (segid " A" and resid 56 and name HB2) 2.683 0.900 0.900 weight 1.000 ! spec=15N_...last, no=549, id=780, vol=1.065162e+07 or (segid " A" and resid 57 and name HN) (segid " A" and resid 56 and name HB1) or (segid " A" and resid 57 and name HN) (segid " A" and resid 56 and name HB3) assign (segid " A" and resid 117 and name HN) (segid " A" and resid 117 and name HA) 2.876 1.034 1.034 weight 1.000 ! spec=15N_...last, no=552, id=782, vol=1.040110e+07 assign (segid " A" and resid 59 and name HN) (segid " A" and resid 59 and name HB) 2.914 1.061 1.061 weight 1.000 ! spec=15N_...last, no=553, id=783, vol=6.171478e+06 assign (segid " A" and resid 59 and name HN) (segid " A" and resid 58 and name HA) 2.816 0.991 0.991 weight 1.000 ! spec=15N_...last, no=557, id=786, vol=1.072093e+07 assign (segid " A" and resid 60 and name HN) (segid " A" and resid 59 and name HN) 3.232 1.306 1.306 weight 1.000 ! spec=15N_...last, no=558, id=787, vol=2.853956e+06 assign (segid " A" and resid 60 and name HN) (segid " A" and resid 60 and name HA) 2.995 1.121 1.121 weight 1.000 ! spec=15N_...last, no=561, id=788, vol=6.435902e+06 assign (segid " A" and resid 60 and name HN) (segid " A" and resid 59 and name HA) 2.450 0.750 0.750 weight 1.000 ! spec=15N_...last, no=562, id=789, vol=1.720735e+07 assign (segid " A" and resid 60 and name HN) (segid " A" and resid 59 and name HB) 3.263 1.331 1.331 weight 1.000 ! spec=15N_...last, no=564, id=791, vol=5.751818e+06 assign (segid " A" and resid 61 and name HN) (segid " A" and resid 60 and name HA) 2.565 0.822 0.822 weight 1.000 ! spec=15N_...last, no=568, id=795, vol=1.565691e+07 assign (segid " A" and resid 61 and name HN) (segid " A" and resid 61 and name HA1) 3.154 1.244 1.244 weight 1.000 ! spec=15N_...last, no=569, id=796, vol=6.140518e+06 assign (segid " A" and resid 61 and name HN) (segid " A" and resid 61 and name HA2) 2.854 1.018 1.018 weight 1.000 ! spec=15N_...last, no=570, id=797, vol=1.298097e+07 assign (segid " A" and resid 61 and name HN) (segid " A" and resid 60 and name HB2) 3.740 1.749 1.749 weight 1.000 ! spec=15N_...last, no=571, id=798, vol=1.013407e+07 assign (segid " A" and resid 62 and name HN) (segid " A" and resid 62 and name HD1) 4.047 2.048 2.048 weight 1.000 ! spec=15N_...last, no=573, id=800, vol=3.974766e+06 or (segid " A" and resid 62 and name HN) (segid " A" and resid 62 and name HD2) assign (segid " A" and resid 62 and name HN) (segid " A" and resid 62 and name HA) 3.460 1.497 1.497 weight 1.000 ! spec=15N_...last, no=575, id=801, vol=3.816638e+06 assign (segid " A" and resid 62 and name HN) (segid " A" and resid 61 and name HA1) 2.766 0.957 0.957 weight 1.000 ! spec=15N_...last, no=577, id=802, vol=1.023793e+07 assign (segid " A" and resid 62 and name HN) (segid " A" and resid 61 and name HA2) 4.112 2.114 2.114 weight 1.000 ! spec=15N_...last, no=578, id=803, vol=6.972861e+06 assign (segid " A" and resid 62 and name HN) (segid " A" and resid 62 and name HB1) 4.118 2.119 2.119 weight 1.000 ! spec=15N_...last, no=579, id=804, vol=4.710315e+06 assign (segid " A" and resid 62 and name HN) (segid " A" and resid 62 and name HB2) 2.970 1.103 1.103 weight 1.000 ! spec=15N_...last, no=580, id=805, vol=6.403072e+06 assign (segid " A" and resid 63 and name HN) (segid " A" and resid 63 and name HA) 2.862 1.024 1.024 weight 1.000 ! spec=15N_...last, no=582, id=806, vol=1.079642e+07 assign (segid " A" and resid 63 and name HN) (segid " A" and resid 63 and name HB2) 2.322 0.674 0.674 weight 1.000 ! spec=15N_...last, no=583, id=807, vol=2.154283e+07 or (segid " A" and resid 63 and name HN) (segid " A" and resid 63 and name HB1) or (segid " A" and resid 63 and name HN) (segid " A" and resid 63 and name HB3) assign (segid " A" and resid 63 and name HN) (segid " A" and resid 62 and name HB2) 3.742 1.750 1.750 weight 1.000 ! spec=15N_...last, no=584, id=808, vol=1.010850e+07 assign (segid " A" and resid 63 and name HN) (segid " A" and resid 62 and name HB1) 2.929 1.072 1.072 weight 1.000 ! spec=15N_...last, no=586, id=809, vol=1.217474e+07 assign (segid " A" and resid 63 and name HN) (segid " A" and resid 62 and name HA) 2.591 0.839 0.839 weight 1.000 ! spec=15N_...last, no=587, id=810, vol=1.645112e+07 assign (segid " A" and resid 63 and name HN) (segid " A" and resid 62 and name HD1) 5.165 3.335 3.335 weight 1.000 ! spec=15N_...last, no=588, id=811, vol=2.847854e+06 or (segid " A" and resid 63 and name HN) (segid " A" and resid 62 and name HD2) assign (segid " A" and resid 64 and name HN) (segid " A" and resid 64 and name HA) 2.958 1.094 1.094 weight 1.000 ! spec=15N_...last, no=590, id=813, vol=8.582483e+06 assign (segid " A" and resid 64 and name HN) (segid " A" and resid 63 and name HA) 2.700 0.911 0.911 weight 1.000 ! spec=15N_...last, no=591, id=814, vol=1.604315e+07 assign (segid " A" and resid 64 and name HN) (segid " A" and resid 64 and name HB1) 3.660 1.675 1.675 weight 1.000 ! spec=15N_...last, no=592, id=815, vol=1.122944e+07 assign (segid " A" and resid 64 and name HN) (segid " A" and resid 62 and name HB1) 3.587 1.609 1.609 weight 1.000 ! spec=15N_...last, no=593, id=816, vol=4.057867e+06 assign (segid " A" and resid 64 and name HN) (segid " A" and resid 64 and name HB2) 2.606 0.849 0.849 weight 1.000 ! spec=15N_...last, no=594, id=817, vol=1.525084e+07 assign (segid " A" and resid 64 and name HN) (segid " A" and resid 63 and name HB2) 3.104 1.204 1.204 weight 1.000 ! spec=15N_...last, no=598, id=818, vol=1.797736e+07 or (segid " A" and resid 64 and name HN) (segid " A" and resid 63 and name HB1) or (segid " A" and resid 64 and name HN) (segid " A" and resid 63 and name HB3) assign (segid " A" and resid 64 and name HN) (segid " A" and resid 64 and name HD2) 3.308 1.368 1.368 weight 1.000 ! 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spec=15N_...last, no=608, id=825, vol=7.147433e+06 assign (segid " A" and resid 66 and name HN) (segid " A" and resid 66 and name HB2) 2.722 0.926 0.926 weight 1.000 ! spec=15N_...last, no=613, id=827, vol=1.465264e+07 assign (segid " A" and resid 66 and name HN) (segid " A" and resid 66 and name HB1) 2.467 0.761 0.761 weight 1.000 ! spec=15N_...last, no=614, id=828, vol=1.471236e+07 assign (segid " A" and resid 66 and name HN) (segid " A" and resid 66 and name HD22) 3.817 1.821 1.821 weight 1.000 ! spec=15N_...last, no=615, id=829, vol=8.398697e+06 or (segid " A" and resid 66 and name HN) (segid " A" and resid 66 and name HD21) or (segid " A" and resid 66 and name HN) (segid " A" and resid 66 and name HD23) assign (segid " A" and resid 67 and name HN) (segid " A" and resid 67 and name HA) 3.091 1.195 1.195 weight 1.000 ! spec=15N_...last, no=617, id=830, vol=6.045414e+06 assign (segid " A" and resid 67 and name HN) (segid " A" and resid 66 and name HA) 2.240 0.627 0.627 weight 1.000 ! spec=15N_...last, no=618, id=831, vol=2.947973e+07 assign (segid " A" and resid 67 and name HN) (segid " A" and resid 67 and name HB2) 3.367 1.417 1.417 weight 1.000 ! spec=15N_...last, no=619, id=832, vol=5.826173e+06 assign (segid " A" and resid 67 and name HN) (segid " A" and resid 66 and name HB2) 3.795 1.801 1.801 weight 1.000 ! spec=15N_...last, no=620, id=833, vol=1.072200e+07 assign (segid " A" and resid 67 and name HD21) (segid " A" and resid 67 and name HB2) 3.491 1.523 1.523 weight 1.000 ! spec=15N_...last, no=627, id=834, vol=1.070109e+07 assign (segid " A" and resid 68 and name HN) (segid " A" and resid 67 and name HA) 2.241 0.628 0.628 weight 1.000 ! spec=15N_...last, no=644, id=836, vol=3.180776e+07 assign (segid " A" and resid 68 and name HN) (segid " A" and resid 50 and name HA) 4.416 2.437 2.437 weight 1.000 ! spec=15N_...last, no=646, id=838, vol=2.855928e+06 assign (segid " A" and resid 68 and name HN) (segid " A" and resid 67 and name HB2) 4.798 2.877 2.877 weight 1.000 ! spec=15N_...last, no=651, id=840, vol=3.276413e+06 assign (segid " A" and resid 68 and name HN) (segid " A" and resid 51 and name HB) 3.207 1.285 1.285 weight 1.000 ! spec=15N_...last, no=652, id=841, vol=5.940112e+06 assign (segid " A" and resid 69 and name HN) (segid " A" and resid 70 and name HN) 4.141 2.143 2.143 weight 1.000 ! spec=15N_...last, no=656, id=844, vol=2.750479e+06 assign (segid " A" and resid 69 and name HN) (segid " A" and resid 123 and name HN) 2.901 1.052 1.052 weight 1.000 ! spec=15N_...last, no=657, id=845, vol=1.095153e+07 assign (segid " A" and resid 69 and name HN) (segid " A" and resid 121 and name HN) 4.162 2.166 2.166 weight 1.000 ! spec=15N_...last, no=658, id=846, vol=1.993072e+06 assign (segid " A" and resid 69 and name HN) (segid " A" and resid 68 and name HA) 2.105 0.554 0.554 weight 1.000 ! spec=15N_...last, no=659, id=847, vol=3.409124e+07 assign (segid " A" and resid 69 and name HN) (segid " A" and resid 69 and name HA) 2.889 1.043 1.043 weight 1.000 ! spec=15N_...last, no=661, id=848, vol=6.604959e+06 assign (segid " A" and resid 69 and name HN) (segid " A" and resid 122 and name HA) 2.558 0.818 0.818 weight 1.000 ! spec=15N_...last, no=662, id=849, vol=1.229318e+07 assign (segid " A" and resid 69 and name HN) (segid " A" and resid 68 and name HB2) 3.355 1.407 1.407 weight 1.000 ! spec=15N_...last, no=663, id=850, vol=1.460845e+07 assign (segid " A" and resid 69 and name HN) (segid " A" and resid 69 and name HB2) 2.331 0.679 0.679 weight 1.000 ! spec=15N_...last, no=665, id=851, vol=1.701313e+07 or (segid " A" and resid 69 and name HN) (segid " A" and resid 69 and name HB1) or (segid " A" and resid 69 and name HN) (segid " A" and resid 69 and name HB3) assign (segid " A" and resid 69 and name HN) (segid " A" and resid 122 and name HD22) 2.432 0.740 0.740 weight 1.000 ! spec=15N_...last, no=667, id=852, vol=1.843142e+07 or (segid " A" and resid 69 and name HN) (segid " A" and resid 122 and name HD21) or (segid " A" and resid 69 and name HN) (segid " A" and resid 122 and name HD23) assign (segid " A" and resid 72 and name HE1) (segid " A" and resid 127 and name HN) 4.320 2.333 2.333 weight 1.000 ! spec=15N_...last, no=669, id=853, vol=3.655313e+06 assign (segid " A" and resid 71 and name HN) (segid " A" and resid 70 and name HN) 4.292 2.302 2.302 weight 1.000 ! spec=15N_...last, no=672, id=854, vol=3.222862e+06 assign (segid " A" and resid 71 and name HN) (segid " A" and resid 125 and name HN) 4.030 2.030 2.030 weight 1.000 ! spec=15N_...last, no=675, id=855, vol=4.011516e+06 assign (segid " A" and resid 71 and name HN) (segid " A" and resid 70 and name HA) 2.083 0.542 0.542 weight 1.000 ! spec=15N_...last, no=676, id=856, vol=4.944868e+07 assign (segid " A" and resid 71 and name HN) (segid " A" and resid 71 and name HB) 3.830 1.834 1.834 weight 1.000 ! spec=15N_...last, no=677, id=857, vol=3.543926e+06 assign (segid " A" and resid 71 and name HN) (segid " A" and resid 124 and name HA2) 3.220 1.296 1.296 weight 1.000 ! spec=15N_...last, no=678, id=858, vol=5.000380e+06 assign (segid " A" and resid 71 and name HN) (segid " A" and resid 70 and name HB2) 4.465 2.492 2.492 weight 1.000 ! spec=15N_...last, no=679, id=859, vol=3.239280e+06 assign (segid " A" and resid 71 and name HN) (segid " A" and resid 71 and name HG21) 2.702 0.913 0.913 weight 1.000 ! spec=15N_...last, no=681, id=860, vol=1.181505e+07 or (segid " A" and resid 71 and name HN) (segid " A" and resid 71 and name HG22) or (segid " A" and resid 71 and name HN) (segid " A" and resid 71 and name HG23) assign (segid " A" and resid 71 and name HN) (segid " A" and resid 70 and name HB1) 3.032 1.149 1.149 weight 1.000 ! spec=15N_...last, no=682, id=861, vol=1.189498e+07 assign (segid " A" and resid 71 and name HN) (segid " A" and resid 70 and name HD22) 3.879 1.880 1.880 weight 1.000 ! spec=15N_...last, no=683, id=862, vol=5.111582e+06 or (segid " A" and resid 71 and name HN) (segid " A" and resid 70 and name HD21) or (segid " A" and resid 71 and name HN) (segid " A" and resid 70 and name HD23) assign (segid " A" and resid 71 and name HN) (segid " A" and resid 126 and name HD12) 2.736 0.936 0.936 weight 1.000 ! spec=15N_...last, no=684, id=863, vol=8.859629e+06 or (segid " A" and resid 71 and name HN) (segid " A" and resid 126 and name HD11) or (segid " A" and resid 71 and name HN) (segid " A" and resid 126 and name HD13) assign (segid " A" and resid 73 and name HN) (segid " A" and resid 72 and name HN) 4.714 2.778 2.778 weight 1.000 ! spec=15N_...last, no=685, id=864, vol=1.817877e+06 assign (segid " A" and resid 73 and name HN) (segid " A" and resid 73 and name HA) 2.244 0.630 0.630 weight 1.000 ! spec=15N_...last, no=687, id=865, vol=4.112932e+07 assign (segid " A" and resid 73 and name HN) (segid " A" and resid 72 and name HB1) 3.282 1.347 1.347 weight 1.000 ! spec=15N_...last, no=689, id=866, vol=4.168322e+06 assign (segid " A" and resid 73 and name HN) (segid " A" and resid 73 and name HB2) 2.402 0.721 0.721 weight 1.000 ! spec=15N_...last, no=690, id=867, vol=2.606420e+07 assign (segid " A" and resid 73 and name HN) (segid " A" and resid 126 and name HB2) 3.891 1.892 1.892 weight 1.000 ! spec=15N_...last, no=691, id=868, vol=4.678292e+06 assign (segid " A" and resid 74 and name HN) (segid " A" and resid 73 and name HA) 2.465 0.760 0.760 weight 1.000 ! spec=15N_...last, no=694, id=870, vol=1.883198e+07 assign (segid " A" and resid 74 and name HN) (segid " A" and resid 74 and name HB) 2.906 1.055 1.055 weight 1.000 ! spec=15N_...last, no=695, id=871, vol=8.853399e+06 assign (segid " A" and resid 74 and name HN) (segid " A" and resid 74 and name HA) 3.265 1.332 1.332 weight 1.000 ! spec=15N_...last, no=696, id=872, vol=4.303559e+06 assign (segid " A" and resid 74 and name HN) (segid " A" and resid 73 and name HB1) 3.557 1.581 1.581 weight 1.000 ! spec=15N_...last, no=697, id=873, vol=4.342714e+06 assign (segid " A" and resid 74 and name HN) (segid " A" and resid 74 and name HG21) 4.380 2.398 2.398 weight 1.000 ! spec=15N_...last, no=698, id=874, vol=3.219812e+06 or (segid " A" and resid 74 and name HN) (segid " A" and resid 74 and name HG22) or (segid " A" and resid 74 and name HN) (segid " A" and resid 74 and name HG23) assign (segid " A" and resid 74 and name HN) (segid " A" and resid 75 and name HN) 3.343 1.397 1.397 weight 1.000 ! spec=15N_...last, no=699, id=875, vol=3.679476e+06 assign (segid " A" and resid 75 and name HN) (segid " A" and resid 77 and name HN) 3.501 1.532 1.532 weight 1.000 ! spec=15N_...last, no=700, id=876, vol=5.581156e+06 assign (segid " A" and resid 75 and name HN) (segid " A" and resid 75 and name HA) 3.008 1.131 1.131 weight 1.000 ! spec=15N_...last, no=702, id=878, vol=9.997612e+06 assign (segid " A" and resid 75 and name HN) (segid " A" and resid 74 and name HB) 2.797 0.978 0.978 weight 1.000 ! spec=15N_...last, no=703, id=879, vol=1.053335e+07 assign (segid " A" and resid 75 and name HN) (segid " A" and resid 74 and name HA) 3.513 1.543 1.543 weight 1.000 ! spec=15N_...last, no=704, id=880, vol=3.824290e+06 assign (segid " A" and resid 75 and name HN) (segid " A" and resid 76 and name HN) 2.765 0.956 0.956 weight 1.000 ! spec=15N_...last, no=707, id=882, vol=1.014424e+07 assign (segid " A" and resid 76 and name HN) (segid " A" and resid 75 and name HA) 3.724 1.734 1.734 weight 1.000 ! spec=15N_...last, no=709, id=884, vol=3.439294e+06 assign (segid " A" and resid 76 and name HN) (segid " A" and resid 76 and name HA) 3.099 1.201 1.201 weight 1.000 ! spec=15N_...last, no=711, id=885, vol=6.792675e+06 assign (segid " A" and resid 77 and name HN) (segid " A" and resid 77 and name HA) 3.023 1.142 1.142 weight 1.000 ! spec=15N_...last, no=713, id=886, vol=6.832894e+06 assign (segid " A" and resid 77 and name HN) (segid " A" and resid 73 and name HB2) 3.718 1.728 1.728 weight 1.000 ! spec=15N_...last, no=714, id=887, vol=6.659133e+06 assign (segid " A" and resid 77 and name HN) (segid " A" and resid 77 and name HB) 2.309 0.666 0.666 weight 1.000 ! spec=15N_...last, no=716, id=889, vol=2.710000e+07 assign (segid " A" and resid 77 and name HN) (segid " A" and resid 77 and name HG12) 3.718 1.728 1.728 weight 1.000 ! spec=15N_...last, no=718, id=891, vol=6.678648e+06 assign (segid " A" and resid 78 and name HN) (segid " A" and resid 75 and name HA) 3.241 1.313 1.313 weight 1.000 ! spec=15N_...last, no=721, id=893, vol=6.292903e+06 assign (segid " A" and resid 78 and name HN) (segid " A" and resid 78 and name HA) 2.917 1.063 1.063 weight 1.000 ! spec=15N_...last, no=722, id=894, vol=1.062491e+07 assign (segid " A" and resid 78 and name HN) (segid " A" and resid 77 and name HB) 2.583 0.834 0.834 weight 1.000 ! spec=15N_...last, no=725, id=896, vol=1.282547e+07 assign (segid " A" and resid 78 and name HN) (segid " A" and resid 77 and name HG22) 3.737 1.746 1.746 weight 1.000 ! spec=15N_...last, no=726, id=897, vol=3.994175e+06 or (segid " A" and resid 78 and name HN) (segid " A" and resid 77 and name HG21) or (segid " A" and resid 78 and name HN) (segid " A" and resid 77 and name HG23) assign (segid " A" and resid 78 and name HN) (segid " A" and resid 79 and name HN) 2.773 0.961 0.961 weight 1.000 ! spec=15N_...last, no=727, id=898, vol=9.951167e+06 assign (segid " A" and resid 79 and name HN) (segid " A" and resid 79 and name HA) 2.663 0.887 0.887 