NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
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593170 |
2mpj   |
19986 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
assign (segid " C" and resid 8 and name HE1) (segid " C" and resid 17 and name HB2) 2.487 0.773 0.773 weight 1.000 ! spec=200m..._H2O, no=5, id=2, vol=3.369574e+05
or (segid " C" and resid 8 and name HE1) (segid " C" and resid 17 and name HB1)
or (segid " C" and resid 8 and name HE1) (segid " C" and resid 17 and name HB3)
or (segid " C" and resid 8 and name HE2) (segid " C" and resid 17 and name HB2)
or (segid " C" and resid 8 and name HE2) (segid " C" and resid 17 and name HB1)
or (segid " C" and resid 8 and name HE2) (segid " C" and resid 17 and name HB3)
or (segid " C" and resid 8 and name HE1) (segid " C" and resid 9 and name HG2)
or (segid " C" and resid 8 and name HE2) (segid " C" and resid 9 and name HG2)
assign (segid " C" and resid 19 and name HE22) (segid " C" and resid 19 and name HG2) 4.152 2.155 2.155 weight 1.000 ! spec=200m..._H2O, no=11, id=4, vol=1.447412e+05
or (segid " C" and resid 19 and name HE22) (segid " C" and resid 19 and name HG1)
assign (segid " C" and resid 9 and name HE) (segid " C" and resid 9 and name HD1) 2.939 1.079 1.079 weight 1.000 ! spec=200m..._H2O, no=31, id=15, vol=3.481890e+05
or (segid " C" and resid 9 and name HE) (segid " C" and resid 9 and name HD2)
assign (segid " C" and resid 2 and name HE) (segid " C" and resid 2 and name HD2) 3.491 1.523 1.523 weight 1.000 ! spec=200m..._H2O, no=35, id=19, vol=1.181044e+05
or (segid " C" and resid 2 and name HE) (segid " C" and resid 2 and name HD1)
assign (segid " C" and resid 15 and name HN) (segid " C" and resid 15 and name HB1) 3.046 1.160 1.160 weight 1.000 ! spec=200m..._H2O, no=36, id=20, vol=3.374752e+05
or (segid " C" and resid 15 and name HN) (segid " C" and resid 15 and name HB2)
assign (segid " C" and resid 19 and name HN) (segid " C" and resid 18 and name HA) 3.034 1.151 1.151 weight 1.000 ! spec=200m..._H2O, no=91, id=47, vol=3.106185e+05
or (segid " C" and resid 18 and name HN) (segid " C" and resid 18 and name HA)
assign (segid " C" and resid 23 and name HN) (segid " C" and resid 23 and name HB1) 2.609 0.851 0.851 weight 1.000 ! spec=200m..._H2O, no=129, id=70, vol=6.768380e+05
or (segid " C" and resid 23 and name HN) (segid " C" and resid 23 and name HB2)
assign (segid " C" and resid 3 and name HN) (segid " C" and resid 3 and name HB1) 3.175 1.260 1.260 weight 1.000 ! spec=200m..._H2O, no=134, id=73, vol=3.152734e+05
or (segid " C" and resid 3 and name HN) (segid " C" and resid 3 and name HB2)
assign (segid " C" and resid 19 and name HN) (segid " C" and resid 18 and name HB2) 2.752 0.946 0.946 weight 1.000 ! spec=200m..._H2O, no=138, id=76, vol=6.142268e+05
or (segid " C" and resid 18 and name HN) (segid " C" and resid 18 and name HB2)
or (segid " C" and resid 18 and name HN) (segid " C" and resid 18 and name HB1)
assign (segid " C" and resid 19 and name HN) (segid " C" and resid 16 and name HB1) 3.201 1.281 1.281 weight 1.000 ! spec=200m..._H2O, no=157, id=89, vol=2.148494e+05
or (segid " C" and resid 18 and name HN) (segid " C" and resid 16 and name HB1)
assign (segid " C" and resid 5 and name HN) (segid " C" and resid 5 and name HB1) 2.696 0.908 0.908 weight 1.000 ! spec=200m..._H2O, no=169, id=97, vol=7.258668e+05
or (segid " C" and resid 5 and name HN) (segid " C" and resid 5 and name HB2)
assign (segid " C" and resid 6 and name HN) (segid " C" and resid 5 and name HB1) 3.513 1.543 1.543 weight 1.000 ! spec=200m..._H2O, no=170, id=98, vol=2.718342e+05
or (segid " C" and resid 6 and name HN) (segid " C" and resid 5 and name HB2)