weight 1.000 ! spec=15N_...last, no=728, id=899, vol=1.582966e+07 assign (segid " A" and resid 79 and name HN) (segid " A" and resid 78 and name HA) 3.376 1.425 1.425 weight 1.000 ! spec=15N_...last, no=729, id=900, vol=5.922037e+06 assign (segid " A" and resid 79 and name HN) (segid " A" and resid 77 and name HA) 3.770 1.776 1.776 weight 1.000 ! spec=15N_...last, no=730, id=901, vol=3.030347e+06 assign (segid " A" and resid 80 and name HN) (segid " A" and resid 80 and name HD12) 3.912 1.913 1.913 weight 1.000 ! spec=15N_...last, no=735, id=904, vol=6.180755e+06 or (segid " A" and resid 80 and name HN) (segid " A" and resid 80 and name HD11) or (segid " A" and resid 80 and name HN) (segid " A" and resid 80 and name HD13) assign (segid " A" and resid 80 and name HN) (segid " A" and resid 80 and name HA) 2.792 0.974 0.974 weight 1.000 ! spec=15N_...last, no=736, id=905, vol=1.100069e+07 assign (segid " A" and resid 80 and name HN) (segid " A" and resid 77 and name HA) 3.272 1.338 1.338 weight 1.000 ! spec=15N_...last, no=737, id=906, vol=5.456910e+06 assign (segid " A" and resid 80 and name HN) (segid " A" and resid 81 and name HG1) 3.894 1.895 1.895 weight 1.000 ! spec=15N_...last, no=739, id=907, vol=4.686418e+06 assign (segid " A" and resid 80 and name HN) (segid " A" and resid 79 and name HB1) 2.829 1.001 1.001 weight 1.000 ! spec=15N_...last, no=740, id=908, vol=1.207691e+07 assign (segid " A" and resid 80 and name HN) (segid " A" and resid 80 and name HB2) 2.687 0.902 0.902 weight 1.000 ! spec=15N_...last, no=741, id=909, vol=8.925193e+06 assign (segid " A" and resid 80 and name HN) (segid " A" and resid 80 and name HD22) 3.677 1.690 1.690 weight 1.000 ! spec=15N_...last, no=742, id=910, vol=5.963731e+06 or (segid " A" and resid 80 and name HN) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 80 and name HN) (segid " A" and resid 80 and name HD23) assign (segid " A" and resid 81 and name HN) (segid " A" and resid 81 and name HA) 3.125 1.221 1.221 weight 1.000 ! spec=15N_...last, no=743, id=911, vol=8.085068e+06 assign (segid " A" and resid 81 and name HN) (segid " A" and resid 80 and name HN) 2.594 0.841 0.841 weight 1.000 ! spec=15N_...last, no=744, id=912, vol=1.351699e+07 assign (segid " A" and resid 81 and name HN) (segid " A" and resid 82 and name HN) 2.701 0.912 0.912 weight 1.000 ! spec=15N_...last, no=745, id=913, vol=1.254227e+07 assign (segid " A" and resid 81 and name HN) (segid " A" and resid 79 and name HA) 3.406 1.450 1.450 weight 1.000 ! spec=15N_...last, no=746, id=914, vol=3.183244e+06 assign (segid " A" and resid 81 and name HN) (segid " A" and resid 81 and name HG2) 3.410 1.453 1.453 weight 1.000 ! spec=15N_...last, no=748, id=916, vol=7.957192e+06 assign (segid " A" and resid 81 and name HN) (segid " A" and resid 81 and name HB2) 2.617 0.856 0.856 weight 1.000 ! spec=15N_...last, no=750, id=917, vol=1.842611e+07 assign (segid " A" and resid 81 and name HN) (segid " A" and resid 80 and name HB1) 3.576 1.598 1.598 weight 1.000 ! spec=15N_...last, no=752, id=918, vol=6.861037e+06 assign (segid " A" and resid 81 and name HN) (segid " A" and resid 80 and name HB2) 3.730 1.740 1.740 weight 1.000 ! spec=15N_...last, no=753, id=919, vol=2.239385e+06 assign (segid " A" and resid 82 and name HN) (segid " A" and resid 79 and name HA) 3.491 1.523 1.523 weight 1.000 ! spec=15N_...last, no=759, id=922, vol=4.707484e+06 assign (segid " A" and resid 82 and name HN) (segid " A" and resid 82 and name HB2) 2.482 0.770 0.770 weight 1.000 ! spec=15N_...last, no=762, id=924, vol=1.776679e+07 assign (segid " A" and resid 83 and name HN) (segid " A" and resid 82 and name HA) 2.935 1.077 1.077 weight 1.000 ! spec=15N_...last, no=765, id=925, vol=8.255026e+06 assign (segid " A" and resid 83 and name HN) (segid " A" and resid 83 and name HA) 3.068 1.177 1.177 weight 1.000 ! spec=15N_...last, no=766, id=926, vol=6.931580e+06 assign (segid " A" and resid 83 and name HN) (segid " A" and resid 82 and name HB1) 2.981 1.111 1.111 weight 1.000 ! spec=15N_...last, no=767, id=927, vol=8.278218e+06 assign (segid " A" and resid 83 and name HN) (segid " A" and resid 82 and name HB2) 4.333 2.347 2.347 weight 1.000 ! spec=15N_...last, no=768, id=928, vol=4.510126e+06 assign (segid " A" and resid 83 and name HN) (segid " A" and resid 83 and name HB2) 2.577 0.830 0.830 weight 1.000 ! spec=15N_...last, no=769, id=929, vol=1.195041e+07 or (segid " A" and resid 83 and name HN) (segid " A" and resid 83 and name HB1) or (segid " A" and resid 83 and name HN) (segid " A" and resid 83 and name HB3) assign (segid " A" and resid 84 and name HN) (segid " A" and resid 84 and name HA) 2.478 0.767 0.767 weight 1.000 ! spec=15N_...last, no=771, id=930, vol=3.246081e+07 assign (segid " A" and resid 84 and name HN) (segid " A" and resid 85 and name HA1) 4.578 2.620 2.620 weight 1.000 ! spec=15N_...last, no=772, id=931, vol=4.243221e+06 assign (segid " A" and resid 84 and name HN) (segid " A" and resid 83 and name HA) 3.338 1.393 1.393 weight 1.000 ! spec=15N_...last, no=773, id=932, vol=5.956497e+06 assign (segid " A" and resid 84 and name HN) (segid " A" and resid 84 and name HB1) 3.616 1.634 1.634 weight 1.000 ! spec=15N_...last, no=774, id=933, vol=5.838686e+06 assign (segid " A" and resid 84 and name HN) (segid " A" and resid 84 and name HB2) 3.258 1.327 1.327 weight 1.000 ! spec=15N_...last, no=775, id=934, vol=5.116532e+06 assign (segid " A" and resid 84 and name HN) (segid " A" and resid 83 and name HB2) 2.625 0.862 0.862 weight 1.000 ! spec=15N_...last, no=778, id=935, vol=1.162514e+07 or (segid " A" and resid 84 and name HN) (segid " A" and resid 83 and name HB1) or (segid " A" and resid 84 and name HN) (segid " A" and resid 83 and name HB3) assign (segid " A" and resid 85 and name HN) (segid " A" and resid 85 and name HA1) 2.413 0.728 0.728 weight 1.000 ! spec=15N_...last, no=781, id=936, vol=1.894916e+07 assign (segid " A" and resid 85 and name HN) (segid " A" and resid 85 and name HA2) 2.937 1.078 1.078 weight 1.000 ! spec=15N_...last, no=783, id=937, vol=1.635955e+07 assign (segid " A" and resid 86 and name HN) (segid " A" and resid 86 and name HB2) 2.133 0.569 0.569 weight 1.000 ! spec=15N_...last, no=786, id=938, vol=3.820844e+07 or (segid " A" and resid 86 and name HN) (segid " A" and resid 86 and name HB1) or (segid " A" and resid 86 and name HN) (segid " A" and resid 86 and name HB3) assign (segid " A" and resid 86 and name HN) (segid " A" and resid 85 and name HA2) 3.875 1.877 1.877 weight 1.000 ! spec=15N_...last, no=787, id=939, vol=4.220348e+06 assign (segid " A" and resid 86 and name HN) (segid " A" and resid 86 and name HA) 2.563 0.821 0.821 weight 1.000 ! spec=15N_...last, no=788, id=940, vol=2.069255e+07 assign (segid " A" and resid 86 and name HN) (segid " A" and resid 84 and name HA) 3.911 1.912 1.912 weight 1.000 ! spec=15N_...last, no=789, id=941, vol=2.970086e+06 assign (segid " A" and resid 86 and name HN) (segid " A" and resid 87 and name HN) 2.782 0.968 0.968 weight 1.000 ! spec=15N_...last, no=790, id=942, vol=1.176382e+07 assign (segid " A" and resid 86 and name HN) (segid " A" and resid 84 and name HN) 4.285 2.295 2.295 weight 1.000 ! spec=15N_...last, no=791, id=943, vol=2.409235e+06 assign (segid " A" and resid 88 and name HN) (segid " A" and resid 87 and name HA) 3.202 1.282 1.282 weight 1.000 ! spec=15N_...last, no=795, id=945, vol=6.757906e+06 assign (segid " A" and resid 88 and name HN) (segid " A" and resid 88 and name HA) 2.937 1.078 1.078 weight 1.000 ! spec=15N_...last, no=796, id=946, vol=9.819286e+06 assign (segid " A" and resid 88 and name HN) (segid " A" and resid 85 and name HA2) 3.101 1.202 1.202 weight 1.000 ! spec=15N_...last, no=797, id=947, vol=7.014340e+06 assign (segid " A" and resid 88 and name HN) (segid " A" and resid 87 and name HB2) 2.668 0.890 0.890 weight 1.000 ! spec=15N_...last, no=802, id=950, vol=2.326119e+07 or (segid " A" and resid 88 and name HN) (segid " A" and resid 87 and name HB1) or (segid " A" and resid 88 and name HN) (segid " A" and resid 87 and name HB3) assign (segid " A" and resid 90 and name HN) (segid " A" and resid 89 and name HD1) 4.547 2.584 2.584 weight 1.000 ! spec=15N_...last, no=806, id=953, vol=3.332012e+06 or (segid " A" and resid 90 and name HN) (segid " A" and resid 89 and name HD2) assign (segid " A" and resid 90 and name HN) (segid " A" and resid 87 and name HA) 2.810 0.987 0.987 weight 1.000 ! spec=15N_...last, no=807, id=954, vol=1.366276e+07 assign (segid " A" and resid 90 and name HN) (segid " A" and resid 90 and name HA) 2.771 0.960 0.960 weight 1.000 ! spec=15N_...last, no=808, id=955, vol=1.269950e+07 assign (segid " A" and resid 90 and name HN) (segid " A" and resid 89 and name HB2) 3.918 1.919 1.919 weight 1.000 ! spec=15N_...last, no=809, id=956, vol=7.669396e+06 assign (segid " A" and resid 90 and name HN) (segid " A" and resid 89 and name HB1) 2.732 0.933 0.933 weight 1.000 ! spec=15N_...last, no=810, id=957, vol=9.419418e+06 assign (segid " A" and resid 90 and name HN) (segid " A" and resid 90 and name HB2) 2.423 0.734 0.734 weight 1.000 ! spec=15N_...last, no=812, id=959, vol=2.760103e+07 assign (segid " A" and resid 90 and name HN) (segid " A" and resid 91 and name HN) 2.707 0.916 0.916 weight 1.000 ! spec=15N_...last, no=814, id=960, vol=1.181864e+07 assign (segid " A" and resid 91 and name HN) (segid " A" and resid 89 and name HA) 4.065 2.066 2.066 weight 1.000 ! spec=15N_...last, no=816, id=962, vol=2.440248e+06 assign (segid " A" and resid 91 and name HN) (segid " A" and resid 91 and name HA) 2.830 1.001 1.001 weight 1.000 ! spec=15N_...last, no=817, id=963, vol=1.081345e+07 assign (segid " A" and resid 91 and name HN) (segid " A" and resid 88 and name HA) 3.005 1.129 1.129 weight 1.000 ! spec=15N_...last, no=818, id=964, vol=8.985583e+06 assign (segid " A" and resid 91 and name HN) (segid " A" and resid 90 and name HG2) 4.751 2.822 2.822 weight 1.000 ! spec=15N_...last, no=820, id=966, vol=2.704224e+06 assign (segid " A" and resid 91 and name HN) (segid " A" and resid 91 and name HB1) 2.332 0.680 0.680 weight 1.000 ! spec=15N_...last, no=822, id=968, vol=2.605039e+07 assign (segid " A" and resid 91 and name HN) (segid " A" and resid 91 and name HB2) 2.695 0.908 0.908 weight 1.000 ! spec=15N_...last, no=823, id=969, vol=1.243685e+07 assign (segid " A" and resid 91 and name HN) (segid " A" and resid 92 and name HN) 2.621 0.858 0.858 weight 1.000 ! spec=15N_...last, no=826, id=971, vol=1.379459e+07 assign (segid " A" and resid 92 and name HN) (segid " A" and resid 92 and name HD1) 4.576 2.618 2.618 weight 1.000 ! spec=15N_...last, no=828, id=972, vol=5.346422e+06 or (segid " A" and resid 92 and name HN) (segid " A" and resid 92 and name HD2) assign (segid " A" and resid 92 and name HN) (segid " A" and resid 89 and name HA) 3.194 1.275 1.275 weight 1.000 ! spec=15N_...last, no=829, id=973, vol=6.977290e+06 assign (segid " A" and resid 92 and name HN) (segid " A" and resid 92 and name HA) 2.842 1.010 1.010 weight 1.000 ! spec=15N_...last, no=830, id=974, vol=1.269515e+07 assign (segid " A" and resid 92 and name HN) (segid " A" and resid 91 and name HB1) 2.812 0.988 0.988 weight 1.000 ! spec=15N_...last, no=834, id=976, vol=8.406317e+06 assign (segid " A" and resid 92 and name HN) (segid " A" and resid 91 and name HB2) 3.905 1.906 1.906 weight 1.000 ! spec=15N_...last, no=835, id=977, vol=6.328897e+06 assign (segid " A" and resid 93 and name HN) (segid " A" and resid 94 and name HN) 2.776 0.963 0.963 weight 1.000 ! spec=15N_...last, no=837, id=978, vol=1.017561e+07 assign (segid " A" and resid 93 and name HN) (segid " A" and resid 92 and name HD1) 3.940 1.941 1.941 weight 1.000 ! spec=15N_...last, no=838, id=979, vol=7.296159e+06 or (segid " A" and resid 93 and name HN) (segid " A" and resid 92 and name HD2) assign (segid " A" and resid 93 and name HN) (segid " A" and resid 90 and name HA) 2.899 1.051 1.051 weight 1.000 ! spec=15N_...last, no=839, id=980, vol=1.099977e+07 assign (segid " A" and resid 93 and name HN) (segid " A" and resid 93 and name HA) 2.696 0.909 0.909 weight 1.000 ! spec=15N_...last, no=840, id=981, vol=9.448427e+06 assign (segid " A" and resid 93 and name HN) (segid " A" and resid 92 and name HB1) 2.594 0.841 0.841 weight 1.000 ! spec=15N_...last, no=841, id=982, vol=1.392560e+07 assign (segid " A" and resid 93 and name HN) (segid " A" and resid 93 and name HB2) 2.483 0.771 0.771 weight 1.000 ! spec=15N_...last, no=844, id=983, vol=1.444629e+07 assign (segid " A" and resid 93 and name HN) (segid " A" and resid 93 and name HG) 2.649 0.877 0.877 weight 1.000 ! spec=15N_...last, no=847, id=986, vol=8.134058e+06 assign (segid " A" and resid 94 and name HN) (segid " A" and resid 94 and name HA) 2.597 0.843 0.843 weight 1.000 ! spec=15N_...last, no=850, id=988, vol=1.941420e+07 assign (segid " A" and resid 94 and name HN) (segid " A" and resid 90 and name HA) 4.129 2.131 2.131 weight 1.000 ! spec=15N_...last, no=851, id=989, vol=2.812257e+06 assign (segid " A" and resid 94 and name HN) (segid " A" and resid 93 and name HA) 3.218 1.294 1.294 weight 1.000 ! spec=15N_...last, no=852, id=990, vol=6.177400e+06 assign (segid " A" and resid 94 and name HN) (segid " A" and resid 93 and name HB2) 2.657 0.883 0.883 weight 1.000 ! spec=15N_...last, no=853, id=991, vol=9.840069e+06 assign (segid " A" and resid 94 and name HN) (segid " A" and resid 93 and name HB1) 3.383 1.430 1.430 weight 1.000 ! spec=15N_...last, no=855, id=993, vol=1.224607e+07 assign (segid " A" and resid 95 and name HN) (segid " A" and resid 93 and name HN) 3.366 1.416 1.416 weight 1.000 ! spec=15N_...last, no=857, id=994, vol=5.910604e+06 assign (segid " A" and resid 95 and name HN) (segid " A" and resid 96 and name HN) 2.082 0.542 0.542 weight 1.000 ! spec=15N_...last, no=858, id=995, vol=4.285070e+07 assign (segid " A" and resid 95 and name HN) (segid " A" and resid 95 and name HA) 2.704 0.914 0.914 weight 1.000 ! spec=15N_...last, no=859, id=996, vol=1.369319e+07 assign (segid " A" and resid 95 and name HN) (segid " A" and resid 96 and name HG) 3.576 1.598 1.598 weight 1.000 ! spec=15N_...last, no=864, id=1000, vol=5.554412e+06 assign (segid " A" and resid 96 and name HN) (segid " A" and resid 95 and name HA) 3.285 1.349 1.349 weight 1.000 ! spec=15N_...last, no=867, id=1002, vol=4.831433e+06 assign (segid " A" and resid 96 and name HN) (segid " A" and resid 94 and name HA) 3.530 1.558 1.558 weight 1.000 ! spec=15N_...last, no=868, id=1003, vol=3.802641e+06 assign (segid " A" and resid 96 and name HN) (segid " A" and resid 96 and name HA) 2.611 0.852 0.852 weight 1.000 ! spec=15N_...last, no=869, id=1004, vol=1.505584e+07 assign (segid " A" and resid 96 and name HN) (segid " A" and resid 93 and name HA) 2.868 1.028 1.028 weight 1.000 ! spec=15N_...last, no=870, id=1005, vol=1.802160e+07 assign (segid " A" and resid 96 and name HN) (segid " A" and resid 96 and name HB1) 3.388 1.435 1.435 weight 1.000 ! spec=15N_...last, no=872, id=1006, vol=1.507242e+07 assign (segid " A" and resid 96 and name HN) (segid " A" and resid 96 and name HD12) 3.211 1.289 1.289 weight 1.000 ! spec=15N_...last, no=873, id=1007, vol=1.383715e+07 or (segid " A" and resid 96 and name HN) (segid " A" and resid 96 and name HD11) or (segid " A" and resid 96 and name HN) (segid " A" and resid 96 and name HD13) assign (segid " A" and resid 96 and name HN) (segid " A" and resid 95 and name HB2) 2.896 1.049 1.049 weight 1.000 ! spec=15N_...last, no=874, id=1008, vol=1.223563e+07 or (segid " A" and resid 96 and name HN) (segid " A" and resid 95 and name HB1) or (segid " A" and resid 96 and name HN) (segid " A" and resid 95 and name HB3) assign (segid " A" and resid 96 and name HN) (segid " A" and resid 96 and name HD22) 3.513 1.543 1.543 weight 1.000 ! spec=15N_...last, no=876, id=1010, vol=8.867637e+06 or (segid " A" and resid 96 and name HN) (segid " A" and resid 96 and name HD21) or (segid " A" and resid 96 and name HN) (segid " A" and resid 96 and name HD23) assign (segid " A" and resid 118 and name HN) (segid " A" and resid 117 and name HN) 2.694 0.907 0.907 weight 1.000 ! spec=15N_...last, no=877, id=1011, vol=1.190575e+07 assign (segid " A" and resid 99 and name HN) (segid " A" and resid 98 and name HN) 2.385 0.711 0.711 weight 1.000 ! spec=15N_...last, no=878, id=1012, vol=2.073248e+07 assign (segid " A" and resid 98 and name HN) (segid " A" and resid 95 and name HA) 3.319 1.377 1.377 weight 1.000 ! spec=15N_...last, no=879, id=1013, vol=4.499704e+06 assign (segid " A" and resid 98 and name HN) (segid " A" and resid 98 and name HA) 2.697 0.909 0.909 weight 1.000 ! spec=15N_...last, no=880, id=1014, vol=1.690324e+07 assign (segid " A" and resid 98 and name HN) (segid " A" and resid 97 and name HG2) 2.332 0.679 0.679 weight 1.000 ! spec=15N_...last, no=885, id=1018, vol=3.386074e+07 assign (segid " A" and resid 98 and name HN) (segid " A" and resid 95 and name HB2) 3.217 1.294 1.294 weight 1.000 ! spec=15N_...last, no=886, id=1019, vol=9.979572e+06 or (segid " A" and resid 98 and name HN) (segid " A" and resid 95 and name HB1) or (segid " A" and resid 98 and name HN) (segid " A" and