assign (segid " C" and resid 19 and name HN) (segid " C" and resid 19 and name HG2) 2.866 1.027 1.027 weight 1.000 ! spec=200m..._H2O, no=173, id=99, vol=3.468010e+05
or (segid " C" and resid 19 and name HN) (segid " C" and resid 19 and name HG1)
assign (segid " C" and resid 16 and name HN) (segid " C" and resid 19 and name HB2) 3.156 1.245 1.245 weight 1.000 ! spec=200m..._H2O, no=180, id=105, vol=2.833896e+05
or (segid " C" and resid 16 and name HN) (segid " C" and resid 19 and name HB1)
assign (segid " C" and resid 19 and name HN) (segid " C" and resid 19 and name HB1) 2.570 0.826 0.826 weight 1.000 ! spec=200m..._H2O, no=181, id=106, vol=5.314189e+05
or (segid " C" and resid 19 and name HN) (segid " C" and resid 19 and name HB2)
assign (segid " C" and resid 9 and name HN) (segid " C" and resid 8 and name HN) 2.328 0.677 0.677 weight 1.000 ! spec=200m..._H2O, no=272, id=143, vol=1.233687e+06
or (segid " C" and resid 9 and name HN) (segid " C" and resid 10 and name HN)
assign (segid " C" and resid 9 and name HN) (segid " C" and resid 9 and name HD1) 4.137 2.140 2.140 weight 1.000 ! spec=200m..._H2O, no=425, id=183, vol=1.321925e+05
or (segid " C" and resid 9 and name HN) (segid " C" and resid 9 and name HD2)
assign (segid " C" and resid 2 and name HD2) (segid " C" and resid 2 and name HG2) 2.786 0.970 0.970 weight 1.000 ! spec=200m..._H2O, no=468, id=196, vol=4.188906e+05
or (segid " C" and resid 2 and name HD1) (segid " C" and resid 2 and name HG2)
or (segid " C" and resid 2 and name HD1) (segid " C" and resid 2 and name HG1)
assign (segid " C" and resid 16 and name HN) (segid " C" and resid 19 and name HG2) 3.877 1.879 1.879 weight 1.000 ! spec=200m..._H2O, no=509, id=204, vol=1.075058e+05
or (segid " C" and resid 16 and name HN) (segid " C" and resid 19 and name HG1)
assign (segid " C" and resid 17 and name HB2) (segid " C" and resid 9 and name HN) 2.881 1.037 1.037 weight 1.000 ! spec=200m..._H2O, no=542, id=211, vol=3.562029e+05
or (segid " C" and resid 17 and name HB1) (segid " C" and resid 9 and name HN)
or (segid " C" and resid 17 and name HB3) (segid " C" and resid 9 and name HN)
or (segid " C" and resid 9 and name HG2) (segid " C" and resid 9 and name HN)
assign (segid " C" and resid 15 and name HD2) (segid " C" and resid 19 and name HB2) 2.672 0.892 0.892 weight 1.000 ! spec=200m..._H2O, no=581, id=219, vol=6.411059e+05
or (segid " C" and resid 15 and name HD2) (segid " C" and resid 19 and name HB1)
assign (segid " C" and resid 15 and name HB1) (segid " C" and resid 19 and name HB1) 2.607 0.850 0.850 weight 1.000 ! spec=200m..._H2O, no=589, id=221, vol=7.103809e+05
or (segid " C" and resid 15 and name HB1) (segid " C" and resid 19 and name HB2)
assign (segid " C" and resid 9 and name HE) (segid " C" and resid 9 and name HG2) 3.429 1.470 1.470 weight 1.000 ! spec=200m..._H2O, no=7, id=3, vol=1.659501e+05
assign (segid " C" and resid 15 and name HE1) (segid " C" and resid 7 and name HB1) 3.606 1.626 1.626 weight 1.000 ! spec=200m..._H2O, no=12, id=5, vol=1.160496e+05
assign (segid " C" and resid 16 and name HE3) (segid " C" and resid 16 and name HB2) 3.134 1.227 1.227 weight 1.000 ! spec=200m..._H2O, no=19, id=6, vol=2.216950e+05
assign (segid " C" and resid 16 and name HD1) (segid " C" and resid 16 and name HB2) 3.865 1.867 1.867 weight 1.000 ! spec=200m..._H2O, no=20, id=7, vol=2.091395e+05
assign (segid " C" and resid 15 and name HE1) (segid " C" and resid 21 and name HD2) 3.119 1.216 1.216 weight 1.000 ! spec=200m..._H2O, no=21, id=8, vol=2.802524e+05
assign (segid " C" and resid 8 and name HE1) (segid " C" and resid 8 and name HB1) 3.376 1.425 1.425 weight 1.000 ! spec=200m..._H2O, no=23, id=9, vol=1.431505e+05
or (segid " C" and resid 8 and name HE2) (segid " C" and resid 8 and name HB1)
assign (segid " C" and resid 8 and name HD1) (segid " C" and resid 8 and name HB1) 2.626 0.862 0.862 weight 1.000 ! spec=200m..._H2O, no=24, id=10, vol=5.792860e+05
or (segid " C" and resid 8 and name HD2) (segid " C" and resid 8 and name HB1)
assign (segid " C" and resid 20 and name HN) (segid " C" and resid 20 and name HB2) 2.999 1.124 1.124 weight 1.000 ! spec=200m..._H2O, no=25, id=11, vol=1.055232e+06
assign (segid " C" and resid 15 and name HD2) (segid " C" and resid 20 and name HB2) 3.224 1.299 2.776 weight 1.000 ! spec=200m..._H2O, no=27, id=12, vol=6.587669e+05
assign (segid " C" and resid 8 and name HE1) (segid " C" and resid 8 and name HB2) 3.207 1.286 1.286 weight 1.000 ! spec=200m..._H2O, no=29, id=13, vol=1.936186e+05
or (segid " C" and resid 8 and name HE2) (segid " C" and resid 8 and name HB2)
assign (segid " C" and resid 8 and name HD1) (segid " C" and resid 8 and name HB2) 2.527 0.798 0.798 weight 1.000 ! spec=200m..._H2O, no=30, id=14, vol=7.104955e+05
or (segid " C" and resid 8 and name HD2) (segid " C" and resid 8 and name HB2)
assign (segid " C" and resid 16 and name HE3) (segid " C" and resid 16 and name HB1) 4.071 2.072 2.072 weight 1.000 ! spec=200m..._H2O, no=32, id=16, vol=2.192098e+05
assign (segid " C" and resid 16 and name HD1) (segid " C" and resid 16 and name HB1) 2.879 1.036 1.036 weight 1.000 ! spec=200m..._H2O, no=33, id=17, vol=3.664960e+05
assign (segid " C" and resid 15 and name HE1) (segid " C" and resid 21 and name HD1) 3.264 1.332 1.332 weight 1.000 ! spec=200m..._H2O, no=34, id=18, vol=2.152172e+05
assign (segid " C" and resid 15 and name HD2) (segid " C" and resid 15 and name HB1) 2.436 0.742 0.742 weight 1.000 ! spec=200m..._H2O, no=37, id=21, vol=1.098825e+06
assign (segid " C" and resid 20 and name HN) (segid " C" and resid 20 and name HB1) 2.479 0.768 0.768 weight 1.000 ! spec=200m..._H2O, no=38, id=22, vol=8.752114e+05
assign (segid " C" and resid 15 and name HE1) (segid " C" and resid 7 and name HB2) 3.903 1.904 1.904 weight 1.000 ! spec=200m..._H2O, no=40, id=23, vol=8.808938e+04
assign (segid " C" and resid 10 and name HN) (segid " C" and resid 10 and name HA) 3.013 1.135 1.135 weight 1.000 ! spec=200m..._H2O, no=42, id=24, vol=3.377661e+05
assign (segid " C" and resid 16 and name HN) (segid " C" and resid 16 and name HA) 2.941 1.081 1.081 weight 1.000 ! spec=200m..._H2O, no=43, id=25, vol=3.649620e+05
assign (segid " C" and resid 11 and name HN) (segid " C" and resid 10 and name HA) 3.277 1.342 1.342 weight 1.000 ! spec=200m..._H2O, no=44, id=26, vol=2.236625e+05
assign (segid " C" and resid 16 and name HE3) (segid " C" and resid 16 and name HA) 3.146 1.237 1.237 weight 1.000 ! spec=200m..._H2O, no=45, id=27, vol=2.962449e+05
assign (segid " C" and resid 17 and name HN) (segid " C" and resid 16 and name HA) 2.398 0.719 0.719 weight 1.000 ! spec=200m..._H2O, no=47, id=28, vol=1.255570e+06
assign (segid " C" and resid 16 and name HD1) (segid " C" and resid 16 and name HA) 3.129 1.224 1.224 weight 1.000 ! spec=200m..._H2O, no=48, id=29, vol=3.997911e+05
assign (segid " C" and resid 17 and name HN) (segid " C" and resid 17 and name HA) 2.684 0.901 0.901 weight 1.000 ! spec=200m..._H2O, no=49, id=30, vol=6.215878e+05
assign (segid " C" and resid 18 and name HN) (segid " C" and resid 17 and name HA) 3.575 1.598 1.598 weight 1.000 ! spec=200m..._H2O, no=50, id=31, vol=1.054221e+05
assign (segid " C" and resid 16 and name HN) (segid " C" and resid 15 and name HA) 2.392 0.715 0.715 weight 1.000 ! spec=200m..._H2O, no=71, id=32, vol=1.308658e+06