resid 95 and name HB3) assign (segid " A" and resid 99 and name HN) (segid " A" and resid 98 and name HA) 3.572 1.594 1.594 weight 1.000 ! spec=15N_...last, no=888, id=1020, vol=4.382973e+06 assign (segid " A" and resid 99 and name HN) (segid " A" and resid 100 and name HN) 2.689 0.904 0.904 weight 1.000 ! spec=15N_...last, no=889, id=1021, vol=1.063112e+07 assign (segid " A" and resid 102 and name HN) (segid " A" and resid 100 and name HN) 3.820 1.824 1.824 weight 1.000 ! spec=15N_...last, no=891, id=1023, vol=3.070271e+06 assign (segid " A" and resid 99 and name HN) (segid " A" and resid 101 and name HN) 3.919 1.920 1.920 weight 1.000 ! spec=15N_...last, no=892, id=1024, vol=3.182997e+06 assign (segid " A" and resid 102 and name HN) (segid " A" and resid 101 and name HN) 2.706 0.915 0.915 weight 1.000 ! spec=15N_...last, no=893, id=1025, vol=1.241050e+07 assign (segid " A" and resid 102 and name HN) (segid " A" and resid 102 and name HA) 2.765 0.956 0.956 weight 1.000 ! spec=15N_...last, no=894, id=1026, vol=1.361439e+07 assign (segid " A" and resid 102 and name HN) (segid " A" and resid 98 and name HA) 3.987 1.987 1.987 weight 1.000 ! spec=15N_...last, no=895, id=1027, vol=1.755794e+06 assign (segid " A" and resid 99 and name HN) (segid " A" and resid 96 and name HA) 3.129 1.224 1.224 weight 1.000 ! spec=15N_...last, no=896, id=1028, vol=6.604522e+06 assign (segid " A" and resid 102 and name HN) (segid " A" and resid 103 and name HB1) 4.643 2.695 2.695 weight 1.000 ! spec=15N_...last, no=897, id=1029, vol=7.863668e+06 assign (segid " A" and resid 102 and name HN) (segid " A" and resid 99 and name HA) 3.020 1.140 1.140 weight 1.000 ! spec=15N_...last, no=898, id=1030, vol=6.140585e+06 assign (segid " A" and resid 99 and name HN) (segid " A" and resid 99 and name HA) 2.901 1.052 1.052 weight 1.000 ! spec=15N_...last, no=899, id=1031, vol=8.219578e+06 assign (segid " A" and resid 102 and name HN) (segid " A" and resid 102 and name HB2) 2.028 0.514 0.514 weight 1.000 ! spec=15N_...last, no=904, id=1032, vol=5.074848e+07 or (segid " A" and resid 102 and name HN) (segid " A" and resid 102 and name HB1) or (segid " A" and resid 102 and name HN) (segid " A" and resid 102 and name HB3) assign (segid " A" and resid 99 and name HN) (segid " A" and resid 99 and name HB2) 2.201 0.605 0.605 weight 1.000 ! spec=15N_...last, no=905, id=1033, vol=2.484880e+07 assign (segid " A" and resid 99 and name HN) (segid " A" and resid 99 and name HB1) 3.244 1.315 1.315 weight 1.000 ! spec=15N_...last, no=907, id=1034, vol=9.854735e+06 assign (segid " A" and resid 101 and name HN) (segid " A" and resid 101 and name HA) 2.759 0.951 0.951 weight 1.000 ! spec=15N_...last, no=912, id=1037, vol=1.191977e+07 assign (segid " A" and resid 101 and name HN) (segid " A" and resid 98 and name HA) 3.109 1.208 1.208 weight 1.000 ! spec=15N_...last, no=913, id=1038, vol=6.291132e+06 assign (segid " A" and resid 101 and name HN) (segid " A" and resid 100 and name HA) 3.568 1.592 1.592 weight 1.000 ! spec=15N_...last, no=914, id=1039, vol=4.263075e+06 assign (segid " A" and resid 101 and name HN) (segid " A" and resid 99 and name HA) 4.032 2.032 2.032 weight 1.000 ! spec=15N_...last, no=915, id=1040, vol=2.116758e+06 assign (segid " A" and resid 101 and name HB2) (segid " A" and resid 101 and name HN) 2.042 0.521 0.521 weight 1.000 ! spec=15N_...last, no=916, id=1041, vol=4.387094e+07 or (segid " A" and resid 101 and name HB1) (segid " A" and resid 101 and name HN) or (segid " A" and resid 101 and name HB3) (segid " A" and resid 101 and name HN) assign (segid " A" and resid 103 and name HN) (segid " A" and resid 102 and name HA) 3.408 1.452 1.452 weight 1.000 ! spec=15N_...last, no=918, id=1043, vol=4.997888e+06 assign (segid " A" and resid 103 and name HN) (segid " A" and resid 104 and name HN) 2.676 0.895 0.895 weight 1.000 ! spec=15N_...last, no=919, id=1044, vol=1.222989e+07 assign (segid " A" and resid 104 and name HN) (segid " A" and resid 105 and name HN) 2.795 0.977 0.977 weight 1.000 ! spec=15N_...last, no=920, id=1045, vol=9.670642e+06 assign (segid " A" and resid 104 and name HN) (segid " A" and resid 101 and name HA) 3.437 1.477 1.477 weight 1.000 ! spec=15N_...last, no=924, id=1046, vol=4.946687e+06 assign (segid " A" and resid 104 and name HN) (segid " A" and resid 104 and name HG1) 2.553 0.815 0.815 weight 1.000 ! spec=15N_...last, no=926, id=1047, vol=1.238598e+07 assign (segid " A" and resid 105 and name HN) (segid " A" and resid 103 and name HN) 4.463 2.489 2.489 weight 1.000 ! spec=15N_...last, no=928, id=1048, vol=1.924762e+06 assign (segid " A" and resid 106 and name HN) (segid " A" and resid 105 and name HN) 2.736 0.936 0.936 weight 1.000 ! spec=15N_...last, no=930, id=1050, vol=1.082629e+07 assign (segid " A" and resid 105 and name HN) (segid " A" and resid 105 and name HD21) 4.832 2.919 2.919 weight 1.000 ! spec=15N_...last, no=931, id=1051, vol=2.999384e+06 assign (segid " A" and resid 105 and name HN) (segid " A" and resid 105 and name HA) 2.882 1.038 1.038 weight 1.000 ! spec=15N_...last, no=932, id=1052, vol=1.183490e+07 assign (segid " A" and resid 105 and name HN) (segid " A" and resid 106 and name HA) 4.550 2.587 2.587 weight 1.000 ! spec=15N_...last, no=933, id=1053, vol=3.103699e+06 assign (segid " A" and resid 105 and name HN) (segid " A" and resid 104 and name HB2) 2.663 0.887 0.887 weight 1.000 ! spec=15N_...last, no=936, id=1056, vol=1.032392e+07 assign (segid " A" and resid 105 and name HN) (segid " A" and resid 104 and name HB1) 3.857 1.859 1.859 weight 1.000 ! spec=15N_...last, no=937, id=1057, vol=6.142252e+06 assign (segid " A" and resid 105 and name HN) (segid " A" and resid 104 and name HG1) 4.157 2.160 2.160 weight 1.000 ! spec=15N_...last, no=938, id=1058, vol=5.288457e+06 assign (segid " A" and resid 105 and name HN) (segid " A" and resid 106 and name HB2) 4.049 2.050 2.050 weight 1.000 ! spec=15N_...last, no=939, id=1059, vol=4.815206e+06 or (segid " A" and resid 105 and name HN) (segid " A" and resid 106 and name HB1) or (segid " A" and resid 105 and name HN) (segid " A" and resid 106 and name HB3) assign (segid " A" and resid 20 and name HN) (segid " A" and resid 22 and name HN) 3.809 1.814 1.814 weight 1.000 ! spec=15N_...last, no=942, id=1061, vol=4.631356e+06 assign (segid " A" and resid 106 and name HN) (segid " A" and resid 103 and name HA) 2.909 1.058 1.058 weight 1.000 ! spec=15N_...last, no=943, id=1062, vol=9.213386e+06 assign (segid " A" and resid 126 and name HN) (segid " A" and resid 126 and name HA) 3.030 1.148 1.148 weight 1.000 ! spec=15N_...last, no=944, id=1063, vol=7.067694e+06 assign (segid " A" and resid 126 and name HN) (segid " A" and resid 125 and name HA1) 3.703 1.714 1.714 weight 1.000 ! spec=15N_...last, no=945, id=1064, vol=5.426522e+06 assign (segid " A" and resid 126 and name HN) (segid " A" and resid 126 and name HG) 3.273 1.339 1.339 weight 1.000 ! spec=15N_...last, no=946, id=1065, vol=1.082685e+07 assign (segid " A" and resid 107 and name HN) (segid " A" and resid 106 and name HA) 3.419 1.462 1.462 weight 1.000 ! spec=15N_...last, no=950, id=1068, vol=5.078412e+06 assign (segid " A" and resid 107 and name HN) (segid " A" and resid 107 and name HA) 2.759 0.952 0.952 weight 1.000 ! spec=15N_...last, no=951, id=1069, vol=1.280333e+07 assign (segid " A" and resid 107 and name HN) (segid " A" and resid 107 and name HD2) 4.305 2.317 2.317 weight 1.000 ! spec=15N_...last, no=953, id=1070, vol=1.954259e+06 assign (segid " A" and resid 107 and name HN) (segid " A" and resid 107 and name HB2) 2.873 1.031 1.031 weight 1.000 ! spec=15N_...last, no=955, id=1071, vol=5.668986e+06 assign (segid " A" and resid 107 and name HN) (segid " A" and resid 108 and name HN) 2.439 0.743 0.743 weight 1.000 ! spec=15N_...last, no=959, id=1072, vol=1.874843e+07 assign (segid " A" and resid 108 and name HN) (segid " A" and resid 108 and name HA1) 2.934 1.076 1.076 weight 1.000 ! spec=15N_...last, no=961, id=1074, vol=2.042401e+07 assign (segid " A" and resid 108 and name HN) (segid " A" and resid 108 and name HA2) 2.544 0.809 0.809 weight 1.000 ! spec=15N_...last, no=962, id=1075, vol=1.685668e+07 assign (segid " A" and resid 108 and name HN) (segid " A" and resid 107 and name HB2) 3.544 1.570 1.570 weight 1.000 ! spec=15N_...last, no=963, id=1076, vol=4.258970e+06 assign (segid " A" and resid 108 and name HN) (segid " A" and resid 107 and name HB1) 4.123 2.124 2.124 weight 1.000 ! spec=15N_...last, no=964, id=1077, vol=3.721425e+06 assign (segid " A" and resid 107 and name HN) (segid " A" and resid 109 and name HN) 3.364 1.414 1.414 weight 1.000 ! spec=15N_...last, no=967, id=1079, vol=6.983437e+06 assign (segid " A" and resid 108 and name HN) (segid " A" and resid 109 and name HN) 2.782 0.967 0.967 weight 1.000 ! spec=15N_...last, no=968, id=1080, vol=1.103397e+07 assign (segid " A" and resid 117 and name HN) (segid " A" and resid 117 and name HB2) 2.275 0.647 0.647 weight 1.000 ! spec=15N_...last, no=971, id=1082, vol=2.251426e+07 or (segid " A" and resid 117 and name HN) (segid " A" and resid 117 and name HB1) or (segid " A" and resid 117 and name HN) (segid " A" and resid 117 and name HB3) assign (segid " A" and resid 109 and name HN) (segid " A" and resid 109 and name HB) 2.489 0.774 0.774 weight 1.000 ! spec=15N_...last, no=976, id=1083, vol=1.608038e+07 assign (segid " A" and resid 109 and name HN) (segid " A" and resid 109 and name HG12) 3.478 1.512 1.512 weight 1.000 ! spec=15N_...last, no=977, id=1084, vol=9.592883e+06 or (segid " A" and resid 109 and name HN) (segid " A" and resid 109 and name HG11) or (segid " A" and resid 109 and name HN) (segid " A" and resid 109 and name HG13) assign (segid " A" and resid 109 and name HN) (segid " A" and resid 109 and name HG22) 3.406 1.450 1.450 weight 1.000 ! spec=15N_...last, no=978, id=1085, vol=3.553932e+06 or (segid " A" and resid 109 and name HN) (segid " A" and resid 109 and name HG21) or (segid " A" and resid 109 and name HN) (segid " A" and resid 109 and name HG23) assign (segid " A" and resid 110 and name HN) (segid " A" and resid 109 and name HN) 4.580 2.622 2.622 weight 1.000 ! spec=15N_...last, no=980, id=1086, vol=2.126559e+06 assign (segid " A" and resid 110 and name HN) (segid " A" and resid 110 and name HA) 3.389 1.436 1.436 weight 1.000 ! spec=15N_...last, no=982, id=1087, vol=4.246195e+06 assign (segid " A" and resid 110 and name HN) (segid " A" and resid 109 and name HA) 2.407 0.724 0.724 weight 1.000 ! spec=15N_...last, no=984, id=1088, vol=2.088242e+07 assign (segid " A" and resid 110 and name HN) (segid " A" and resid 110 and name HB1) 3.018 1.139 1.139 weight 1.000 ! spec=15N_...last, no=985, id=1089, vol=7.393414e+06 assign (segid " A" and resid 110 and name HN) (segid " A" and resid 110 and name HB2) 3.128 1.223 1.223 weight 1.000 ! spec=15N_...last, no=986, id=1090, vol=6.986484e+06 assign (segid " A" and resid 110 and name HN) (segid " A" and resid 109 and name HB) 3.733 1.742 1.742 weight 1.000 ! spec=15N_...last, no=988, id=1091, vol=5.881920e+06 assign (segid " A" and resid 110 and name HN) (segid " A" and resid 109 and name HG22) 3.541 1.567 1.567 weight 1.000 ! spec=15N_...last, no=991, id=1092, vol=1.317621e+07 or (segid " A" and resid 110 and name HN) (segid " A" and resid 109 and name HG21) or (segid " A" and resid 110 and name HN) (segid " A" and resid 109 and name HG23) assign (segid " A" and resid 111 and name HN) (segid " A" and resid 111 and name HA) 3.158 1.247 1.247 weight 1.000 ! spec=15N_...last, no=994, id=1094, vol=6.369671e+06 assign (segid " A" and resid 111 and name HN) (segid " A" and resid 111 and name HB1) 3.386 1.433 1.433 weight 1.000 ! spec=15N_...last, no=995, id=1095, vol=2.097395e+07 assign (segid " A" and resid 111 and name HN) (segid " A" and resid 111 and name HB2) 2.481 0.769 0.769 weight 1.000 ! spec=15N_...last, no=996, id=1096, vol=1.585650e+07 assign (segid " A" and resid 111 and name HN) (segid " A" and resid 112 and name HN) 2.901 1.052 1.052 weight 1.000 ! spec=15N_...last, no=998, id=1097, vol=8.723540e+06 assign (segid " A" and resid 112 and name HN) (segid " A" and resid 114 and name HN) 4.516 2.549 2.549 weight 1.000 ! spec=15N_...last, no=999, id=1098, vol=1.941429e+06 assign (segid " A" and resid 112 and name HN) (segid " A" and resid 110 and name HA) 3.901 1.902 1.902 weight 1.000 ! spec=15N_...last, no=1002, id=1100, vol=2.865926e+06 assign (segid " A" and resid 112 and name HN) (segid " A" and resid 111 and name HB1) 3.700 1.711 1.711 weight 1.000 ! spec=15N_...last, no=1004, id=1102, vol=6.587338e+06 assign (segid " A" and resid 112 and name HN) (segid " A" and resid 111 and name HB2) 3.153 1.243 1.243 weight 1.000 ! spec=15N_...last, no=1005, id=1103, vol=6.225938e+06 assign (segid " A" and resid 112 and name HN) (segid " A" and resid 113 and name HN) 2.821 0.994 0.994 weight 1.000 ! spec=15N_...last, no=1006, id=1104, vol=9.885064e+06 assign (segid " A" and resid 113 and name HN) (segid " A" and resid 114 and name HN) 2.541 0.807 0.807 weight 1.000 ! spec=15N_...last, no=1007, id=1105, vol=1.444743e+07 assign (segid " A" and resid 113 and name HN) (segid " A" and resid 113 and name HA) 3.139 1.232 1.232 weight 1.000 ! spec=15N_...last, no=1008, id=1106, vol=7.543827e+06 assign (segid " A" and resid 113 and name HN) (segid " A" and resid 113 and name HB2) 2.573 0.827 0.827 weight 1.000 ! spec=15N_...last, no=1009, id=1107, vol=1.801398e+07 assign (segid " A" and resid 113 and name HN) (segid " A" and resid 113 and name HB1) 2.862 1.024 1.024 weight 1.000 ! spec=15N_...last, no=1010, id=1108, vol=1.024351e+07 assign (segid " A" and resid 115 and name HN) (segid " A" and resid 114 and name HN) 2.735 0.935 0.935 weight 1.000 ! spec=15N_...last, no=1012, id=1110, vol=1.213957e+07 assign (segid " A" and resid 114 and name HN) (segid " A" and resid 113 and name HA) 3.625 1.643 1.643 weight 1.000 ! spec=15N_...last, no=1014, id=1112, vol=3.863570e+06 assign (segid " A" and resid 114 and name HN) (segid " A" and resid 111 and name HA) 3.009 1.132 1.132 weight 1.000 ! spec=15N_...last, no=1015, id=1113, vol=8.207584e+06 assign (segid " A" and resid 114 and name HN) (segid " A" and resid 112 and name HA2) 3.341 1.395 1.395 weight 1.000 ! spec=15N_...last, no=1016, id=1114, vol=8.061432e+06 assign (segid " A" and resid 114 and name HN) (segid " A" and resid 114 and name HA) 2.416 0.730 0.730 weight 1.000 ! spec=15N_...last, no=1017, id=1115, vol=2.197665e+07 assign (segid " A" and resid 115 and name HN) (segid " A" and resid 115 and name HG21) 3.047 1.160 1.160 weight 1.000 ! spec=15N_...last, no=1023, id=1118, vol=7.861434e+06 or (segid " A" and resid 115 and name HN) (segid " A" and resid 115 and name HG22) or (segid " A" and resid 115 and name HN) (segid " A" and resid 115 and name HG23) assign (segid " A" and resid 116 and name HN) (segid " A" and resid 115 and name HA) 2.826 0.998 0.998 weight 1.000 ! spec=15N_...last, no=1030, id=1120, vol=1.291489e+07 assign (segid " A" and resid 116 and name HN) (segid " A" and resid 115 and name HB) 2.405 0.723 0.723 weight 1.000 ! spec=15N_...last, no=1031, id=1121, vol=1.383679e+07 assign (segid " A" and resid 116 and name HN) (segid " A" and resid 116 and name HB2) 3.500 1.531 1.531 weight 1.000 ! spec=15N_...last, no=1033, id=1122, vol=7.655034e+06 assign (segid " A" and resid 116 and name HN) (segid " A" and resid 116 and name HB1) 3.434 1.474 1.474 weight 1.000 ! spec=15N_...last, no=1035, id=1123, vol=4.312003e+06 assign (segid " A" and resid 116 and name HN) (segid " A" and resid 115 and name HG21) 4.091 2.092 2.092 weight 1.000 ! spec=15N_...last, no=1038, id=1125, vol=6.357522e+06 or (segid " A" and resid 116 and name HN) (segid " A" and resid 115 and name HG22) or (segid " A" and resid 116 and name HN) (segid " A" and resid 115 and name HG23) assign (segid " A" and resid 117 and name HN) (segid " A" and resid 116 and name HA) 2.575 0.829 0.829 weight 1.000 ! spec=15N_...last, no=1041, id=1127, vol=1.454661e+07 assign (segid " A" and resid 117 and name HN) (segid " A" and resid 116 and name HB2) 3.387 1.434 1.434 weight 1.000 ! spec=15N_...last, no=1042, id=1128, vol=3.456912e+06 assign (segid " A" and resid 117 and name HN) (segid " A" and resid 116 and name HB1) 4.307 2.319 2.319 weight 1.000 ! spec=15N_...last, no=1044, id=1129, vol=5.191904e+06 assign (segid " A" and resid 118 and name HN) (segid " A" and resid 117 and name HA) 3.007 1.131 1.131 weight 1.000 ! spec=15N_...last, no=1049, id=1131, vol=9.182960e+06 assign (segid " A" and resid 118 and name HN) (segid " A" and resid 118 and name HB2) 2.429 0.737 0.737 weight 1.000 ! spec=15N_...last, no=1052, id=1132, vol=1.782045e+07 assign (segid " A" and resid 118 and name HN) (segid " A" and resid 117 and name HB2) 2.811 0.988 0.988 weight 1.000 ! spec=15N_...last, no=1056, id=1133, vol=1.533352e+07 or (segid " A" and resid 118 and name HN) (segid " A" and resid 117 and name HB1) or (segid " A" and resid 118 and name HN) (segid " A" and resid 117 and name HB3) assign (segid " A" and resid 127 and name HN) (segid " A" and resid 126 and name HB1) 2.318 0.672 0.672 weight 1.000 ! spec=15N_...last, no=1057, id=1134, vol=2.531334e+07 assign (segid " A" and resid 127 and name HN) (segid " A" and resid 126 and name HG) 3.383 1.430 1.430 weight 1.000 ! spec=15N_...last, no=1060, id=1135, vol=1.044851e+07 assign (segid " A" and resid 127 and name HN) (segid " A" and resid 126 and name HB2) 4.022 2.022 2.022 weight 1.000 ! spec=15N_...last, no=1061, id=1136, vol=7.169258e+06 assign (segid " A" and resid 119 and name HN) (segid " A" and resid 120 and name HA) 4.502 2.533 2.533 weight 1.000 ! spec=15N_...last, no=1064, id=1138, vol=2.679601e+06 assign (segid " A" and resid 119 and name HN) (segid " A" and resid 119 and name HA) 2.929 1.073 1.073 weight 1.000 ! spec=15N_...last, no=1065, id=1139, vol=8.859376e+06 assign (segid " A" and resid 119 and name HN) (segid " A" and resid 118 and name HB1) 2.857 1.020 1.020 weight 1.000 ! spec=15N_...last, no=1066, id=1140, vol=9.627736e+06 assign (segid " A" and resid 119 and name HN) (segid " A" and resid 118 and name HB2) 4.207 2.212 2.212 weight 1.000 ! spec=15N_...last, no=1067, id=1141, vol=5.775952e+06 assign (segid " A" and resid 119 and name HN) (segid " A" and resid 119 and name HB2) 2.262 0.640 0.640 weight 1.000 ! spec=15N_...last, no=1068, id=1142, vol=2.493941e+07 or (segid " A" and resid 119 and name HN) (segid " A" and resid 119 and name HB1) or (segid " A" and resid 119 and name HN) (segid " A" and resid 119 and name HB3) assign (segid " A" and resid 119 and name HN) (segid " A" and resid 120 and name HN) 2.803 0.982 0.982 weight 1.000 ! spec=15N_...last, no=1069, id=1143, vol=1.159899e+07 assign (segid " A" and resid 120 and name HN) (segid " A" and resid 120 and name HA) 2.975 1.107 1.107 weight 1.000 ! spec=15N_...last, no=1072, id=1144, vol=7.653562e+06 assign (segid " A" and resid 120 and name HN) (segid " A" and resid 118 and name HA) 4.395 2.414 2.414 weight 1.000 ! spec=15N_...last, no=1073, id=1145, vol=4.842891e+06 assign (segid " A" and resid 120 and name HN) (segid " A" and resid 119 and name HA) 3.302 1.363 1.363 weight 1.000 ! spec=15N_...last, no=1074, id=1146, vol=6.715347e+06 assign (segid " A" and resid 120 and name HN) (segid " A" and resid 118 and name HB1) 2.866 1.027 1.027 weight 1.000 ! spec=15N_...last, no=1075, id=1147, vol=9.834969e+06 assign (segid " A" and resid 120 and name HN) (segid " A" and resid 118 and name HB2) 4.017 2.017 2.017 weight 1.000 ! spec=15N_...last, no=1076, id=1148, vol=6.017906e+06 assign (segid " A" and resid 120 and name HN) (segid " A" and resid 120 and name HB1) 2.735 0.935 0.935 weight 1.000 ! spec=15N_...last, no=1078, id=1150, vol=1.306963e+07 assign (segid " A" and resid 120 and name HN) (segid " A" and resid 119 and name HB2) 2.601 0.846 0.846 weight 1.000 ! spec=15N_...last, no=1079, id=1151, vol=2.154670e+07 or (segid " A" and resid 120 and name HN) (segid " A" and resid 119 and name HB1) or (segid " A" and resid 120 and name HN) (segid " A" and resid 119 and name HB3) assign (segid " A" and resid 120 and name HN) (segid " A" and resid 120 and name HD12) 3.497 1.529 1.529 weight 1.000 ! spec=15N_...last, no=1080, id=1152, vol=1.193711e+07 or (segid " A" and resid 120 and name HN) (segid " A" and resid 120 and name HD11) or (segid " A" and resid 120 and name HN) (segid " A" and resid 120 and name HD13) assign (segid " A" and resid 121 and name HN) (segid " A" and resid 122 and name HN) 3.670 1.683 1.683 weight 1.000 ! spec=15N_...last, no=1081, id=1153, vol=5.230755e+06 assign (segid " A" and resid 121 and name HN) (segid " A" and resid 116 and name HE22) 2.743 0.941 0.941 weight 1.000 ! spec=15N_...last, no=1082, id=1154, vol=8.625003e+06 assign (segid " A" and resid 121 and name HN) (segid " A" and resid 121 and name HG12) 2.087 0.544 0.544 weight 1.000 ! spec=15N_...last, no=1083, id=1155, vol=3.084308e+07 or (segid " A" and resid 121 and name HN) (segid " A" and resid 121 and name HG11) or (segid " A" and resid 121 and name HN) (segid " A" and resid 121 and name HG13) assign (segid " A" and resid 121 and name HN) (segid " A" and resid 120 and name HB1) 3.947 1.948 1.948 weight 1.000 ! spec=15N_...last, no=1085, id=1156, vol=4.804376e+06 assign (segid " A" and resid 121 and name HN) (segid " A" and resid 120 and name HG) 2.818 0.993 0.993 weight 1.000 ! spec=15N_...last, no=1086, id=1157, vol=5.728485e+06 assign (segid " A" and resid 121 and name HN) (segid " A" and resid 121 and name HB) 2.674 0.894 0.894 weight 1.000 ! spec=15N_...last, no=1087, id=1158, vol=1.220819e+07 assign (segid " A" and resid 121 and name HN) (segid " A" and resid 121 and name HA) 3.013 1.135 1.135 weight 1.000 ! spec=15N_...last, no=1088, id=1159, vol=5.731576e+06 assign (segid " A" and resid 121 and name HN) (segid " A" and resid 120 and name HA) 2.308 0.666 0.666 weight 1.000 ! spec=15N_...last, no=1089, id=1160, vol=2.184993e+07 assign (segid " A" and resid 121 and name HN) (segid " A" and resid 68 and name HA) 2.891 1.045 1.045 weight 1.000 ! spec=15N_...last, no=1090, id=1161, vol=7.155254e+06 assign (segid " A" and resid 116 and name HE21) (segid " A" and resid 121 and name HN) 4.017 2.017 2.017 weight 1.000 ! spec=15N_...last, no=1092, id=1162, vol=7.147594e+06 assign (segid " A" and resid 122 and name HN) (segid " A" and resid 121 and name HA) 2.131 0.568 0.568 weight 1.000 ! spec=15N_...last, no=1095, id=1165, vol=4.367666e+07 assign (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HA) 2.795 0.976 0.976 weight 1.000 ! spec=15N_...last, no=1096, id=1166, vol=9.953342e+06 assign (segid " A" and resid 122 and name HN) (segid " A" and resid 121 and name HB) 4.933 3.042 3.042 weight 1.000 ! spec=15N_...last, no=1097, id=1167, vol=2.848937e+06 assign (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HB2) 2.539 0.806 0.806 weight 1.000 ! spec=15N_...last, no=1098, id=1168, vol=1.499958e+07 assign (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HG) 2.630 0.864 0.864 weight 1.000 ! spec=15N_...last, no=1099, id=1169, vol=1.738868e+07 assign (segid " A" and resid 122 and name HN) (segid " A" and resid 121 and name HG22) 3.074 1.181 1.181 weight 1.000 ! spec=15N_...last, no=1101, id=1171, vol=1.112350e+07 or (segid " A" and resid 122 and name HN) (segid " A" and resid 121 and name HG21) or (segid " A" and resid 122 and name HN) (segid " A" and resid 121 and name HG23) assign (segid " A" and resid 122 and name HN) (segid " A" and resid 123 and name HN) 3.769 1.776 1.776 weight 1.000 ! spec=15N_...last, no=1102, id=1172, vol=5.027828e+06 assign (segid " A" and resid 123 and name HN) (segid " A" and resid 122 and name HA) 2.131 0.568 0.568 weight 1.000 ! spec=15N_...last, no=1103, id=1173, vol=3.413098e+07 assign (segid " A" and resid 123 and name HN) (segid " A" and resid 122 and name HB2) 4.095 2.096 2.096 weight 1.000 ! spec=15N_...last, no=1105, id=1175, vol=5.402302e+06 assign (segid " A" and resid 123 and name HN) (segid " A" and resid 123 and name HB2) 2.514 0.790 0.790 weight 1.000 ! spec=15N_...last, no=1106, id=1176, vol=1.390608e+07 assign (segid " A" and resid 123 and name HN) (segid " A" and resid 123 and name HG) 2.580 0.832 0.832 weight 1.000 ! spec=15N_...last, no=1107, id=1177, vol=1.174407e+07 assign (segid " A" and resid 123 and name HN) (segid " A" and resid 121 and name HG12) 3.253 1.323 2.747 weight 1.000 ! spec=15N_...last, no=1108, id=1178, vol=1.115412e+07 or (segid " A" and resid 123 and name HN) (segid " A" and resid 121 and name HG11) or (segid " A" and resid 123 and name HN) (segid " A" and resid 121 and name HG13) assign (segid " A" and resid 123 and name HN) (segid " A" and resid 123 and name HD22) 4.322 2.335 2.335 weight 1.000 ! spec=15N_...last, no=1109, id=1179, vol=1.577465e+06 or (segid " A" and resid 123 and name HN) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 123 and name HN) (segid " A" and resid 123 and name HD23) assign (segid " A" and resid 123 and name HN) (segid " A" and resid 123 and name HD12) 3.992 1.993 1.993 weight 1.000 ! spec=15N_...last, no=1110, id=1180, vol=4.494398e+06 or (segid " A" and resid 123 and name HN) (segid " A" and resid 123 and name HD11) or (segid " A" and resid 123 and name HN) (segid " A" and resid 123 and name HD13) assign (segid " A" and resid 124 and name HN) (segid " A" and resid 123 and name HN) 4.217 2.222 2.222 weight 1.000 ! spec=15N_...last, no=1111, id=1181, vol=3.264121e+06 assign (segid " A" and resid 124 and name HN) (segid " A" and resid 123 and name HA) 2.233 0.623 0.623 weight 1.000 ! spec=15N_...last, no=1112, id=1182, vol=3.551454e+07 assign (segid " A" and resid 124 and name HN) (segid " A" and resid 124 and name HA2) 2.551 0.813 0.813 weight 1.000 ! spec=15N_...last, no=1113, id=1183, vol=3.305537e+07 assign (segid " A" and resid 125 and name HN) (segid " A" and resid 125 and name HA1) 3.127 1.223 1.223 weight 1.000 ! spec=15N_...last, no=1114, id=1184, vol=1.250594e+07 assign (segid " A" and resid 125 and name HN) (segid " A" and resid 125 and name HA2) 2.526 0.797 0.797 weight 1.000 ! spec=15N_...last, no=1115, id=1185, vol=1.387860e+07 assign (segid " A" and resid 125 and name HN) (segid " A" and resid 126 and name HN) 3.050 1.163 1.163 weight 1.000 ! spec=15N_...last, no=1117, id=1186, vol=5.180503e+06 assign (segid " A" and resid 124 and name HN) (segid " A" and resid 123 and name HB2) 4.052 2.052 2.052 weight 1.000 ! spec=15N_...last, no=1119, id=1187, vol=6.097788e+06 assign (segid " A" and resid 125 and name HN) (segid " A" and resid 126 and name HB1) 4.724 2.789 2.789 weight 1.000 ! spec=15N_...last, no=1120, id=1188, vol=6.751422e+06 assign (segid " A" and resid 124 and name HN) (segid " A" and resid 123 and name HB1) 3.566 1.590 1.590 weight 1.000 ! spec=15N_...last, no=1121, id=1189, vol=7.679114e+06 assign (segid " A" and resid 124 and name HN) (segid " A" and resid 123 and name HD22) 4.428 2.451 2.451 weight 1.000 ! spec=15N_...last, no=1123, id=1190, vol=4.020265e+06 or (segid " A" and resid 124 and name HN) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 124 and name HN) (segid " A" and resid 123 and name HD23) assign (segid " A" and resid 126 and name HN) (segid " A" and resid 73 and name HN) 3.801 1.806 1.806 weight 1.000 ! spec=15N_...last, no=1124, id=1191, vol=3.250120e+06 assign (segid " A" and resid 126 and name HN) (segid " A" and resid 72 and name HA) 2.634 0.868 0.868 weight 1.000 ! spec=15N_...last, no=1125, id=1192, vol=1.464925e+07 assign (segid " A" and resid 126 and name HN) (segid " A" and resid 125 and name HA2) 2.903 1.053 1.053 weight 1.000 ! spec=15N_...last, no=1126, id=1193, vol=8.848767e+06 assign (segid " A" and resid 126 and name HN) (segid " A" and resid 126 and name HB2) 2.601 0.845 0.845 weight 1.000 ! spec=15N_...last, no=1128, id=1195, vol=8.392923e+06 assign (segid " A" and resid 127 and name HN) (segid " A" and resid 127 and name HA) 3.248 1.318 1.318 weight 1.000 ! spec=15N_...last, no=1129, id=1196, vol=5.627632e+06 assign (segid " A" and resid 127 and name HN) (segid " A" and resid 128 and name HN) 4.140 2.142 2.142 weight 1.000 ! spec=15N_...last, no=1130, id=1197, vol=5.637995e+06 assign (segid " A" and resid 127 and name HN) (segid " A" and resid 126 and name HA) 2.455 0.753 0.753 weight 1.000 ! spec=15N_...last, no=1132, id=1198, vol=2.381423e+07 assign (segid " A" and resid 127 and name HN) (segid " A" and resid 127 and name HB2) 3.049 1.162 1.162 weight 1.000 ! spec=15N_...last, no=1133, id=1199, vol=5.806443e+06 assign (segid " A" and resid 127 and name HN) (segid " A" and resid 126 and name HD12) 5.200 3.380 3.380 weight 1.000 ! spec=15N_...last, no=1134, id=1200, vol=1.880254e+06 or (segid " A" and resid 127 and name HN) (segid " A" and resid 126 and name HD11) or (segid " A" and resid 127 and name HN) (segid " A" and resid 126 and name HD13) assign (segid " A" and resid 128 and name HN) (segid " A" and resid 128 and name HD1) 3.828 1.832 1.832 weight 1.000 ! spec=15N_...last, no=1135, id=1201, vol=5.407346e+06 or (segid " A" and resid 128 and name HN) (segid " A" and resid 128 and name HD2) assign (segid " A" and resid 128 and name HN) (segid " A" and resid 127 and name HA) 2.998 1.123 1.123 weight 1.000 ! spec=15N_...last, no=1136, id=1202, vol=9.814558e+06 assign (segid " A" and resid 128 and name HN) (segid " A" and resid 128 and name HA) 3.057 1.168 1.168 weight 1.000 ! spec=15N_...last, no=1137, id=1203, vol=7.318044e+06 assign (segid " A" and resid 130 and name HN) (segid " A" and resid 129 and name HA) 2.178 0.593 0.593 weight 1.000 ! spec=15N_...last, no=1144, id=1205, vol=4.203810e+07 assign (segid " A" and resid 130 and name HN) (segid " A" and resid 129 and name HB2) 4.645 2.697 2.697 weight 1.000 ! spec=15N_...last, no=1145, id=1206, vol=4.076043e+06 assign (segid " A" and resid 130 and name HN) (segid " A" and resid 130 and name HB2) 2.410 0.726 0.726 weight 1.000 ! spec=15N_...last, no=1147, id=1207, vol=1.985387e+07 or (segid " A" and resid 130 and name HN) (segid " A" and resid 130 and name HB1) or (segid " A" and resid 130 and name HN) (segid " A" and resid 130 and name HB3) assign (segid " A" and resid 103 and name HE1) (segid " A" and resid 123 and name HD22) 3.523 1.552 1.552 weight 1.000 ! spec=15N_...last, no=1149, id=1208, vol=3.127154e+06 or (segid " A" and resid 103 and name HE1) (segid " A" and resid 123 and name HD21) or (segid " A" and resid 103 and name HE1) (segid " A" and resid 123 and name HD23) assign (segid " A" and resid 103 and name HE1) (segid " A" and resid 103 and name HA) 4.858 2.950 2.950 weight 1.000 ! spec=15N_...last, no=1152, id=1209, vol=4.434874e+06 assign (segid " A" and resid 103 and name HD1) (segid " A" and resid 103 and name HE1) 2.514 0.790 0.790 weight 1.000 ! spec=15N_...last, no=1153, id=1210, vol=2.631692e+07 assign (segid " A" and resid 103 and name HZ2) (segid " A" and resid 103 and name HE1) 2.875 1.033 1.033 weight 1.000 ! spec=15N_...last, no=1154, id=1211, vol=1.176316e+07 assign (segid " A" and resid 72 and name HE1) (segid " A" and resid 92 and name HE1) 4.190 2.195 2.195 weight 1.000 ! spec=15N_...last, no=1157, id=1212, vol=4.102882e+06 or (segid " A" and resid 72 and name HE1) (segid " A" and resid 92 and name HE2) assign (segid " A" and resid 67 and name HD21) (segid " A" and resid 67 and name HD22) 1.711 0.366 0.366 weight 1.000 ! spec=15N_...last, no=1168, id=1213, vol=5.201506e+07 assign (segid " A" and resid 67 and name HD22) (segid " A" and resid 67 and name HB1) 3.852 1.855 1.855 weight 1.000 ! spec=15N_...last, no=1170, id=1214, vol=6.413579e+06 assign (segid " A" and resid 67 and name HD22) (segid " A" and resid 67 and name HB2) 4.176 2.180 2.180 weight 1.000 ! spec=15N_...last, no=1171, id=1215, vol=6.486898e+06 assign (segid " A" and resid 48 and name HE22) (segid " A" and resid 48 and name HE21) 1.787 0.399 0.399 weight 1.000 ! spec=15N_...last, no=1184, id=1216, vol=6.662984e+07 assign (segid " A" and resid 48 and name HE21) (segid " A" and resid 38 and name HG22) 4.126 2.128 2.128 weight 1.000 ! spec=15N_...last, no=1191, id=1220, vol=2.100619e+06 or (segid " A" and resid 48 and name HE21) (segid " A" and resid 38 and name HG21) or (segid " A" and resid 48 and name HE21) (segid " A" and resid 38 and name HG23) assign (segid " A" and resid 48 and name HE22) (segid " A" and resid 71 and name HG21) 3.528 1.556 1.556 weight 1.000 ! spec=15N_...last, no=1193, id=1221, vol=3.198433e+06 or (segid " A" and resid 48 and name HE22) (segid " A" and resid 71 and name HG22) or (segid " A" and resid 48 and name HE22) (segid " A" and resid 71 and name HG23) assign (segid " A" and resid 48 and name HE21) (segid " A" and resid 71 and name HG21) 3.923 1.924 1.924 weight 1.000 ! spec=15N_...last, no=1194, id=1222, vol=2.761645e+06 or (segid " A" and resid 48 and name HE21) (segid " A" and resid 71 and name HG22) or (segid " A" and resid 48 and name HE21) (segid " A" and resid 71 and name HG23) assign (segid " A" and resid 116 and name HE22) (segid " A" and resid 116 and name HB1) 4.347 2.362 2.362 weight 1.000 ! spec=15N_...last, no=1199, id=1223, vol=6.337544e+06 assign (segid " A" and resid 30 and name HD22) (segid " A" and resid 30 and name HB1) 4.529 2.564 2.564 weight 1.000 ! spec=15N_...last, no=1203, id=1224, vol=4.842979e+06 assign (segid " A" and resid 116 and name HE22) (segid " A" and resid 121 and name HG12) 2.580 0.832 0.832 weight 1.000 ! spec=15N_...last, no=1211, id=1226, vol=9.001647e+06 or (segid " A" and resid 116 and name HE22) (segid " A" and resid 121 and name HG11) or (segid " A" and resid 116 and name HE22) (segid " A" and resid 121 and name HG13) assign (segid " A" and resid 67 and name HD21) (segid " A" and resid 67 and name HB1) 2.352 0.691 0.691 weight 1.000 ! spec=15N_...last, no=1214, id=1227, vol=1.183028e+07 assign (segid " A" and resid 105 and name HD21) (segid " A" and resid 105 and name HD22) 1.782 0.397 0.397 weight 1.000 ! spec=15N_...last, no=1235, id=1230, vol=6.801500e+07 assign (segid " A" and resid 73 and name HD21) (segid " A" and resid 73 and name HD22) 1.735 0.376 0.376 weight 1.000 ! spec=15N_...last, no=1259, id=1235, vol=5.792418e+07 assign (segid " A" and resid 73 and name HD21) (segid " A" and resid 73 and