assign (segid " C" and resid 15 and name HN) (segid " C" and resid 15 and name HA) 2.763 0.955 0.955 weight 1.000 ! spec=200m..._H2O, no=72, id=33, vol=4.477360e+05
assign (segid " C" and resid 15 and name HD2) (segid " C" and resid 15 and name HA) 4.255 2.263 2.263 weight 1.000 ! spec=200m..._H2O, no=76, id=34, vol=1.313284e+05
assign (segid " C" and resid 9 and name HN) (segid " C" and resid 8 and name HA) 3.483 1.516 1.516 weight 1.000 ! spec=200m..._H2O, no=77, id=35, vol=1.432914e+05
assign (segid " C" and resid 8 and name HN) (segid " C" and resid 8 and name HA) 2.812 0.989 0.989 weight 1.000 ! spec=200m..._H2O, no=78, id=36, vol=5.030598e+05
assign (segid " C" and resid 11 and name HN) (segid " C" and resid 8 and name HA) 3.411 1.454 1.454 weight 1.000 ! spec=200m..._H2O, no=79, id=37, vol=1.632450e+05
assign (segid " C" and resid 5 and name HN) (segid " C" and resid 5 and name HA) 3.058 1.169 1.169 weight 1.000 ! spec=200m..._H2O, no=81, id=38, vol=3.344268e+05
assign (segid " C" and resid 6 and name HN) (segid " C" and resid 5 and name HA) 2.411 0.726 0.726 weight 1.000 ! spec=200m..._H2O, no=82, id=39, vol=1.192661e+06
assign (segid " C" and resid 8 and name HD1) (segid " C" and resid 8 and name HA) 3.355 1.407 1.407 weight 1.000 ! spec=200m..._H2O, no=83, id=40, vol=2.441184e+05
or (segid " C" and resid 8 and name HD2) (segid " C" and resid 8 and name HA)
assign (segid " C" and resid 19 and name HN) (segid " C" and resid 19 and name HA) 2.877 1.035 1.035 weight 1.000 ! spec=200m..._H2O, no=84, id=41, vol=3.125694e+05
assign (segid " C" and resid 20 and name HN) (segid " C" and resid 19 and name HA) 2.946 1.085 1.085 weight 1.000 ! spec=200m..._H2O, no=85, id=42, vol=3.917754e+05
assign (segid " C" and resid 7 and name HN) (segid " C" and resid 6 and name HA) 2.168 0.587 0.587 weight 1.000 ! spec=200m..._H2O, no=86, id=43, vol=2.037107e+06
assign (segid " C" and resid 6 and name HN) (segid " C" and resid 6 and name HA) 3.061 1.171 1.171 weight 1.000 ! spec=200m..._H2O, no=87, id=44, vol=2.765515e+05
assign (segid " C" and resid 23 and name HN) (segid " C" and resid 21 and name HA) 3.742 1.750 1.750 weight 1.000 ! spec=200m..._H2O, no=88, id=45, vol=4.594410e+05
assign (segid " C" and resid 24 and name HN) (segid " C" and resid 24 and name HA) 2.742 0.940 0.940 weight 1.000 ! spec=200m..._H2O, no=90, id=46, vol=5.712242e+05
assign (segid " C" and resid 3 and name HN) (segid " C" and resid 2 and name HA) 2.668 0.890 0.890 weight 1.000 ! spec=200m..._H2O, no=95, id=48, vol=6.243046e+05
assign (segid " C" and resid 4 and name HN) (segid " C" and resid 3 and name HA) 2.781 0.967 0.967 weight 1.000 ! spec=200m..._H2O, no=96, id=49, vol=5.310541e+05
assign (segid " C" and resid 17 and name HN) (segid " C" and resid 7 and name HA) 3.212 1.289 1.289 weight 1.000 ! spec=200m..._H2O, no=100, id=50, vol=2.285595e+05
assign (segid " C" and resid 7 and name HN) (segid " C" and resid 7 and name HA) 2.791 0.974 0.974 weight 1.000 ! spec=200m..._H2O, no=101, id=51, vol=5.124120e+05
assign (segid " C" and resid 8 and name HN) (segid " C" and resid 7 and name HA) 2.172 0.590 0.590 weight 1.000 ! spec=200m..._H2O, no=102, id=52, vol=2.057127e+06
assign (segid " C" and resid 9 and name HN) (segid " C" and resid 9 and name HA) 2.922 1.067 1.067 weight 1.000 ! spec=200m..._H2O, no=107, id=53, vol=3.527244e+05
assign (segid " C" and resid 14 and name HN) (segid " C" and resid 14 and name HA1) 2.717 0.923 0.923 weight 1.000 ! spec=200m..._H2O, no=109, id=54, vol=5.341215e+05
assign (segid " C" and resid 11 and name HN) (segid " C" and resid 11 and name HA2) 2.885 1.041 1.041 weight 1.000 ! spec=200m..._H2O, no=110, id=55, vol=6.872396e+05