name HA) 4.394 2.413 2.413 weight 1.000 ! spec=15N_...last, no=1263, id=1237, vol=3.037721e+06 assign (segid " A" and resid 73 and name HD21) (segid " A" and resid 73 and name HB2) 2.404 0.722 0.722 weight 1.000 ! spec=15N_...last, no=1264, id=1238, vol=1.168556e+07 assign (segid " A" and resid 73 and name HD22) (segid " A" and resid 73 and name HB2) 3.963 1.964 1.964 weight 1.000 ! spec=15N_...last, no=1265, id=1239, vol=6.060868e+06 assign (segid " A" and resid 128 and name HN) (segid " A" and resid 129 and name HN) 2.723 0.927 0.927 weight 1.000 ! spec=15N_...last, no=1285, id=1240, vol=1.411692e+07 assign (segid " A" and resid 24 and name HA) (segid " A" and resid 24 and name HN) 2.466 0.760 0.760 weight 1.000 ! spec=15N_...last, no=1286, id=1241, vol=2.511151e+07 assign (segid " A" and resid 26 and name HN) (segid " A" and resid 23 and name HA) 2.458 0.756 3.542 weight 1.000 ! spec=15N_...last, no=1287, id=1242, vol=2.600089e+07 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 21 and name HN) 2.505 0.784 0.784 weight 1.000 ! spec=15N_...last, no=1289, id=1243, vol=1.409268e+07 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 89 and name HZ) 3.814 1.818 1.818 weight 1.000 ! spec=15N_...last, no=1290, id=1244, vol=5.605910e+06 assign (segid " A" and resid 26 and name HN) (segid " A" and resid 27 and name HB1) 4.286 2.297 2.297 weight 1.000 ! spec=15N_...last, no=1294, id=1246, vol=4.788598e+06 assign (segid " A" and resid 26 and name HN) (segid " A" and resid 25 and name HB) 2.064 0.532 0.532 weight 1.000 ! spec=15N_...last, no=1297, id=1248, vol=5.441476e+07 assign (segid " A" and resid 41 and name HN) (segid " A" and resid 40 and name HB1) 4.040 2.041 2.041 weight 1.000 ! spec=15N_...last, no=1301, id=1250, vol=4.120577e+06 assign (segid " A" and resid 76 and name HN) (segid " A" and resid 77 and name HN) 2.254 0.635 0.635 weight 1.000 ! spec=15N_...last, no=1307, id=1251, vol=2.540943e+07 assign (segid " A" and resid 80 and name HN) (segid " A" and resid 80 and name HG) 2.322 0.674 0.674 weight 1.000 ! spec=15N_...last, no=1308, id=1252, vol=3.553017e+07 assign (segid " A" and resid 45 and name HN) (segid " A" and resid 45 and name HB2) 3.168 1.254 1.254 weight 1.000 ! spec=15N_...last, no=1319, id=1254, vol=5.054958e+06 assign (segid " A" and resid 45 and name HN) (segid " A" and resid 44 and name HA1) 5.201 3.382 3.382 weight 1.000 ! spec=15N_...last, no=1320, id=1255, vol=1.265862e+06 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 42 and name HA2) 3.606 1.625 1.625 weight 1.000 ! spec=15N_...last, no=1329, id=1256, vol=3.787565e+06 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 43 and name HB1) 3.400 1.445 1.445 weight 1.000 ! spec=15N_...last, no=1330, id=1257, vol=9.761315e+06 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 43 and name HB2) 3.121 1.218 1.218 weight 1.000 ! spec=15N_...last, no=1331, id=1258, vol=6.207110e+06 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 42 and name HA1) 3.012 1.134 1.134 weight 1.000 ! spec=15N_...last, no=1332, id=1259, vol=8.849899e+06 assign (segid " A" and resid 72 and name HE1) (segid " A" and resid 72 and name HD1) 2.674 0.894 0.894 weight 1.000 ! spec=15N_...last, no=1334, id=1260, vol=1.715733e+07 assign (segid " A" and resid 71 and name HN) (segid " A" and resid 123 and name HB2) 3.067 1.176 1.176 weight 1.000 ! spec=15N_...last, no=1336, id=1261, vol=8.154446e+06 assign (segid " A" and resid 33 and name HN) (segid " A" and resid 34 and name HN) 4.357 2.373 2.373 weight 1.000 ! spec=15N_...last, no=1339, id=1262, vol=2.188204e+06 assign (segid " A" and resid 33 and name HN) (segid " A" and resid 31 and name HB2) 4.969 3.086 3.086 weight 1.000 ! spec=15N_...last, no=1344, id=1263, vol=2.732122e+06 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 49 and name HG22) 2.748 0.944 0.944 weight 1.000 ! spec=15N_...last, no=1354, id=1265, vol=1.092162e+07 or (segid " A" and resid 22 and name HN) (segid " A" and resid 49 and name HG21) or (segid " A" and resid 22 and name HN) (segid " A" and resid 49 and name HG23) assign (segid " A" and resid 50 and name HN) (segid " A" and resid 35 and name HA) 4.002 2.002 2.002 weight 1.000 ! spec=15N_...last, no=1357, id=1266, vol=4.176749e+06 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 18 and name HB2) 4.591 2.635 2.635 weight 1.000 ! spec=15N_...last, no=1359, id=1267, vol=2.264868e+06 or (segid " A" and resid 14 and name HN) (segid " A" and resid 18 and name HB1) or (segid " A" and resid 14 and name HN) (segid " A" and resid 18 and name HB3) assign (segid " A" and resid 58 and name HN) (segid " A" and resid 58 and name HA) 3.527 1.555 1.555 weight 1.000 ! spec=15N_...last, no=1373, id=1268, vol=4.282968e+06 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 11 and name HB2) 3.001 1.126 1.126 weight 1.000 ! spec=15N_...last, no=1377, id=1269, vol=6.997564e+06 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 30 and name HD21) 3.843 1.846 1.846 weight 1.000 ! spec=15N_...last, no=1378, id=1270, vol=2.826791e+06 assign (segid " A" and resid 77 and name HN) (segid " A" and resid 128 and name HE1) 4.202 2.207 2.207 weight 1.000 ! spec=15N_...last, no=1384, id=1271, vol=4.885774e+06 or (segid " A" and resid 77 and name HN) (segid " A" and resid 128 and name HE2) assign (segid " A" and resid 103 and name HE1) (segid " A" and resid 123 and name HD12) 3.232 1.306 1.306 weight 1.000 ! spec=15N_...last, no=1391, id=1272, vol=4.855648e+06 or (segid " A" and resid 103 and name HE1) (segid " A" and resid 123 and name HD11) or (segid " A" and resid 103 and name HE1) (segid " A" and resid 123 and name HD13) assign (segid " A" and resid 68 and name HN) (segid " A" and resid 52 and name HA) 3.465 1.501 1.501 weight 1.000 ! spec=15N_...last, no=1392, id=1273, vol=7.179814e+06 assign (segid " A" and resid 10 and name HN) (segid " A" and resid 9 and name HG21) 3.122 1.218 1.218 weight 1.000 ! spec=15N_...last, no=1395, id=1274, vol=1.133838e+07 or (segid " A" and resid 10 and name HN) (segid " A" and resid 9 and name HG22) or (segid " A" and resid 10 and name HN) (segid " A" and resid 9 and name HG23) assign (segid " A" and resid 125 and name HN) (segid " A" and resid 126 and name HB2) 4.482 2.511 2.511 weight 1.000 ! spec=15N_...last, no=1398, id=1275, vol=3.083252e+06 assign (segid " A" and resid 72 and name HE1) (segid " A" and resid 126 and name HD12) 4.005 2.005 2.005 weight 1.000 ! spec=15N_...last, no=1401, id=1276, vol=4.852643e+06 or (segid " A" and resid 72 and name HE1) (segid " A" and resid 126 and name HD11) or (segid " A" and resid 72 and name HE1) (segid " A" and resid 126 and name HD13) assign (segid " A" and resid 129 and name HN) (segid " A" and resid 92 and name HD1) 4.408 2.429 2.429 weight 1.000 ! spec=15N_...last, no=1402, id=1277, vol=3.177335e+06 or (segid " A" and resid 129 and name HN) (segid " A" and resid 92 and name HD2) assign (segid " A" and resid 129 and name HN) (segid " A" and resid 92 and name HE1) 4.640 2.691 2.691 weight 1.000 ! spec=15N_...last, no=1403, id=1278, vol=2.084156e+06 or (segid " A" and resid 129 and name HN) (segid " A" and resid 92 and name HE2) assign (segid " A" and resid 72 and name HE1) (segid " A" and resid 126 and name HG) 3.981 1.981 1.981 weight 1.000 ! spec=15N_...last, no=1404, id=1279, vol=5.224796e+06 assign (segid " A" and resid 117 and name HN) (segid " A" and resid 108 and name HA2) 4.549 2.587 2.587 weight 1.000 ! spec=15N_...last, no=1419, id=1280, vol=1.684728e+06 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 13 and name HD1) 4.012 2.012 2.012 weight 1.000 ! spec=15N_...last, no=1423, id=1281, vol=4.264980e+06 or (segid " A" and resid 18 and name HN) (segid " A" and resid 13 and name HD2) assign (segid " A" and resid 129 and name HN) (segid " A" and resid 128 and name HD1) 4.491 2.521 2.521 weight 1.000 ! spec=15N_...last, no=1428, id=1282, vol=5.152993e+06 or (segid " A" and resid 129 and name HN) (segid " A" and resid 128 and name HD2) assign (segid " A" and resid 48 and name HE22) (segid " A" and resid 38 and name HG12) 4.008 2.008 2.008 weight 1.000 ! spec=15N_...last, no=1454, id=1285, vol=5.555560e+06 or (segid " A" and resid 48 and name HE22) (segid " A" and resid 38 and name HG11) or (segid " A" and resid 48 and name HE22) (segid " A" and resid 38 and name HG13) assign (segid " A" and resid 48 and name HE21) (segid " A" and resid 38 and name HG12) 3.565 1.589 1.589 weight 1.000 ! spec=15N_...last, no=1455, id=1286, vol=3.825604e+06 or (segid " A" and resid 48 and name HE21) (segid " A" and resid 38 and name HG11) or (segid " A" and resid 48 and name HE21) (segid " A" and resid 38 and name HG13) assign (segid " A" and resid 6 and name HN) (segid " A" and resid 6 and name HA) 2.444 0.747 0.747 weight 1.000 ! spec=15N_...last, no=1456, id=1287, vol=2.371616e+07 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 38 and name HB) 2.582 0.833 0.833 weight 1.000 ! spec=15N_...last, no=1462, id=1288, vol=9.437375e+06 assign (segid " A" and resid 93 and name HN) (segid " A" and resid 96 and name HG) 4.360 2.377 2.377 weight 1.000 ! spec=15N_...last, no=1463, id=1289, vol=2.747421e+06 assign (segid " A" and resid 123 and name HN) (segid " A" and resid 68 and name HD12) 3.166 1.253 1.253 weight 1.000 ! spec=15N_...last, no=1464, id=1290, vol=6.923084e+06 or (segid " A" and resid 123 and name HN) (segid " A" and resid 68 and name HD11) or (segid " A" and resid 123 and name HN) (segid " A" and resid 68 and name HD13) assign (segid " A" and resid 68 and name HN) (segid " A" and resid 67 and name HB1) 4.914 3.019 3.019 weight 1.000 ! spec=15N_...last, no=1466, id=1291, vol=1.622178e+06 assign (segid " A" and resid 67 and name HD22) (segid " A" and resid 69 and name HB2) 3.359 1.410 1.410 weight 1.000 ! spec=15N_...last, no=1473, id=1292, vol=2.795968e+06 or (segid " A" and resid 67 and name HD22) (segid " A" and resid 69 and name HB1) or (segid " A" and resid 67 and name HD22) (segid " A" and resid 69 and name HB3) assign (segid " A" and resid 67 and name HD22) (segid " A" and resid 122 and name HD22) 3.470 1.505 1.505 weight 1.000 ! spec=15N_...last, no=1475, id=1293, vol=2.983407e+06 or (segid " A" and resid 67 and name HD22) (segid " A" and resid 122 and name HD21) or (segid " A" and resid 67 and name HD22) (segid " A" and resid 122 and name HD23) assign (segid " A" and resid 85 and name HN) (segid " A" and resid 83 and name HN) 4.644 2.696 2.696 weight 1.000 ! spec=15N_...last, no=1486, id=1295, vol=9.826909e+05 assign (segid " A" and resid 85 and name HN) (segid " A" and resid 84 and name HA) 3.062 1.172 1.172 weight 1.000 ! spec=15N_...last, no=1487, id=1296, vol=1.137998e+07 assign (segid " A" and resid 67 and name HD21) (segid " A" and resid 122 and name HD22) 3.168 1.254 1.254 weight 1.000 ! spec=15N_...last, no=1497, id=1297, vol=2.442900e+06 or (segid " A" and resid 67 and name HD21) (segid " A" and resid 122 and name HD21) or (segid " A" and resid 67 and name HD21) (segid " A" and resid 122 and name HD23) assign (segid " A" and resid 67 and name HD21) (segid " A" and resid 69 and name HB2) 3.468 1.503 1.503 weight 1.000 ! spec=15N_...last, no=1498, id=1298, vol=2.489078e+06 or (segid " A" and resid 67 and name HD21) (segid " A" and resid 69 and name HB1) or (segid " A" and resid 67 and name HD21) (segid " A" and resid 69 and name HB3) assign (segid " A" and resid 16 and name HN) (segid " A" and resid 16 and name HG1) 3.803 1.808 1.808 weight 1.000 ! spec=15N_...last, no=1502, id=1299, vol=1.081468e+07 assign (segid " A" and resid 98 and name HN) (segid " A" and resid 97 and name HD2) 2.843 1.010 1.010 weight 1.000 ! spec=15N_...last, no=1504, id=1300, vol=1.091242e+07 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 12 and name HA) 3.088 1.192 1.192 weight 1.000 ! spec=15N_...last, no=1508, id=1301, vol=7.228566e+06 assign (segid " A" and resid 111 and name HN) (segid " A" and resid 110 and name HA) 2.526 0.797 0.797 weight 1.000 ! spec=15N_...last, no=1517, id=1304, vol=1.748245e+07 assign (segid " A" and resid 111 and name HN) (segid " A" and resid 104 and name HG1) 4.107 2.108 2.108 weight 1.000 ! spec=15N_...last, no=1518, id=1305, vol=4.657594e+06 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 10 and name HA) 3.560 1.584 1.584 weight 1.000 ! spec=15N_...last, no=1528, id=1307, vol=3.727083e+06 assign (segid " A" and resid 49 and name HN) (segid " A" and resid 70 and name HB2) 2.620 0.858 0.858 weight 1.000 ! spec=15N_...last, no=1530, id=1308, vol=9.304435e+06 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 40 and name HE1) 4.540 2.577 2.577 weight 1.000 ! spec=15N_...last, no=1531, id=1309, vol=1.933673e+06 or (segid " A" and resid 43 and name HN) (segid " A" and resid 40 and name HE2) assign (segid " A" and resid 110 and name HN) (segid " A" and resid 116 and name HA) 3.074 1.181 1.181 weight 1.000 ! spec=15N_...last, no=1533, id=1310, vol=7.442712e+06 assign (segid " A" and resid 110 and name HN) (segid " A" and resid 109 and name HG12) 3.437 1.476 1.476 weight 1.000 ! spec=15N_...last, no=1537, id=1311, vol=3.777817e+06 or (segid " A" and resid 110 and name HN) (segid " A" and resid 109 and name HG11) or (segid " A" and resid 110 and name HN) (segid " A" and resid 109 and name HG13) assign (segid " A" and resid 116 and name HE21) (segid " A" and resid 121 and name HG12) 3.303 1.363 1.363 weight 1.000 ! spec=15N_...last, no=1543, id=1313, vol=1.064427e+07 or (segid " A" and resid 116 and name HE21) (segid " A" and resid 121 and name HG11) or (segid " A" and resid 116 and name HE21) (segid " A" and resid 121 and name HG13) assign (segid " A" and resid 116 and name HE22) (segid " A" and resid 120 and name HA) 2.907 1.056 1.056 weight 1.000 ! spec=15N_...last, no=1547, id=1314, vol=6.198446e+06 assign (segid " A" and resid 116 and name HE21) (segid " A" and resid 120 and name HA) 3.337 1.392 1.392 weight 1.000 ! spec=15N_...last, no=1548, id=1315, vol=8.197846e+06 assign (segid " A" and resid 103 and name HE1) (segid " A" and resid 126 and name HG) 3.075 1.182 2.925 weight 1.000 ! spec=15N_...last, no=1549, id=1316, vol=9.062965e+06 assign (segid " A" and resid 128 and name HN) (segid " A" and resid 127 and name HB1) 2.252 0.634 0.634 weight 1.000 ! spec=15N_...last, no=1552, id=1317, vol=1.766433e+07 assign (segid " A" and resid 34 and name HN) (segid " A" and resid 53 and name HA) 3.278 1.343 1.343 weight 1.000 ! spec=15N_...last, no=1563, id=1319, vol=4.835724e+06 assign (segid " A" and resid 53 and name HN) (segid " A" and resid 52 and name HG12) 2.510 0.787 0.787 weight 1.000 ! spec=15N_...last, no=1569, id=1321, vol=1.714037e+07 or (segid " A" and resid 53 and name HN) (segid " A" and resid 52 and name HG11) or (segid " A" and resid 53 and name HN) (segid " A" and resid 52 and name HG13) assign (segid " A" and resid 66 and name HN) (segid " A" and resid 115 and name HA) 3.152 1.242 1.242 weight 1.000 ! spec=15N_...last, no=1571, id=1322, vol=6.518774e+06 assign (segid " A" and resid 29 and name HN) (segid " A" and resid 29 and name HG) 1.971 0.486 0.486 weight 1.000 ! spec=15N_...last, no=1575, id=1323, vol=4.569988e+07 assign (segid " A" and resid 109 and name HN) (segid " A" and resid 108 and name HA1) 3.303 1.363 1.363 weight 1.000 ! spec=15N_...last, no=1580, id=1324, vol=1.007052e+07 assign (segid " A" and resid 109 and name HN) (segid " A" and resid 108 and name HA2) 3.107 1.207 1.207 weight 1.000 ! spec=15N_...last, no=1581, id=1325, vol=7.723298e+06 assign (segid " A" and resid 109 and name HN) (segid " A" and resid 104 and name HB1) 4.059 2.059 2.059 weight 1.000 ! spec=15N_...last, no=1586, id=1326, vol=3.771780e+06 assign (segid " A" and resid 98 and name HN) (segid " A" and resid 99 and name HB1) 4.325 2.338 2.338 weight 1.000 ! spec=15N_...last, no=1597, id=1327, vol=7.474104e+06 assign (segid " A" and resid 117 and name HN) (segid " A" and resid 118 and name HB1) 4.644 2.696 2.696 weight 1.000 ! spec=15N_...last, no=1601, id=1328, vol=7.007932e+06 assign (segid " A" and resid 117 and name HN) (segid " A" and resid 109 and name HG12) 4.377 2.395 2.395 weight 1.000 ! spec=15N_...last, no=1607, id=1329, vol=3.002353e+06 or (segid " A" and resid 117 and name HN) (segid " A" and resid 109 and name HG11) or (segid " A" and resid 117 and name HN) (segid " A" and resid 109 and name HG13) assign (segid " A" and resid 116 and name HN) (segid " A" and resid 62 and name HB1) 3.958 1.959 1.959 weight 1.000 ! spec=15N_...last, no=1612, id=1330, vol=4.254682e+06 assign (segid " A" and resid 116 and name HN) (segid " A" and resid 62 and name HB2) 3.099 1.200 1.200 weight 1.000 ! spec=15N_...last, no=1613, id=1331, vol=7.838123e+06 assign (segid " A" and resid 121 and name HN) (segid " A" and resid 120 and name HB2) 4.127 2.129 2.129 weight 1.000 ! spec=15N_...last, no=1615, id=1332, vol=4.863844e+06 assign (segid " A" and resid 118 and name HN) (segid " A" and resid 116 and name HB2) 2.491 0.776 0.776 weight 1.000 ! spec=15N_...last, no=1617, id=1333, vol=1.303108e+07 assign (segid " A" and resid 85 and name HN) (segid " A" and resid 82 and name HB2) 3.592 1.613 1.613 weight 1.000 ! spec=15N_...last, no=1618, id=1334, vol=2.453618e+06 assign (segid " A" and resid 85 and name HN) (segid " A" and resid 83 and name HA) 3.683 1.696 1.696 weight 1.000 ! spec=15N_...last, no=1620, id=1335, vol=3.435716e+06 assign (segid " A" and resid 85 and name HN) (segid " A" and resid 82 and name HN) 4.100 2.101 2.101 weight 1.000 ! spec=15N_...last, no=1621, id=1336, vol=2.298232e+06 assign (segid " A" and resid 129 and name HN) (segid " A" and resid 127 and name HB1) 3.637 1.653 1.653 weight 1.000 ! spec=15N_...last, no=1622, id=1337, vol=5.234016e+06 assign (segid " A" and resid 107 and name HN) (segid " A" and resid 108 and name HA1) 5.588 3.903 3.903 weight 1.000 ! spec=15N_...last, no=1627, id=1338, vol=1.887084e+06 assign (segid " A" and resid 107 and name HN) (segid " A" and resid 104 and name HA) 3.717 1.727 1.727 weight 1.000 ! spec=15N_...last, no=1628, id=1339, vol=2.630219e+06 assign (segid " A" and resid 107 and name HN) (segid " A" and resid 108 and name HA2) 5.539 3.835 3.835 weight 1.000 ! spec=15N_...last, no=1629, id=1340, vol=1.631282e+06 assign (segid " A" and resid 107 and name HN) (segid " A" and resid 109 and name HG12) 4.152 2.155 2.155 weight 1.000 ! spec=15N_...last, no=1632, id=1341, vol=4.329689e+06 or (segid " A" and resid 107 and name HN) (segid " A" and resid 109 and name HG11) or (segid " A" and resid 107 and name HN) (segid " A" and resid 109 and name HG13) assign (segid " A" and resid 30 and name HA) (segid " A" and resid 30 and name HB1) 2.873 1.032 1.032 weight 1.000 ! spec=NOESY_D2O, no=19, id=8, vol=1.174836e+06 assign (segid " A" and resid 35 and name HA) (segid " A" and resid 35 and name HB) 2.388 0.713 0.713 weight 1.000 ! spec=NOESY_D2O, no=24, id=12, vol=2.972374e+06 assign (segid " A" and resid 37 and name HB) (segid " A" and resid 37 and name HA) 2.753 0.948 0.948 weight 1.000 ! spec=NOESY_D2O, no=25, id=13, vol=1.419762e+06 assign (segid " A" and resid 39 and name HA1) (segid " A" and resid 39 and name HA2) 1.977 0.489 0.489 weight 1.000 ! spec=NOESY_D2O, no=26, id=14, vol=4.832288e+06 assign (segid " A" and resid 103 and name HH2) (segid " A" and resid 103 and name HZ2) 2.314 0.670 0.670 weight 1.000 ! spec=NOESY_D2O, no=30, id=16, vol=4.593619e+06 assign (segid " A" and resid 128 and name HE1) (segid " A" and resid 80 and name HD12) 3.516 1.545 1.545 weight 1.000 ! spec=NOESY_D2O, no=65, id=22, vol=7.850404e+05 or (segid " A" and resid 128 and name HE1) (segid " A" and resid 80 and name HD11) or (segid " A" and resid 128 and name HE1) (segid " A" and resid 80 and name HD13) or (segid " A" and resid 128 and name HE2) (segid " A" and resid 80 and name HD12) or (segid " A" and resid 128 and name HE2) (segid " A" and resid 80 and name HD11) or (segid " A" and resid 128 and name HE2) (segid " A" and resid 80 and name HD13) assign (segid " A" and resid 103 and name HH2) (segid " A" and resid 103 and name HE3) 3.910 1.911 1.911 weight 1.000 ! spec=NOESY_D2O, no=79, id=34, vol=9.071001e+05 assign (segid " A" and resid 103 and name HZ3) (segid " A" and resid 103 and name HB1) 4.974 3.093 3.093 weight 1.000 ! spec=NOESY_D2O, no=82, id=36, vol=4.663454e+05 assign (segid " A" and resid 103 and name HD1) (segid " A" and resid 103 and name HB2) 3.951 1.951 1.951 weight 1.000 ! spec=NOESY_D2O, no=83, id=37, vol=6.954571e+05 assign (segid " A" and resid 31 and name HD2) (segid " A" and resid 31 and name HB1) 4.428 2.451 2.451 weight 1.000 ! spec=NOESY_D2O, no=90, id=39, vol=3.819672e+05 assign (segid " A" and resid 31 and name HD2) (segid " A" and resid 31 and name HB2) 3.222 1.298 1.298 weight 1.000 ! spec=NOESY_D2O, no=92, id=40, vol=7.754121e+05 assign (segid " A" and resid 103 and name HD1) (segid " A" and resid 103 and name HA) 2.274 0.646 0.646 weight 1.000 ! spec=NOESY_D2O, no=106, id=44, vol=4.379398e+06 assign (segid " A" and resid 55 and name HD2) (segid " A" and resid 55 and name HA) 4.134 2.136 2.136 weight 1.000 ! spec=NOESY_D2O, no=107, id=45, vol=3.774849e+05 assign (segid " A" and resid 103 and name HD1) (segid " A" and resid 103 and name HB1) 3.837 1.840 1.840 weight 1.000 ! spec=NOESY_D2O, no=108, id=46, vol=4.456298e+05 assign (segid " A" and resid 103 and name HD1) (segid " A" and resid 103 and name HE3) 4.375 2.393 2.393 weight 1.000 ! spec=NOESY_D2O, no=117, id=48, vol=3.511885e+05 assign (segid " A" and resid 103 and name HD1) (segid " A" and resid 103 and name HZ2) 4.342 2.357 2.357 weight 1.000 ! spec=NOESY_D2O, no=118, id=49, vol=4.825859e+05 assign (segid " A" and resid 34 and name HD2) (segid " A" and resid 34 and name HA) 4.399 2.419 2.419 weight 1.000 ! spec=NOESY_D2O, no=129, id=50, vol=2.348685e+05 assign (segid " A" and resid 64 and name HD2) (segid " A" and resid 64 and name HA) 4.317 2.329 2.329 weight 1.000 ! spec=NOESY_D2O, no=132, id=51, vol=1.787752e+05 assign (segid " A" and resid 62 and name HD1) (segid " A" and resid 62 and name HA) 3.328 1.384 1.384 weight 1.000 ! spec=NOESY_D2O, no=134, id=52, vol=1.896716e+06 or (segid " A" and resid 62 and name HD2) (segid " A" and resid 62 and name HA) assign (segid " A" and resid 62 and name HE1) (segid " A" and resid 62 and name HA) 4.936 3.045 3.045 weight 1.000 ! spec=NOESY_D2O, no=145, id=53, vol=2.118550e+05 or (segid " A" and resid 62 and name HE2) (segid " A" and resid 62 and name HA) assign (segid " A" and resid 62 and name HE1) (segid " A" and resid 62 and name HB2) 4.975 3.094 3.094 weight 1.000 ! spec=NOESY_D2O, no=147, id=54, vol=2.026470e+05 or (segid " A" and resid 62 and name HE2) (segid " A" and resid 62 and name HB2) assign (segid " A" and resid 62 and name HE1) (segid " A" and resid 62 and name HB1) 5.129 3.288 3.288 weight 1.000 ! spec=NOESY_D2O, no=148, id=55, vol=1.609791e+05 or (segid " A" and resid 62 and name HE2) (segid " A" and resid 62 and name HB1) assign (segid " A" and resid 40 and name HD1) (segid " A" and resid 40 and name HB2) 3.125 1.221 1.221 weight 1.000 ! spec=NOESY_D2O, no=156, id=60, vol=2.247590e+06 or (segid " A" and resid 40 and name HD2) (segid " A" and resid 40 and name HB2) assign (segid " A" and resid 40 and name HE1) (segid " A" and resid 40 and name HB1) 4.772 2.847 2.847 weight 1.000 ! spec=NOESY_D2O, no=158, id=62, vol=2.764376e+05 or (segid " A" and resid 40 and name HE2) (segid " A" and resid 40 and name HB1) assign (segid " A" and resid 40 and name HE1) (segid " A" and resid 40 and name HB2) 4.396 2.415 2.415 weight 1.000 ! spec=NOESY_D2O, no=159, id=63, vol=4.438318e+05 or (segid " A" and resid 40 and name HE2) (segid " A" and resid 40 and name HB2) assign (segid " A" and resid 111 and name HE1) (segid " A" and resid 111 and name HA) 4.047 2.047 2.047 weight 1.000 ! spec=NOESY_D2O, no=162, id=64, vol=6.410561e+05 or (segid " A" and resid 111 and name HE2) (segid " A" and resid 111 and name HA) assign (segid " A" and resid 111 and name HD1) (segid " A" and resid 111 and name HB1) 2.930 1.073 1.073 weight 1.000 ! spec=NOESY_D2O, no=163, id=65, vol=3.142029e+06 or (segid " A" and resid 111 and name HD2) (segid " A" and resid 111 and name HB1) assign (segid " A" and resid 128 and name HE1) (segid " A" and resid 77 and name HG12) 4.107 2.108 2.108 weight 1.000 ! spec=NOESY_D2O, no=171, id=67, vol=4.351195e+05 or (segid " A" and resid 128 and name HE2) (segid " A" and resid 77 and name HG12) assign (segid " A" and resid 128 and name HZ) (segid " A" and resid 80 and name HD12) 3.710 1.721 1.721 weight 1.000 ! spec=NOESY_D2O, no=174, id=69, vol=2.256968e+05 or (segid " A" and resid 128 and name HZ) (segid " A" and resid 80 and name HD11) or (segid " A" and resid 128 and name HZ) (segid " A" and resid 80 and name HD13) assign (segid " A" and resid 128 and name HZ) (segid " A" and resid 77 and name HG12) 3.510 1.540 1.540 weight 1.000 ! spec=NOESY_D2O, no=177, id=70, vol=3.414945e+05 assign (segid " A" and resid 128 and name HE1) (segid " A" and resid 128 and name HB2) 4.366 2.383 2.383 weight 1.000 ! spec=NOESY_D2O, no=181, id=71, vol=4.378144e+05 or (segid " A" and resid 128 and name HE2) (segid " A" and resid 128 and name HB2) assign (segid " A" and resid 128 and name HD1) (segid " A" and resid 128 and name HZ) 4.466 2.493 2.493 weight 1.000 ! spec=NOESY_D2O, no=192, id=75, vol=3.648386e+05 or (segid " A" and resid 128 and name HD2) (segid " A" and resid 128 and name HZ) assign (segid " A" and resid 111 and name HD1) (segid " A" and resid 111 and name HA) 3.223 1.298 1.298 weight 1.000 ! spec=NOESY_D2O, no=196, id=77, vol=2.218506e+06 or (segid " A" and resid 111 and name HD2) (segid " A" and resid 111 and name HA) assign (segid " A" and resid 17 and name HD1) (segid " A" and resid 17 and name HA) 3.234 1.307 1.307 weight 1.000 ! spec=NOESY_D2O, no=197, id=78, vol=1.859746e+06 or (segid " A" and resid 17 and name HD2) (segid " A" and resid 17 and name HA) assign (segid " A" and resid 17 and name HE1) (segid " A" and resid 17 and name HZ) 2.872 1.031 1.031 weight 1.000 ! spec=NOESY_D2O, no=202, id=83, vol=3.386631e+06 or (segid " A" and resid 17 and name HE2) (segid " A" and resid 17 and name HZ) assign (segid " A" and resid 111 and name HD1) (segid " A" and resid 111 and name HB2) 3.046 1.160 1.160 weight 1.000 ! spec=NOESY_D2O, no=205, id=84, vol=2.655090e+06 or (segid " A" and resid 111 and name HD2) (segid " A" and resid 111 and name HB2) assign (segid " A" and resid 111 and name HE1) (segid " A" and resid 111 and name HB2) 3.541 1.568 1.568 weight 1.000 ! spec=NOESY_D2O, no=206, id=85, vol=1.576544e+06 or (segid " A" and resid 111 and name HE2) (segid " A" and resid 111 and name HB2) assign (segid " A" and resid 111 and name HE1) (segid " A" and resid 111 and name HB1) 3.616 1.635 1.635 weight 1.000 ! spec=NOESY_D2O, no=207, id=86, vol=1.390516e+06 or (segid " A" and resid 111 and name HE2) (segid " A" and resid 111 and name HB1) assign (segid " A" and resid 111 and name HD1) (segid " A" and resid 111 and name HZ) 3.436 1.476 1.476 weight 1.000 ! spec=NOESY_D2O, no=209, id=88, vol=1.696086e+06 or (segid " A" and resid 111 and name HD2) (segid " A" and resid 111 and name HZ) assign (segid " A" and resid 13 and name HZ) (segid " A" and resid 13 and name HD1) 4.436 2.460 2.460 weight 1.000 ! spec=NOESY_D2O, no=233, id=97, vol=3.757943e+05 or (segid " A" and resid 13 and name HZ) (segid " A" and resid 13 and name HD2) assign (segid " A" and resid 13 and name HE1) (segid " A" and resid 13 and name HB1) 4.454 2.480 2.480 weight 1.000 ! spec=NOESY_D2O, no=236, id=100, vol=3.655027e+05 or (segid " A" and resid 13 and name HE2) (segid " A" and resid 13 and name HB1) assign (segid " A" and resid 13 and name HD1) (segid " A" and resid 13 and name HB1) 4.319 2.332 2.332 weight 1.000 ! spec=NOESY_D2O, no=237, id=101, vol=2.851155e+05 or (segid " A" and resid 13 and name HD2) (segid " A" and resid 13 and name HB1) assign (segid " A" and resid 13 and name HD1) (segid " A" and resid 13 and name HB2) 2.755 0.949 0.949 weight 1.000 ! spec=NOESY_D2O, no=238, id=102, vol=4.270072e+06 or (segid " A" and resid 13 and name HD2) (segid " A" and resid 13 and name HB2) assign (segid " A" and resid 92 and name HE1) (segid " A" and resid 92 and name HD1) 3.916 1.917 1.917 weight 1.000 ! spec=NOESY_D2O, no=241, id=104, vol=1.161490e+06 or (segid " A" and resid 92 and name HE1) (segid " A" and resid 92 and name HD2) or (segid " A" and resid 92 and name HE2) (segid " A" and resid 92 and name HD1) or (segid " A" and resid 92 and name HE2) (segid " A" and resid 92 and name HD2) assign (segid " A" and resid 92 and name HD1) (segid " A" and resid 92 and name HB2) 4.127 2.129 2.129 weight 1.000 ! spec=NOESY_D2O, no=243, id=105, vol=3.993407e+05 or (segid " A" and resid 92 and name HD2) (segid " A" and resid 92 and name HB2) assign (segid " A" and resid 72 and name HE3) (segid " A" and resid 72 and name HZ3) 2.695 0.908 0.908 weight 1.000 ! spec=NOESY_D2O, no=277, id=111, vol=2.395100e+06 assign (segid " A" and resid 72 and name HE3) (segid " A" and resid 13 and name HE1) 3.729 1.738 1.738 weight 1.000 ! spec=NOESY_D2O, no=281, id=112, vol=9.431081e+05 or (segid " A" and resid 72 and name HE3) (segid " A" and resid 13 and name HE2) assign (segid " A" and resid 72 and name HE3) (segid " A" and resid 13 and name HZ) 3.779 1.785 1.785 weight 1.000 ! spec=NOESY_D2O, no=292, id=114, vol=3.758149e+05 assign (segid " A" and resid 128 and name HZ) (segid " A" and resid 13 and name HZ) 3.431 1.471 1.471 weight 1.000 ! spec=NOESY_D2O, no=293, id=115, vol=5.460843e+05 assign (segid " A" and resid 77 and name HD12) (segid " A" and resid 77 and name HG12) 2.660 0.885 0.885 weight 1.000 ! spec=NOESY_D2O, no=301, id=116, vol=8.695173e+05 or (segid " A" and resid 77 and name HD11) (segid " A" and resid 77 and name HG12) or (segid " A" and resid 77 and name HD13) (segid " A" and resid 77 and name HG12) assign (segid " A" and resid 40 and name HD1) (segid " A" and resid 40 and name HE1) 3.109 1.208 1.208 weight 1.000 ! spec=NOESY_D2O, no=312, id=120, vol=4.794632e+06 or (segid " A" and resid 40 and name HD1) (segid " A" and resid 40 and name HE2) or (segid " A" and resid 40 and name HD2) (segid " A" and resid 40 and name HE1) or (segid " A" and resid 40 and name HD2) (segid " A" and resid 40 and name HE2) assign (segid " A" and resid 128 and name HD1) (segid " A" and resid 80 and name HD12) 4.020 2.020 2.020 weight 1.000 ! spec=NOESY_D2O, no=482, id=121, vol=3.307641e+05 or (segid " A" and resid 128 and name HD1) (segid " A" and resid 80 and name HD11) or (segid " A" and resid 128 and name HD1) (segid " A" and resid 80 and name HD13) or (segid " A" and resid 128 and name HD2) (segid " A" and resid 80 and name HD12) or (segid " A" and resid 128 and name HD2) (segid " A" and resid 80 and name HD11) or (segid " A" and resid 128 and name HD2) (segid " A" and resid 80 and name HD13) assign (segid " A" and resid 103 and name HB1) (segid " A" and resid 103 and name HA) 3.365 1.416 1.416 weight 1.000 ! spec=NOESY_D2O, no=1419, id=129, vol=4.413169e+05 assign (segid " A" and resid 13 and name HZ) (segid " A" and resid 128 and name HE1) 4.176 2.180 2.180 weight 1.000 ! spec=NOESY_D2O, no=1724, id=130, vol=7.114321e+05 or (segid " A" and resid 13 and name HZ) (segid " A" and resid 128 and name HE2) assign (segid " A" and resid 89 and name HE1) (segid " A" and resid 17 and name HD1) 5.346 3.572 3.572 weight 1.000 ! spec=NOESY_D2O, no=1733, id=131, vol=2.156388e+05 or (segid " A" and resid 89 and name HE1) (segid " A" and resid 17 and name HD2) or (segid " A" and resid 89 and name HE2) (segid " A" and resid 17 and name HD1) or (segid " A" and resid 89 and name HE2) (segid " A" and resid 17 and name HD2) assign (segid " A" and resid 89 and name HD1) (segid " A" and resid 17 and name HD1) 4.827 2.913 2.913 weight 1.000 ! spec=NOESY_D2O, no=1734, id=132, vol=3.624228e+05 or (segid " A" and resid 89 and name HD1) (segid " A" and resid 17 and name HD2) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 17 and name HD1) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 17 and name HD2) assign (segid " A" and resid 115 and name HA) (segid " A" and resid 115 and name HB) 2.527 0.798 0.798 weight 1.000 ! spec=NOESY_D2O, no=1821, id=133, vol=2.295481e+06 assign (segid " A" and resid 77 and name HA) (segid " A" and resid 77 and name HG22) 2.701 0.912 0.912 weight 1.000 ! spec=NOESY_D2O, no=2450, id=134, vol=1.218072e+06 or (segid " A" and resid 77 and name HA) (segid " A" and resid 77 and name HG21) or (segid " A" and resid 77 and name HA) (segid " A" and resid 77 and name HG23) assign (segid " A" and resid 104 and name HA) (segid " A" and resid 104 and name HB2) 2.736 0.936 0.936 weight 1.000 ! spec=NOESY_D2O, no=2560, id=136, vol=3.716147e+06 assign (segid " A" and resid 77 and name HG22) (segid " A" and resid 77 and name HG12) 2.836 1.006 1.006 weight 1.000 ! spec=NOESY_D2O, no=2936, id=137, vol=7.273153e+05 or (segid " A" and resid 77 and name HG21) (segid " A" and resid 77 and name HG12) or (segid " A" and resid 77 and name HG23) (segid " A" and resid 77 and name HG12) assign (segid " A" and resid 77 and name HG12) (segid " A" and resid 77 and name HA) 3.043 1.158 1.158 weight 1.000 ! spec=NOESY_D2O, no=2951, id=143, vol=5.811770e+05 assign (segid " A" and resid 77 and name HB) (segid " A" and resid 77 and name HG12) 4.460 2.486 2.486 weight 1.000 ! spec=NOESY_D2O, no=2955, id=146, vol=1.380805e+05 assign (segid " A" and resid 43 and name HD2) (segid " A" and resid 43 and name HA) 5.070 3.213 3.213 weight 1.000 ! spec=NOESY_D2O, no=2961, id=147, vol=8.652446e+04 assign (segid " A" and resid 43 and name HD2) (segid " A" and resid 43 and name HB1) 4.050 2.050 2.050 weight 1.000 ! spec=NOESY_D2O, no=2962, id=148, vol=3.113187e+05 assign (segid " A" and resid 43 and name HD2) (segid " A" and resid 43 and name HB2) 3.681 1.694 1.694 weight 1.000 ! spec=NOESY_D2O, no=2963, id=149, vol=4.063393e+05 assign (segid " A" and resid 43 and name HE1) (segid " A" and resid 43 and name HD2) 5.596 3.915 3.915 weight 1.000 ! spec=NOESY_D2O, no=2964, id=150, vol=1.131057e+05 assign (segid " A" and resid 67 and name HA) (segid " A" and resid 52 and name HA) 2.880 1.037 1.037 weight 1.000 ! spec=NOESY_D2O, no=2972, id=151, vol=1.063824e+06 