assign (segid " C" and resid 8 and name HD1) (segid " C" and resid 9 and name HA) 3.237 1.309 1.309 weight 1.000 ! spec=200m..._H2O, no=111, id=56, vol=1.857674e+05
or (segid " C" and resid 8 and name HD2) (segid " C" and resid 9 and name HA)
assign (segid " C" and resid 15 and name HN) (segid " C" and resid 14 and name HA1) 3.463 1.499 1.499 weight 1.000 ! spec=200m..._H2O, no=112, id=57, vol=2.137452e+05
assign (segid " C" and resid 12 and name HN) (segid " C" and resid 12 and name HA1) 2.863 1.025 1.025 weight 1.000 ! spec=200m..._H2O, no=113, id=58, vol=7.070821e+05
assign (segid " C" and resid 13 and name HN) (segid " C" and resid 12 and name HA1) 2.464 0.759 0.759 weight 1.000 ! spec=200m..._H2O, no=114, id=59, vol=1.165723e+06
assign (segid " C" and resid 15 and name HE1) (segid " C" and resid 12 and name HA1) 4.891 2.991 2.991 weight 1.000 ! spec=200m..._H2O, no=115, id=60, vol=7.627675e+04
assign (segid " C" and resid 15 and name HE1) (segid " C" and resid 20 and name HA) 3.763 1.770 1.770 weight 1.000 ! spec=200m..._H2O, no=117, id=61, vol=1.036739e+05
assign (segid " C" and resid 20 and name HN) (segid " C" and resid 20 and name HA) 2.856 1.020 1.020 weight 1.000 ! spec=200m..._H2O, no=118, id=62, vol=4.286900e+05
assign (segid " C" and resid 15 and name HD2) (segid " C" and resid 20 and name HA) 2.274 0.646 0.646 weight 1.000 ! spec=200m..._H2O, no=119, id=63, vol=1.597372e+06
assign (segid " C" and resid 4 and name HN) (segid " C" and resid 4 and name HA1) 3.082 1.187 1.187 weight 1.000 ! spec=200m..._H2O, no=120, id=64, vol=3.711818e+05
assign (segid " C" and resid 5 and name HN) (segid " C" and resid 4 and name HA1) 2.809 0.986 0.986 weight 1.000 ! spec=200m..._H2O, no=121, id=65, vol=4.667845e+05
assign (segid " C" and resid 23 and name HN) (segid " C" and resid 23 and name HA) 2.549 0.812 0.812 weight 1.000 ! spec=200m..._H2O, no=123, id=66, vol=8.270518e+05
assign (segid " C" and resid 22 and name HN) (segid " C" and resid 22 and name HA1) 2.567 0.824 0.824 weight 1.000 ! spec=200m..._H2O, no=125, id=67, vol=6.867549e+05
assign (segid " C" and resid 4 and name HN) (segid " C" and resid 4 and name HA2) 2.675 0.895 0.895 weight 1.000 ! spec=200m..._H2O, no=127, id=68, vol=5.317275e+05
assign (segid " C" and resid 5 and name HN) (segid " C" and resid 4 and name HA2) 3.335 1.390 1.390 weight 1.000 ! spec=200m..._H2O, no=128, id=69, vol=3.913948e+05
assign (segid " C" and resid 12 and name HN) (segid " C" and resid 11 and name HA1) 3.314 1.373 1.373 weight 1.000 ! spec=200m..._H2O, no=130, id=71, vol=2.139159e+05
assign (segid " C" and resid 7 and name HN) (segid " C" and resid 6 and name HB) 2.815 0.990 0.990 weight 1.000 ! spec=200m..._H2O, no=131, id=72, vol=4.903454e+05
assign (segid " C" and resid 11 and name HN) (segid " C" and resid 11 and name HA1) 2.273 0.646 0.646 weight 1.000 ! spec=200m..._H2O, no=135, id=74, vol=1.422397e+06
assign (segid " C" and resid 6 and name HN) (segid " C" and resid 6 and name HB) 3.264 1.332 1.332 weight 1.000 ! spec=200m..._H2O, no=136, id=75, vol=3.893720e+05
assign (segid " C" and resid 14 and name HN) (segid " C" and resid 14 and name HA2) 2.780 0.966 0.966 weight 1.000 ! spec=200m..._H2O, no=140, id=77, vol=7.193730e+05
assign (segid " C" and resid 15 and name HN) (segid " C" and resid 14 and name HA2) 2.903 1.054 1.054 weight 1.000 ! spec=200m..._H2O, no=141, id=78, vol=3.066192e+05
assign (segid " C" and resid 12 and name HN) (segid " C" and resid 12 and name HA2) 2.386 0.712 0.712 weight 1.000 ! spec=200m..._H2O, no=142, id=79, vol=1.097840e+06
assign (segid " C" and resid 13 and name HN) (segid " C" and resid 12 and name HA2) 2.587 0.836 0.836 weight 1.000 ! spec=200m..._H2O, no=143, id=80, vol=8.408054e+05
assign (segid " C" and resid 15 and name HE1) (segid " C" and resid 12 and name HA2) 2.904 1.054 1.054 weight 1.000 ! spec=200m..._H2O, no=144, id=81, vol=3.653392e+05
assign (segid " C" and resid 17 and name HN) (segid " C" and resid 16 and name HB2) 2.709 0.917 0.917 weight 1.000 ! spec=200m..._H2O, no=145, id=82, vol=4.972822e+05
assign (segid " C" and resid 16 and name HN) (segid " C" and resid 16 and name HB2) 3.543 1.569 1.569 weight 1.000 ! spec=200m..._H2O, no=146, id=83, vol=2.830054e+05
assign (segid " C" and resid 8 and name HN) (segid " C" and resid 8 and name HB1) 3.079 1.185 1.185 weight 1.000 ! spec=200m..._H2O, no=149, id=84, vol=4.733785e+05
assign (segid " C" and resid 8 and name HN) (segid " C" and resid 8 and name HB2) 2.608 0.850 0.850 weight 1.000 ! spec=200m..._H2O, no=154, id=86, vol=6.581902e+05
assign (segid " C" and resid 17 and name HN) (segid " C" and resid 16 and name HB1) 3.661 1.676 1.676 weight 1.000 ! spec=200m..._H2O, no=155, id=87, vol=3.078325e+05
assign (segid " C" and resid 22 and name HN) (segid " C" and resid 21 and name HD1) 3.346 1.399 2.654 weight 1.000 ! spec=200m..._H2O, no=156, id=88, vol=2.838496e+05
assign (segid " C" and resid 19 and name HN) (segid " C" and resid 20 and name HB1) 4.054 2.055 2.055 weight 1.000 ! spec=200m..._H2O, no=161, id=90, vol=1.248832e+05
assign (segid " C" and resid 12 and name HN) (segid " C" and resid 7 and name HB2) 2.714 0.921 0.921 weight 1.000 ! spec=200m..._H2O, no=162, id=91, vol=4.946374e+05
assign (segid " C" and resid 7 and name HN) (segid " C" and resid 7 and name HB2) 2.686 0.902 0.902 weight 1.000 ! spec=200m..._H2O, no=164, id=92, vol=1.309612e+06
assign (segid " C" and resid 10 and name HN) (segid " C" and resid 7 and name HB2) 3.051 1.163 1.163 weight 1.000 ! spec=200m..._H2O, no=165, id=93, vol=2.380899e+05
assign (segid " C" and resid 11 and name HN) (segid " C" and resid 7 and name HB2) 3.091 1.195 1.195 weight 1.000 ! spec=200m..._H2O, no=166, id=94, vol=2.620090e+05
assign (segid " C" and resid 10 and name HN) (segid " C" and resid 10 and name HB2) 2.858 1.021 1.021 weight 1.000 ! spec=200m..._H2O, no=167, id=95, vol=3.489156e+05
assign (segid " C" and resid 13 and name HN) (segid " C" and resid 13 and name HG2) 3.048 1.161 1.161 weight 1.000 ! spec=200m..._H2O, no=168, id=96, vol=2.819029e+05
assign (segid " C" and resid 24 and name HN) (segid " C" and resid 24 and name HB) 3.275 1.340 1.340 weight 1.000 ! spec=200m..._H2O, no=174, id=100, vol=1.854206e+05
assign (segid " C" and resid 12 and name HN) (segid " C" and resid 7 and name HB1) 4.007 2.007 2.007 weight 1.000 ! spec=200m..._H2O, no=175, id=101, vol=1.404904e+05
assign (segid " C" and resid 7 and name HN) (segid " C" and resid 7 and name HB1) 2.433 0.740 0.740 weight 1.000 ! spec=200m..._H2O, no=176, id=102, vol=8.926169e+05
assign (segid " C" and resid 14 and name HN) (segid " C" and resid 13 and name HB2) 2.942 1.082 1.082 weight 1.000 ! spec=200m..._H2O, no=177, id=103, vol=3.802736e+05
assign (segid " C" and resid 13 and name HN) (segid " C" and resid 13 and name HB2) 3.469 1.504 1.504 weight 1.000 ! spec=200m..._H2O, no=179, id=104, vol=3.513195e+05
assign (segid " C" and resid 9 and name HN) (segid " C" and resid 9 and name HB2) 3.354 1.406 1.406 weight 1.000 ! spec=200m..._H2O, no=182, id=107, vol=3.948669e+05
assign (segid " C" and resid 10 and name HN) (segid " C" and resid 9 and name HB2) 3.263 1.331 1.331 weight 1.000 ! spec=200m..._H2O, no=183, id=108, vol=3.464796e+05
assign (segid " C" and resid 14 and name HN) (segid " C" and resid 13 and name HB1) 4.150 2.153 2.153 weight 1.000 ! spec=200m..._H2O, no=185, id=109, vol=1.444664e+05