assign (segid " A" and resid 51 and name HG22) (segid " A" and resid 51 and name HA) 2.770 0.959 0.959 weight 1.000 ! spec=NOESY_D2O, no=2983, id=152, vol=1.111638e+06 or (segid " A" and resid 51 and name HG21) (segid " A" and resid 51 and name HA) or (segid " A" and resid 51 and name HG23) (segid " A" and resid 51 and name HA) assign (segid " A" and resid 51 and name HB) (segid " A" and resid 51 and name HA) 3.656 1.671 1.671 weight 1.000 ! spec=NOESY_D2O, no=2985, id=154, vol=2.397199e+05 assign (segid " A" and resid 72 and name HE3) (segid " A" and resid 72 and name HZ2) 4.583 2.625 2.625 weight 1.000 ! spec=NOESY_D2O, no=2995, id=161, vol=2.284338e+05 assign (segid " A" and resid 103 and name HH2) (segid " A" and resid 70 and name HD22) 2.793 0.975 0.975 weight 1.000 ! spec=NOESY_D2O, no=2998, id=162, vol=1.012412e+06 or (segid " A" and resid 103 and name HH2) (segid " A" and resid 70 and name HD21) or (segid " A" and resid 103 and name HH2) (segid " A" and resid 70 and name HD23) assign (segid " A" and resid 72 and name HH2) (segid " A" and resid 70 and name HB1) 2.873 1.032 1.032 weight 1.000 ! spec=NOESY_D2O, no=3002, id=163, vol=1.191448e+06 assign (segid " A" and resid 72 and name HH2) (segid " A" and resid 70 and name HD12) 2.722 0.926 0.926 weight 1.000 ! spec=NOESY_D2O, no=3007, id=164, vol=1.705222e+06 or (segid " A" and resid 72 and name HH2) (segid " A" and resid 70 and name HD11) or (segid " A" and resid 72 and name HH2) (segid " A" and resid 70 and name HD13) assign (segid " A" and resid 115 and name HA) (segid " A" and resid 115 and name HG21) 2.431 0.739 0.739 weight 1.000 ! spec=NOESY_D2O, no=3012, id=166, vol=2.888265e+06 or (segid " A" and resid 115 and name HA) (segid " A" and resid 115 and name HG22) or (segid " A" and resid 115 and name HA) (segid " A" and resid 115 and name HG23) assign (segid " A" and resid 89 and name HD1) (segid " A" and resid 80 and name HD12) 3.175 1.260 1.260 weight 1.000 ! spec=NOESY_D2O, no=3032, id=169, vol=1.300205e+06 or (segid " A" and resid 89 and name HD1) (segid " A" and resid 80 and name HD11) or (segid " A" and resid 89 and name HD1) (segid " A" and resid 80 and name HD13) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 80 and name HD12) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 80 and name HD11) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 80 and name HD13) assign (segid " A" and resid 73 and name HB2) (segid " A" and resid 73 and name HA) 3.038 1.153 1.153 weight 1.000 ! spec=NOESY_D2O, no=3038, id=171, vol=1.727771e+06 assign (segid " A" and resid 72 and name HD1) (segid " A" and resid 127 and name HA) 4.059 2.060 2.060 weight 1.000 ! spec=NOESY_D2O, no=3039, id=172, vol=1.923642e+05 assign (segid " A" and resid 22 and name HB2) (segid " A" and resid 21 and name HB) 3.105 1.205 1.205 weight 1.000 ! spec=NOESY_D2O, no=3056, id=173, vol=1.968414e+06 or (segid " A" and resid 22 and name HB1) (segid " A" and resid 21 and name HB) or (segid " A" and resid 22 and name HB3) (segid " A" and resid 21 and name HB) assign (segid " A" and resid 89 and name HD1) (segid " A" and resid 21 and name HD12) 3.422 1.464 2.578 weight 1.000 ! spec=NOESY_D2O, no=3060, id=174, vol=1.324846e+06 or (segid " A" and resid 89 and name HD1) (segid " A" and resid 21 and name HD11) or (segid " A" and resid 89 and name HD1) (segid " A" and resid 21 and name HD13) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 21 and name HD12) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 21 and name HD11) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 21 and name HD13) assign (segid " A" and resid 72 and name HZ2) (segid " A" and resid 21 and name HD12) 3.108 1.208 1.208 weight 1.000 ! spec=NOESY_D2O, no=3061, id=175, vol=1.127994e+06 or (segid " A" and resid 72 and name HZ2) (segid " A" and resid 21 and name HD11) or (segid " A" and resid 72 and name HZ2) (segid " A" and resid 21 and name HD13) assign (segid " A" and resid 100 and name HD12) (segid " A" and resid 103 and name HZ3) 3.200 1.280 1.280 weight 1.000 ! spec=NOESY_D2O, no=3066, id=177, vol=7.659086e+05 or (segid " A" and resid 100 and name HD11) (segid " A" and resid 103 and name HZ3) or (segid " A" and resid 100 and name HD13) (segid " A" and resid 103 and name HZ3) assign (segid " A" and resid 70 and name HD12) (segid " A" and resid 103 and name HZ3) 3.627 1.645 1.645 weight 1.000 ! spec=NOESY_D2O, no=3069, id=178, vol=2.521895e+05 or (segid " A" and resid 70 and name HD11) (segid " A" and resid 103 and name HZ3) or (segid " A" and resid 70 and name HD13) (segid " A" and resid 103 and name HZ3) assign (segid " A" and resid 128 and name HE1) (segid " A" and resid 77 and name HG11) 4.817 2.900 2.900 weight 1.000 ! spec=NOESY_D2O, no=3116, id=180, vol=2.719008e+05 or (segid " A" and resid 128 and name HE2) (segid " A" and resid 77 and name HG11) assign (segid " A" and resid 128 and name HE1) (segid " A" and resid 77 and name HB) 4.839 2.927 2.927 weight 1.000 ! spec=NOESY_D2O, no=3117, id=181, vol=2.918720e+05 or (segid " A" and resid 128 and name HE2) (segid " A" and resid 77 and name HB) assign (segid " A" and resid 128 and name HE1) (segid " A" and resid 72 and name HB2) 4.714 2.778 2.778 weight 1.000 ! spec=NOESY_D2O, no=3119, id=182, vol=4.702122e+05 or (segid " A" and resid 128 and name HE2) (segid " A" and resid 72 and name HB2) assign (segid " A" and resid 128 and name HE1) (segid " A" and resid 72 and name HD1) 5.375 3.611 3.611 weight 1.000 ! spec=NOESY_D2O, no=3122, id=183, vol=9.666876e+04 or (segid " A" and resid 128 and name HE2) (segid " A" and resid 72 and name HD1) assign (segid " A" and resid 9 and name HG21) (segid " A" and resid 10 and name HA) 2.635 0.868 0.868 weight 1.000 ! spec=NOESY_D2O, no=3131, id=185, vol=1.972186e+06 or (segid " A" and resid 9 and name HG22) (segid " A" and resid 10 and name HA) or (segid " A" and resid 9 and name HG23) (segid " A" and resid 10 and name HA) assign (segid " A" and resid 96 and name HB2) (segid " A" and resid 96 and name HB1) 1.585 0.314 0.314 weight 1.000 ! spec=NOESY_D2O, no=3133, id=186, vol=1.122509e+07 assign (segid " A" and resid 19 and name HA) (segid " A" and resid 19 and name HG1) 2.353 0.692 0.692 weight 1.000 ! spec=NOESY_D2O, no=3138, id=187, vol=5.913458e+06 assign (segid " A" and resid 70 and name HD22) (segid " A" and resid 72 and name HZ2) 3.331 1.387 1.387 weight 1.000 ! spec=NOESY_D2O, no=3159, id=188, vol=5.927862e+05 or (segid " A" and resid 70 and name HD21) (segid " A" and resid 72 and name HZ2) or (segid " A" and resid 70 and name HD23) (segid " A" and resid 72 and name HZ2) assign (segid " A" and resid 89 and name HD1) (segid " A" and resid 128 and name HD1) 3.733 1.742 1.742 weight 1.000 ! spec=NOESY_D2O, no=3199, id=189, vol=2.455467e+05 or (segid " A" and resid 89 and name HD1) (segid " A" and resid 128 and name HD2) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 128 and name HD1) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 128 and name HD2) assign (segid " A" and resid 92 and name HE1) (segid " A" and resid 128 and name HD1) 5.998 4.497 4.497 weight 1.000 ! spec=NOESY_D2O, no=3200, id=190, vol=1.068182e+05 or (segid " A" and resid 92 and name HE1) (segid " A" and resid 128 and name HD2) or (segid " A" and resid 92 and name HE2) (segid " A" and resid 128 and name HD1) or (segid " A" and resid 92 and name HE2) (segid " A" and resid 128 and name HD2) assign (segid " A" and resid 70 and name HB2) (segid " A" and resid 70 and name HD12) 1.822 0.415 0.415 weight 1.000 ! spec=NOESY_D2O, no=3203, id=191, vol=8.463386e+06 or (segid " A" and resid 70 and name HB2) (segid " A" and resid 70 and name HD11) or (segid " A" and resid 70 and name HB2) (segid " A" and resid 70 and name HD13) assign (segid " A" and resid 103 and name HE3) (segid " A" and resid 100 and name HD12) 2.765 0.956 0.956 weight 1.000 ! spec=NOESY_D2O, no=3212, id=192, vol=1.439378e+06 or (segid " A" and resid 103 and name HE3) (segid " A" and resid 100 and name HD11) or (segid " A" and resid 103 and name HE3) (segid " A" and resid 100 and name HD13) assign (segid " A" and resid 126 and name HB2) (segid " A" and resid 103 and name HZ2) 4.905 3.007 3.007 weight 1.000 ! spec=NOESY_D2O, no=3213, id=193, vol=2.166921e+05 assign (segid " A" and resid 17 and name HA) (segid " A" and resid 89 and name HZ) 3.723 1.733 1.733 weight 1.000 ! spec=NOESY_D2O, no=3216, id=195, vol=4.672589e+05 assign (segid " A" and resid 17 and name HA) (segid " A" and resid 89 and name HE1) 3.555 1.580 1.580 weight 1.000 ! spec=NOESY_D2O, no=3218, id=197, vol=1.637778e+06 or (segid " A" and resid 17 and name HA) (segid " A" and resid 89 and name HE2) assign (segid " A" and resid 17 and name HE1) (segid " A" and resid 86 and name HA) 4.013 2.013 2.013 weight 1.000 ! spec=NOESY_D2O, no=3221, id=199, vol=7.531397e+05 or (segid " A" and resid 17 and name HE2) (segid " A" and resid 86 and name HA) assign (segid " A" and resid 66 and name HA) (segid " A" and resid 66 and name HB2) 2.146 0.576 0.576 weight 1.000 ! spec=NOESY_D2O, no=3228, id=202, vol=4.148558e+06 assign (segid " A" and resid 89 and name HD1) (segid " A" and resid 17 and name HE1) 4.626 2.675 2.675 weight 1.000 ! spec=NOESY_D2O, no=3250, id=206, vol=5.028987e+05 or (segid " A" and resid 89 and name HD1) (segid " A" and resid 17 and name HE2) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 17 and name HE1) or (segid " A" and resid 89 and name HD2) (segid " A" and resid 17 and name HE2) assign (segid " A" and resid 72 and name HZ2) (segid " A" and resid 96 and name HD22) 3.084 1.189 2.916 weight 1.000 ! spec=NOESY_D2O, no=3258, id=207, vol=6.947257e+05 or (segid " A" and resid 72 and name HZ2) (segid " A" and resid 96 and name HD21) or (segid " A" and resid 72 and name HZ2) (segid " A" and resid 96 and name HD23) assign (segid " A" and resid 77 and name HA) (segid " A" and resid 80 and name HG) 3.627 1.645 1.645 weight 1.000 ! spec=NOESY_D2O, no=3259, id=208, vol=2.308386e+05 assign (segid " A" and resid 9 and name HA) (segid " A" and resid 12 and name HB1) 3.910 1.911 1.911 weight 1.000 ! spec=NOESY_D2O, no=3260, id=209, vol=3.502535e+05 assign (segid " A" and resid 40 and name HE1) (segid " A" and resid 40 and name HA) 3.979 1.979 1.979 weight 1.000 ! spec=NOESY_D2O, no=3262, id=210, vol=7.916243e+05 or (segid " A" and resid 40 and name HE2) (segid " A" and resid 40 and name HA) assign (segid " A" and resid 34 and name HD2) (segid " A" and resid 35 and name HA) 4.036 2.036 2.036 weight 1.000 ! spec=NOESY_D2O, no=3264, id=212, vol=2.155596e+05 assign (segid " A" and resid 100 and name HD12) (segid " A" and resid 111 and name HZ) 2.978 1.108 1.108 weight 1.000 ! spec=NOESY_D2O, no=3268, id=214, vol=7.675209e+05 or (segid " A" and resid 100 and name HD11) (segid " A" and resid 111 and name HZ) or (segid " A" and resid 100 and name HD13) (segid " A" and resid 111 and name HZ) assign (segid " A" and resid 100 and name HG) (segid " A" and resid 103 and name HE3) 3.695 1.707 1.707 weight 1.000 ! spec=NOESY_D2O, no=3276, id=216, vol=7.985401e+05 assign (segid " A" and resid 115 and name HA) (segid " A" and resid 66 and name HA) 4.208 2.214 2.214 weight 1.000 ! spec=NOESY_D2O, no=3277, id=217, vol=2.189630e+05 assign (segid " A" and resid 115 and name HA) (segid " A" and resid 116 and name HG2) 3.677 1.690 1.690 weight 1.000 ! spec=NOESY_D2O, no=3279, id=218, vol=3.280872e+05 assign (segid " A" and resid 115 and name HA) (segid " A" and resid 116 and name HB1) 4.163 2.166 2.166 weight 1.000 ! spec=NOESY_D2O, no=3281, id=219, vol=2.079072e+05 assign (segid " A" and resid 66 and name HB1) (segid " A" and resid 115 and name HA) 4.211 2.217 2.217 weight 1.000 ! spec=NOESY_D2O, no=3282, id=220, vol=4.634099e+05 assign (segid " A" and resid 103 and name HZ3) (segid " A" and resid 99 and name HB2) 4.240 2.248 2.248 weight 1.000 ! spec=NOESY_D2O, no=3288, id=221, vol=3.239232e+05 assign (segid " A" and resid 103 and name HH2) (segid " A" and resid 99 and name HB1) 2.952 1.090 1.090 weight 1.000 ! spec=NOESY_D2O, no=3290, id=222, vol=1.227521e+06 assign (segid " A" and resid 92 and name HA) (segid " A" and resid 130 and name HB2) 2.529 0.799 0.799 weight 1.000 ! spec=NOESY_D2O, no=3291, id=223, vol=1.933917e+06 or (segid " A" and resid 92 and name HA) (segid " A" and resid 130 and name HB1) or (segid " A" and resid 92 and name HA) (segid " A" and resid 130 and name HB3) assign (segid " A" and resid 130 and name HB2) (segid " A" and resid 92 and name HB2) 3.575 1.597 1.597 weight 1.000 ! spec=NOESY_D2O, no=3292, id=224, vol=4.005921e+05 or (segid " A" and resid 130 and name HB1) (segid " A" and resid 92 and name HB2) or (segid " A" and resid 130 and name HB3) (segid " A" and resid 92 and name HB2) assign (segid " A" and resid 100 and name HG) (segid " A" and resid 103 and name HZ3) 4.185 2.189 2.189 weight 1.000 ! spec=NOESY_D2O, no=3294, id=226, vol=4.764692e+05 assign (segid " A" and resid 100 and name HD12) (segid " A" and resid 111 and name HE1) 3.663 1.677 1.677 weight 1.000 ! spec=NOESY_D2O, no=3295, id=227, vol=6.261008e+05 or (segid " A" and resid 100 and name HD12) (segid " A" and resid 111 and name HE2) or (segid " A" and resid 100 and name HD11) (segid " A" and resid 111 and name HE1) or (segid " A" and resid 100 and name HD11) (segid " A" and resid 111 and name HE2) or (segid " A" and resid 100 and name HD13) (segid " A" and resid 111 and name HE1) or (segid " A" and resid 100 and name HD13) (segid " A" and resid 111 and name HE2) assign (segid " A" and resid 16 and name HN) (segid " A" and resid 15 and name HN) 2.361 0.697 0.697 weight 1.000 ! spec=NOESY_H2O, no=2, id=230, vol=3.208239e+06 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 22 and name HA) 2.677 0.896 0.896 weight 1.000 ! spec=NOESY_H2O, no=6, id=234, vol=2.367284e+06 assign (segid " A" and resid 16 and name HN) (segid " A" and resid 16 and name HA) 2.937 1.078 1.078 weight 1.000 ! spec=NOESY_H2O, no=15, id=240, vol=1.734850e+06 assign (segid " A" and resid 123 and name HN) (segid " A" and resid 123 and name HA) 3.090 1.194 1.194 weight 1.000 ! spec=NOESY_H2O, no=16, id=241, vol=9.986540e+05 assign (segid " A" and resid 12 and name HA) (segid " A" and resid 12 and name HN) 2.651 0.878 0.878 weight 1.000 ! spec=NOESY_H2O, no=23, id=244, vol=3.165637e+06 assign (segid " A" and resid 10 and name HA) (segid " A" and resid 10 and name HN) 2.527 0.798 0.798 weight 1.000 ! spec=NOESY_H2O, no=24, id=245, vol=3.843096e+06 assign (segid " A" and resid 26 and name HA) (segid " A" and resid 26 and name HN) 2.186 0.597 0.597 weight 1.000 ! spec=NOESY_H2O, no=25, id=246, vol=8.413637e+06 assign (segid " A" and resid 9 and name HN) (segid " A" and resid 9 and name HA) 2.877 1.034 1.034 weight 1.000 ! spec=NOESY_H2O, no=26, id=247, vol=1.848038e+06 assign (segid " A" and resid 20 and name HA) (segid " A" and resid 20 and name HN) 2.519 0.793 0.793 weight 1.000 ! spec=NOESY_H2O, no=27, id=248, vol=4.010286e+06 assign (segid " A" and resid 15 and name HB) (segid " A" and resid 15 and name HA) 2.236 0.625 0.625 weight 1.000 ! spec=NOESY_H2O, no=30, id=250, vol=6.949038e+06 assign (segid " A" and resid 23 and name HN) (segid " A" and resid 23 and name HA) 2.358 0.695 0.695 weight 1.000 ! spec=NOESY_H2O, no=34, id=253, vol=6.728774e+06 assign (segid " A" and resid 25 and name HA) (segid " A" and resid 25 and name HN) 2.795 0.977 0.977 weight 1.000 ! spec=NOESY_H2O, no=36, id=254, vol=2.065921e+06 assign (segid " A" and resid 27 and name HN) (segid " A" and resid 27 and name HA) 2.574 0.828 0.828 weight 1.000 ! spec=NOESY_H2O, no=38, id=256, vol=4.843908e+06 assign (segid " A" and resid 33 and name HB2) (segid " A" and resid 33 and name HN) 2.267 0.643 0.643 weight 1.000 ! spec=NOESY_H2O, no=48, id=260, vol=3.649346e+06 or (segid " A" and resid 33 and name HB1) (segid " A" and resid 33 and name HN) or (segid " A" and resid 33 and name HB3) (segid " A" and resid 33 and name HN) assign (segid " A" and resid 9 and name HA) (segid " A" and resid 9 and name HG21) 2.286 0.653 0.653 weight 1.000 ! spec=NOESY_H2O, no=50, id=262, vol=4.839204e+06 or (segid " A" and resid 9 and name HA) (segid " A" and resid 9 and name HG22) or (segid " A" and resid 9 and name HA) (segid " A" and resid 9 and name HG23) assign (segid " A" and resid 10 and name HA) (segid " A" and resid 10 and name HB2) 2.071 0.536 0.536 weight 1.000 ! spec=NOESY_H2O, no=51, id=263, vol=7.693195e+06 or (segid " A" and resid 10 and name HA) (segid " A" and resid 10 and name HB1) or (segid " A" and resid 10 and name HA) (segid " A" and resid 10 and name HB3) assign (segid " A" and resid 10 and name HB2) (segid " A" and resid 10 and name HN) 2.217 0.615 0.615 weight 1.000 ! spec=NOESY_H2O, no=52, id=264, vol=4.839267e+06 or (segid " A" and resid 10 and name HB1) (segid " A" and resid 10 and name HN) or (segid " A" and resid 10 and name HB3) (segid " A" and resid 10 and name HN) assign (segid " A" and resid 14 and name HA) (segid " A" and resid 14 and name HB2) 2.203 0.607 0.607 weight 1.000 ! spec=NOESY_H2O, no=54, id=266, vol=6.217952e+06 assign (segid " A" and resid 14 and name HA) (segid " A" and resid 14 and name HB1) 2.723 0.927 0.927 weight 1.000 ! spec=NOESY_H2O, no=55, id=267, vol=5.240832e+06 assign (segid " A" and resid 22 and name HA) (segid " A" and resid 22 and name HB2) 2.141 0.573 0.573 weight 1.000 ! spec=NOESY_H2O, no=57, id=269, vol=5.320430e+06 or (segid " A" and resid 22 and name HA) (segid " A" and resid 22 and name HB1) or (segid " A" and resid 22 and name HA) (segid " A" and resid 22 and name HB3) assign (segid " A" and resid 21 and name HA) (segid " A" and resid 21 and name HB) 2.423 0.734 0.734 weight 1.000 ! spec=NOESY_H2O, no=58, id=270, vol=5.267489e+06 assign (segid " A" and resid 33 and name HB2) (segid " A" and resid 33 and name HA) 2.149 0.577 0.577 weight 1.000 ! spec=NOESY_H2O, no=60, id=272, vol=4.928277e+06 or (segid " A" and resid 33 and name HB1) (segid " A" and resid 33 and name HA) or (segid " A" and resid 33 and name HB3) (segid " A" and resid 33 and name HA) assign (segid " A" and resid 38 and name HA) (segid " A" and resid 39 and name HN) 2.200 0.605 0.605 weight 1.000 ! spec=NOESY_H2O, no=63, id=274, vol=7.465456e+06 assign (segid " A" and resid 73 and name HN) (segid " A" and resid 72 and name HB2) 3.286 1.349 1.349 weight 1.000 ! spec=NOESY_H2O, no=71, id=281, vol=3.923965e+06 assign (segid " A" and resid 103 and name HZ3) (segid " A" and resid 103 and name HZ2) 3.563 1.587 1.587 weight 1.000 ! spec=NOESY_H2O, no=75, id=283, vol=2.242842e+06 assign (segid " A" and resid 103 and name HZ3) (segid " A" and resid 103 and name HH2) 2.273 0.646 0.646 weight 1.000 ! spec=NOESY_H2O, no=77, id=285, vol=7.520369e+06 assign (segid " A" and resid 103 and name HE3) (segid " A" and resid 103 and name HB1) 2.876 1.034 1.034 weight 1.000 ! spec=NOESY_H2O, no=80, id=287, vol=5.706733e+06 assign (segid " A" and resid 58 and name HD2) (segid " A" and resid 58 and name HA) 4.893 2.993 2.993 weight 1.000 ! spec=NOESY_H2O, no=85, id=290, vol=2.804031e+05 assign (segid " A" and resid 103 and name HZ3) (segid " A" and resid 103 and name HE3) 2.358 0.695 0.695 weight 1.000 ! spec=NOESY_H2O, no=86, id=291, vol=5.835518e+06 assign (segid " A" and resid 55 and name HD2) (segid " A" and resid 55 and name HB2) 2.912 1.060 1.060 weight 1.000 ! spec=NOESY_H2O, no=88, id=293, vol=1.393823e+06 assign (segid " A" and resid 55 and name HD2) (segid " A" and resid 55 and name HE1) 3.279 1.344 1.344 weight 1.000 ! spec=NOESY_H2O, no=89, id=294, vol=3.000621e+06 assign (segid " A" and resid 62 and name HD1) (segid " A" and resid 62 and name HB1) 3.079 1.185 1.185 weight 1.000 ! spec=NOESY_H2O, no=93, id=296, vol=2.917898e+06 or (segid " A" and resid 62 and name HD2) (segid " A" and resid 62 and name HB1) assign (segid " A" and resid 62 and name HD1) (segid " A" and resid 62 and name HB2) 3.398 1.443 1.443 weight 1.000 ! spec=NOESY_H2O, no=94, id=297, vol=1.656705e+06 or (segid " A" and resid 62 and name HD2) (segid " A" and resid 62 and name HB2) assign (segid " A" and resid 62 and name HE1) (segid " A" and resid 62 and name HD1) 2.835 1.005 1.005 weight 1.000 ! spec=NOESY_H2O, no=99, id=299, vol=1.123455e+07 or (segid " A" and resid 62 and name HE1) (segid " A" and resid 62 and name HD2) or (segid " A" and resid 62 and name HE2) (segid " A" and resid 62 and name HD1) or (segid " A" and resid 62 and name HE2) (segid " A" and resid 62 and name HD2) assign (segid " A" and resid 40 and name HD1) (segid " A" and resid 40 and name HB1) 3.206 1.285 1.285 weight 1.000 ! spec=NOESY_H2O, no=102, id=302, vol=2.599711e+06 or (segid " A" and resid 40 and name HD2) (segid " A" and resid 40 and name HB1) assign (segid " A" and resid 72 and name HZ2) (segid " A" and resid 72 and name HE1) 2.788 0.972 0.972 weight 1.000 ! spec=NOESY_H2O, no=103, id=303, vol=2.675492e+06 assign (segid " A" and resid 17 and name HD1) (segid " A" and resid 17 and name HZ) 4.039 2.039 2.039 weight 1.000 ! spec=NOESY_H2O, no=121, id=314, vol=9.474339e+05 or (segid " A" and resid 17 and name HD2) (segid " A" and resid 17 and name HZ) assign (segid " A" and resid 17 and name HE1) (segid " A" and resid 17 and name HD1) 2.914 1.061 1.061 weight 1.000 ! spec=NOESY_H2O, no=122, id=315, vol=8.938110e+06 or (segid " A" and resid 17 and name HE1) (segid " A" and resid 17 and name HD2) or (segid " A" and resid 17 and name HE2) (segid " A" and resid 17 and name HD1) or (segid " A" and resid 17 and name HE2) (segid " A" and resid 17 and name HD2) assign (segid " A" and resid 128 and name HE1) (segid " A" and resid 128 and name HZ) 2.959 1.095 1.095 weight 1.000 ! spec=NOESY_H2O, no=125, id=316, vol=3.456632e+06 or (segid " A" and resid 128 and name HE2) (segid " A" and resid 128 and name HZ) assign (segid " A" and resid 128 and name HD1) (segid " A" and resid 128 and name HE1) 3.125 1.221 1.221 weight 1.000 ! spec=NOESY_H2O, no=126, id=317, vol=5.792988e+06 or (segid " A" and resid 128 and name HD1) (segid " A" and resid 128 and name HE2) or (segid " A" and resid 128 and name HD2) (segid " A" and resid 128 and name HE1) or (segid " A" and resid 128 and name HD2) (segid " A" and resid 128 and name HE2) assign (segid " A" and resid 128 and name HD1) (segid " A" and resid 128 and name HA) 3.725 1.735 1.735 weight 1.000 ! spec=NOESY_H2O, no=128, id=319, vol=1.301490e+06 or (segid " A" and resid 128 and name HD2) (segid " A" and resid 128 and name HA) assign (segid " A" and resid 128 and name HD1) (segid " A" and resid 128 and name HB1) 3.255 1.324 1.324 weight 1.000 ! spec=NOESY_H2O, no=129, id=320, vol=2.304944e+06 or (segid " A" and resid 128 and name HD2) (segid " A" and resid 128 and name HB1) assign (segid " A" and resid 128 and name HD1) (segid " A" and resid 128 and name HB2) 2.890 1.044 1.044 weight 1.000 ! spec=NOESY_H2O, no=130, id=321, vol=4.620456e+06 or (segid " A" and resid 128 and name HD2) (segid " A" and resid 128 and name HB2) assign (segid " A" and resid 111 and name HE1) (segid " A" and resid 111 and name HZ) 2.551 0.813 0.813 weight 1.000 ! spec=NOESY_H2O, no=131, id=322, vol=8.153252e+06 or (segid " A" and resid 111 and name HE2) (segid " A" and resid 111 and name HZ) assign (segid " A" and resid 89 and name HD1) (segid " A" and resid 89 and name HZ) 3.350 1.403 1.403 weight 1.000 ! spec=NOESY_H2O, no=135, id=325, vol=2.603005e+06 or (segid " A" and resid 89 and name HD2) (segid " A" and resid 89 and name HZ) assign (segid " A" and resid 89 and name HZ) (segid " A" and resid 89 and name HE1) 2.583 0.834 0.834 weight 1.000 ! spec=NOESY_H2O, no=136, id=326, vol=7.305840e+06 or (segid " A" and resid 89 and name HZ) (segid " A" and resid 89 and name HE2) assign (segid " A" and resid 89 and name HD1) (segid " A" and resid 89 and name HA) 3.060 1.170 1.170 weight 1.000 ! spec=NOESY_H2O, no=137, id=327, vol=3.848240e+06 or (segid " A" and resid 89 and name HD2) (segid " A" and resid 89 and name HA) assign (segid " A" and resid 89 and name HE1) (segid " A" and resid 89 and name HB2) 3.642 1.658 1.658 weight 1.000 ! spec=NOESY_H2O, no=138, id=328, vol=1.626694e+06 or (segid " A" and resid 89 and name HE2) (segid " A" and resid 89 and name HB2) assign (segid " A" and resid 89 and name HD1) (segid " A" and resid 89 and name HB2) 3.055 1.167 1.167 weight 1.000 ! spec=NOESY_H2O, no=139, id=329, vol=3.278948e+06 or (segid " A" and resid 89 and name HD2) (segid " A" and resid 89 and name HB2) assign (segid " A" and resid 89 and name HE1) (segid " A" and resid 89 and name HB1) 3.585 1.606 1.606 weight 1.000 ! spec=NOESY_H2O, no=140, id=330, vol=1.796960e+06 or (segid " A" and resid 89 and name HE2) (segid " A" and resid 89 and name HB1) assign (segid " A" and resid 89 and name HD1) (segid " A" and resid 89 and name HB1) 2.984 1.113 1.113 weight 1.000 ! spec=NOESY_H2O, no=141, id=331, vol=3.634851e+06 or (segid " A" and resid 89 and name HD2) (segid " A" and resid 89 and name HB1) assign (segid " A" and resid 17 and name HD1) (segid " A" and resid 17 and name HB2) 3.473 1.508 1.508 weight 1.000 ! spec=NOESY_H2O, no=142, id=332, vol=1.512774e+06 or (segid " A" and resid 17 and name HD2) (segid " A" and resid 17 and name HB2) assign (segid " A" and resid 17 and name HD1) (segid " A" and resid 17 and name HB1) 3.235 1.308 1.308 weight 1.000 ! spec=NOESY_H2O, no=143, id=333, vol=2.175256e+06 or (segid " A" and resid 17 and name HD2) (segid " A" and resid 17 and name HB1) assign (segid " A" and resid 13 and name HZ) (segid " A" and resid 13 and name HE1) 2.699 0.911 0.911 weight 1.000 ! spec=NOESY_H2O, no=149, id=337, vol=6.031596e+06 or (segid " A" and resid 13 and name HZ) (segid " A" and resid 13 and name HE2) assign (segid " A" and resid 92 and name HD1) (segid " A" and resid 92 and name HA) 4.209 2.214 2.214 weight 1.000 ! spec=NOESY_H2O, no=156, id=341, vol=5.805592e+05 or (segid " A" and resid 92 and name HD2) (segid " A" and resid 92 and name HA) assign (segid " A" and resid 64 and name HE1) (segid " A" and resid 64 and name HD2) 4.511 2.544 2.544 weight 1.000 ! spec=NOESY_H2O, no=162, id=343, vol=4.578443e+05 assign (segid " A" and resid 30 and name HD21) (segid " A" and resid 30 and name HA) 4.159 2.162 2.162 weight 1.000 ! spec=NOESY_H2O, no=178, id=349, vol=4.316687e+05 assign (segid " A" and resid 30 and name HD21) (segid " A" and resid 30 and name HB2) 3.141 1.233 1.233 weight 1.000 ! spec=NOESY_H2O, no=179, id=350, vol=8.880252e+05 assign (segid " A" and resid 51 and name HN) (segid " A" and resid 68 and name HB1) 2.535 0.803 0.803 weight 1.000 ! spec=NOESY_H2O, no=208, id=364, vol=3.911183e+06 assign (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HB1) 3.449 1.487 1.487 weight 1.000 ! spec=NOESY_H2O, no=209, id=365, vol=2.494005e+06 assign (segid " A" and resid 73 and name HD22) (segid " A" and resid 73 and name HB1) 4.954 3.068 3.068 weight 1.000 ! spec=NOESY_H2O, no=227, id=370, vol=3.704147e+05 assign (segid " A" and resid 95 and name HN) (segid " A" and resid 95 and name HB2) 1.891 0.447 0.447 weight 1.000 ! spec=NOESY_H2O, no=246, id=375, vol=1.258525e+07 or (segid " A" and resid 95 and name HN) (segid " A" and resid 95 and name HB1) or (segid " A" and resid 95 and name HN) (segid " A" and resid 95 and name HB3) assign (segid " A" and resid 94 and name HN) (segid " A" and resid 94 and name HB2) 2.085 0.543 0.543 weight 1.000 ! spec=NOESY_H2O, no=247, id=376, vol=7.153188e+06 or (segid " A" and resid 94 and name HN) (segid " A" and resid 94 and name HB1) or (segid " A" and resid 94 and name HN) (segid " A" and resid 94 and name HB3) assign (segid " A" and resid 120 and name HN) (segid " A" and resid 120 and name HB2) 2.792 0.974 0.974 weight 1.000 ! spec=NOESY_H2O, no=248, id=377, vol=4.072969e+06 assign (segid " A" and resid 80 and name HA) (segid " A" and resid 80 and name HD12) 3.957 1.957 1.957 weight 1.000 ! spec=NOESY_H2O, no=265, id=379, vol=7.470222e+05 or (segid " A" and resid 80 and name HA) (segid " A" and resid 80 and name HD11) or (segid " A" and resid 80 and name HA) (segid " A" and resid 80 and name HD13) assign (segid " A" and resid 80 and name HD22) (segid " A" and resid 80 and name HA) 2.334 0.681 0.681 weight 1.000 ! spec=NOESY_H2O, no=266, id=380, vol=3.185098e+06 or (segid " A" and resid 80 and name HD21) (segid " A" and resid 80 and name HA) or (segid " A" and resid 80 and name HD23) (segid " A" and resid 80 and name HA) assign (segid " A" and resid 38 and name HN) (segid " A" and resid 37 and name HA) 2.240 0.627 0.627 weight 1.000 ! spec=NOESY_H2O, no=290, id=390, vol=4.988162e+06 assign (segid " A" and resid 9 and name HN) (segid " A" and resid 9 and name HG21) 3.010 1.133 1.133 weight 1.000 ! spec=NOESY_H2O, no=298, id=393, vol=5.584648e+06 or (segid " A" and resid 9 and name HN) (segid " A" and resid 9 and name HG22) or (segid " A" and resid 9 and name HN) (segid " A" and resid 9 and name HG23) assign (segid " A" and resid 50 and name HN) (segid " A" and resid 49 and name HA) 2.128 0.566 0.566 weight 1.000 ! spec=NOESY_H2O, no=383, id=401, vol=5.989606e+06 assign (segid " A" and resid 80 and name HD12) (segid " A" and resid 80 and name HB1) 2.504 0.784 0.784 weight 1.000 ! spec=NOESY_H2O, no=423, id=403, vol=2.816316e+06 or (segid " A" and resid 80 and name HD11) (segid " A" and resid 80 and name HB1) or (segid " A" and resid 80 and name HD13) (segid " A" and resid 80 and name HB1) assign (segid " A" and resid 80 and name HD12) (segid " A" and resid 80 and name HD22) 1.942 0.471 0.471 weight 1.000 ! spec=NOESY_H2O, no=426, id=406, vol=4.289136e+06 or (segid " A" and resid 80 and name HD12) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 80 and name HD12) (segid " A" and resid 80 and name HD23) or (segid " A" and resid 80 and name HD11) (segid " A" and resid 80 and name HD22) or (segid " A" and resid 80 and name HD11) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 80 and name HD11) (segid " A" and resid 80 and name HD23) or (segid " A" and resid 80 and name HD13) (segid " A" and resid 80 and name HD22) or (segid " A" and resid 80 and name HD13) (segid " A" and resid 80 and name HD21) or (segid " A" and resid 80 and name HD13) (segid " A" and resid 80 and name HD23) assign (segid " A" and resid 80 and name HD12) (segid " A" and resid 80 and name HB2) 2.626 0.862 0.862 weight 1.000 ! spec=NOESY_H2O, no=427, id=407, vol=2.243787e+06 or (segid " A" and resid 80 and name HD11) (segid " A" and resid 80 and name HB2) or (segid " A" and resid 80 and name HD13) (segid " A" and resid 80 and name HB2) assign (segid " A" and resid 80 and name HD12) (segid " A" and resid 80 and name HG) 2.193 0.601 0.601 weight 1.000 ! spec=NOESY_H2O, no=429, id=409, vol=2.903756e+06 or (segid " A" and resid 80 and name HD11) (segid " A" and resid 80 and name HG) or (segid " A" and resid 80 and name HD13) (segid " A" and resid 80 and name HG) assign (segid " A" and resid 68 and name HN) (segid " A" and resid 68 and name HD22) 3.768 1.775 1.775 weight 1.000 ! spec=NOESY_H2O, no=447, id=415, vol=1.484438e+06 or (segid " A" and resid 68 and name HN) (segid " A" and resid 68 and name HD21) or (segid " A" and resid 68 and name HN) (segid " A" and resid 68 and name HD23) assign (segid " A" and resid 68 and name HN) (segid " A" and resid 68 and name HA) 3.074 1.181 1.181 weight 1.000 ! spec=NOESY_H2O, no=452, id=419, vol=9.699420e+05 assign (segid " A" and resid 68 and name HN) (segid " A" and resid 68 and name HB2) 3.426 1.467 1.467 weight 1.000 ! spec=NOESY_H2O, no=453, id=420, vol=1.007615e+06 assign (segid " A" and resid 28 and name HN) (segid " A" and resid 27 and name HB2) 4.169 2.173 2.173 weight 1.000 ! spec=NOESY_H2O, no=454, id=421, vol=1.131652e+06 assign (segid " A" and resid 26 and name HN) (segid " A" and resid 25 and name HA) 3.563 1.587 1.587 weight 1.000 ! spec=NOESY_H2O, no=456, id=423, vol=6.921258e+05 assign (segid " A" and resid 77 and name HN) (segid " A" and resid 77 and name HG22) 4.359 2.375 2.375 weight 1.000 ! spec=NOESY_H2O, no=463, id=427, vol=4.934755e+05 or (segid " A" and resid 77 and name HN) (segid " A" and resid 77 and name HG21) or (segid " A" and resid 77 and name HN) (segid " A" and resid 77 and name HG23) assign (segid " A" and resid 38 and name HN) (segid " A" and resid 37 and name HB) 3.757 1.765 1.765 weight 1.000 ! spec=NOESY_H2O, no=468, id=432, vol=9.215591e+05 assign (segid " A" and resid 104 and name HN) (segid " A" and resid 104 and name HB1) 3.881 1.883 1.883 weight 1.000 ! spec=NOESY_H2O, no=470, id=433, vol=1.505394e+06 assign (segid " A" and resid 128 and name HD1) (segid " A" and resid 80 and name HG) 4.417 2.438 2.438 weight 1.000 ! spec=NOESY_H2O, no=492, id=436, vol=2.868649e+05 or (segid " A" and resid 128 and name HD2) (segid " A" and resid 80 and name HG) assign (segid " A" and resid 19 and name HA) (segid " A" and resid 19 and name HG2) 2.979 1.109 1.109 weight 1.000 ! spec=NOESY_H2O, no=497, id=438, vol=7.684441e+06 assign (segid " A" and resid 99 and name HB1) (segid " A" and resid 100 and name HN) 2.752 0.947 0.947 weight 1.000 ! spec=NOESY_H2O, no=499, id=439, vol=2.403436e+06 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 11 and name HA) 3.552 1.577 1.577 weight 1.000 ! spec=NOESY_H2O, no=501, id=440, vol=7.538561e+05 assign (segid " A" and resid 76 and name HN) (segid " A" and resid 73 and name HB2) 3.061 1.171 1.171 weight 1.000 ! spec=NOESY_H2O, no=504, id=442, vol=1.133040e+06 assign (segid " A" and resid 76 and name HN) (segid " A" and resid 73 and name HB1) 3.237 1.310 1.310 weight 1.000 ! spec=NOESY_H2O, no=505, id=443, vol=1.148663e+06 assign (segid " A" and resid 109 and name HG22) (segid " A" and resid 111 and name HN) 4.102 2.104 2.104 weight 1.000 ! spec=NOESY_H2O, no=507, id=444, vol=4.801968e+05 or (segid " A" and resid 109 and name HG21) (segid " A" and resid 111 and name HN) or (segid " A" and resid 109 and name HG23) (segid " A" and resid 111 and name HN) assign (segid " A" and resid 22 and name HN) (segid " A" and resid 37 and name HG12) 3.328 1.384 2.672 weight 1.000 ! spec=NOESY_H2O, no=508, id=445, vol=7.053643e+05 or (segid " A" and resid 22 and name HN) (segid " A" and resid 37 and name HG11) or (segid " A" and resid 22 and name HN) (segid " A" and resid 37 and name HG13)
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