assign (segid " C" and resid 13 and name HN) (segid " C" and resid 13 and name HB1) 2.579 0.832 0.832 weight 1.000 ! spec=200m..._H2O, no=186, id=110, vol=7.224682e+05
assign (segid " C" and resid 10 and name HN) (segid " C" and resid 9 and name HB1) 2.788 0.972 0.972 weight 1.000 ! spec=200m..._H2O, no=188, id=111, vol=3.756198e+05
assign (segid " C" and resid 9 and name HN) (segid " C" and resid 9 and name HB1) 2.521 0.794 0.794 weight 1.000 ! spec=200m..._H2O, no=189, id=112, vol=6.251876e+05
assign (segid " C" and resid 3 and name HN) (segid " C" and resid 2 and name HB2) 4.416 2.438 2.438 weight 1.000 ! spec=200m..._H2O, no=191, id=113, vol=8.833000e+04
assign (segid " C" and resid 17 and name HN) (segid " C" and resid 17 and name HB2) 2.115 0.559 0.559 weight 1.000 ! spec=200m..._H2O, no=192, id=114, vol=1.051527e+06
or (segid " C" and resid 17 and name HN) (segid " C" and resid 17 and name HB1)
or (segid " C" and resid 17 and name HN) (segid " C" and resid 17 and name HB3)
assign (segid " C" and resid 15 and name HD1) (segid " C" and resid 15 and name HB2) 3.110 1.209 1.209 weight 1.000 ! spec=200m..._H2O, no=195, id=115, vol=2.710168e+05
assign (segid " C" and resid 16 and name HE1) (segid " C" and resid 16 and name HD1) 2.442 0.745 0.745 weight 1.000 ! spec=200m..._H2O, no=202, id=119, vol=1.359340e+06
assign (segid " C" and resid 16 and name HE1) (segid " C" and resid 16 and name HZ2) 3.134 1.228 1.228 weight 1.000 ! spec=200m..._H2O, no=203, id=120, vol=3.149920e+05
assign (segid " C" and resid 15 and name HD1) (segid " C" and resid 15 and name HE1) 2.948 1.086 1.086 weight 1.000 ! spec=200m..._H2O, no=209, id=121, vol=3.103015e+05
assign (segid " C" and resid 8 and name HD1) (segid " C" and resid 8 and name HN) 2.819 0.993 0.993 weight 1.000 ! spec=200m..._H2O, no=211, id=123, vol=3.334584e+05
or (segid " C" and resid 8 and name HD2) (segid " C" and resid 8 and name HN)
assign (segid " C" and resid 7 and name HN) (segid " C" and resid 12 and name HN) 3.951 1.951 1.951 weight 1.000 ! spec=200m..._H2O, no=215, id=125, vol=1.117408e+05
assign (segid " C" and resid 7 and name HN) (segid " C" and resid 6 and name HN) 4.206 2.211 2.211 weight 1.000 ! spec=200m..._H2O, no=221, id=126, vol=8.743688e+04
assign (segid " C" and resid 16 and name HD1) (segid " C" and resid 16 and name HN) 3.587 1.608 1.608 weight 1.000 ! spec=200m..._H2O, no=244, id=130, vol=1.268189e+05
assign (segid " C" and resid 15 and name HD2) (segid " C" and resid 16 and name HN) 3.607 1.626 1.626 weight 1.000 ! spec=200m..._H2O, no=245, id=131, vol=1.949618e+05
assign (segid " C" and resid 17 and name HB2) (segid " C" and resid 16 and name HA) 3.771 1.778 1.778 weight 1.000 ! spec=200m..._H2O, no=246, id=132, vol=1.255576e+05
or (segid " C" and resid 17 and name HB1) (segid " C" and resid 16 and name HA)
or (segid " C" and resid 17 and name HB3) (segid " C" and resid 16 and name HA)
assign (segid " C" and resid 14 and name HN) (segid " C" and resid 15 and name HN) 2.557 0.817 0.817 weight 1.000 ! spec=200m..._H2O, no=251, id=136, vol=6.351476e+05
assign (segid " C" and resid 14 and name HN) (segid " C" and resid 6 and name HA) 3.067 1.176 1.176 weight 1.000 ! spec=200m..._H2O, no=257, id=138, vol=3.096146e+05
assign (segid " C" and resid 13 and name HN) (segid " C" and resid 13 and name HG1) 3.584 1.605 1.605 weight 1.000 ! spec=200m..._H2O, no=260, id=139, vol=2.332371e+05
assign (segid " C" and resid 15 and name HE1) (segid " C" and resid 12 and name HN) 3.886 1.888 1.888 weight 1.000 ! spec=200m..._H2O, no=264, id=141, vol=9.427862e+04
assign (segid " C" and resid 9 and name HN) (segid " C" and resid 11 and name HN) 3.164 1.251 1.251 weight 1.000 ! spec=200m..._H2O, no=271, id=142, vol=3.002838e+05
assign (segid " C" and resid 20 and name HN) (segid " C" and resid 19 and name HN) 2.417 0.730 0.730 weight 1.000 ! spec=200m..._H2O, no=275, id=145, vol=1.114974e+06
assign (segid " C" and resid 19 and name HE22) (segid " C" and resid 19 and name HE21) 1.565 0.306 0.306 weight 1.000 ! spec=200m..._H2O, no=279, id=147, vol=9.029296e+06
assign (segid " C" and resid 5 and name HN) (segid " C" and resid 4 and name HN) 3.009 1.131 1.131 weight 1.000 ! spec=200m..._H2O, no=294, id=150, vol=3.194376e+05
assign (segid " C" and resid 3 and name HN) (segid " C" and resid 3 and name HA) 2.980 1.110 1.110 weight 1.000 ! spec=200m..._H2O, no=301, id=151, vol=3.806781e+05
assign (segid " C" and resid 22 and name HN) (segid " C" and resid 22 and name HA2) 2.994 1.120 1.120 weight 1.000 ! spec=200m..._H2O, no=306, id=152, vol=3.769470e+05
assign (segid " C" and resid 9 and name HA) (segid " C" and resid 8 and name HN) 3.664 1.678 1.678 weight 1.000 ! spec=200m..._H2O, no=329, id=160, vol=2.152209e+05
assign (segid " C" and resid 7 and name HB1) (segid " C" and resid 10 and name HN) 4.266 2.275 2.275 weight 1.000 ! spec=200m..._H2O, no=337, id=161, vol=1.613755e+05
assign (segid " C" and resid 15 and name HB1) (segid " C" and resid 19 and name HN) 3.524 1.553 1.553 weight 1.000 ! spec=200m..._H2O, no=389, id=175, vol=1.473525e+05
assign (segid " C" and resid 7 and name HN) (segid " C" and resid 6 and name HG21) 3.191 1.273 1.273 weight 1.000 ! spec=200m..._H2O, no=413, id=180, vol=2.885905e+05
or (segid " C" and resid 7 and name HN) (segid " C" and resid 6 and name HG22)
or (segid " C" and resid 7 and name HN) (segid " C" and resid 6 and name HG23)
assign (segid " C" and resid 6 and name HN) (segid " C" and resid 6 and name HG21) 2.984 1.113 1.113 weight 1.000 ! spec=200m..._H2O, no=414, id=181, vol=2.276229e+05
or (segid " C" and resid 6 and name HN) (segid " C" and resid 6 and name HG22)
or (segid " C" and resid 6 and name HN) (segid " C" and resid 6 and name HG23)
assign (segid " C" and resid 25 and name HG1) (segid " C" and resid 25 and name HD1) 3.279 1.344 1.344 weight 1.000 ! spec=200m..._H2O, no=454, id=189, vol=3.457572e+05
assign (segid " C" and resid 20 and name HA) (segid " C" and resid 21 and name HD2) 2.420 0.732 0.732 weight 1.000 ! spec=200m..._H2O, no=459, id=191, vol=9.529992e+05
assign (segid " C" and resid 20 and name HA) (segid " C" and resid 21 and name HD1) 2.378 0.707 0.707 weight 1.000 ! spec=200m..._H2O, no=460, id=192, vol=1.200092e+06
assign (segid " C" and resid 20 and name HB1) (segid " C" and resid 20 and name HA) 3.047 1.161 1.161 weight 1.000 ! spec=200m..._H2O, no=462, id=194, vol=4.333344e+05
assign (segid " C" and resid 20 and name HB2) (segid " C" and resid 20 and name HA) 2.757 0.950 0.950 weight 1.000 ! spec=200m..._H2O, no=463, id=195, vol=4.493381e+05
assign (segid " C" and resid 1 and name HD21) (segid " C" and resid 1 and name HD22) 1.609 0.324 0.324 weight 1.000 ! spec=200m..._H2O, no=479, id=197, vol=7.775404e+06
assign (segid " C" and resid 25 and name HD1) (segid " C" and resid 24 and name HA) 3.582 1.604 1.604 weight 1.000 ! spec=200m..._H2O, no=485, id=198, vol=1.247728e+05
assign (segid " C" and resid 21 and name HG2) (segid " C" and resid 21 and name HD1) 3.051 1.164 1.164 weight 1.000 ! spec=200m..._H2O, no=490, id=199, vol=4.355506e+05
assign (segid " C" and resid 17 and name HN) (segid " C" and resid 18 and name HN) 3.555 1.580 1.580 weight 1.000 ! spec=200m..._H2O, no=493, id=201, vol=1.209020e+05
assign (segid " C" and resid 6 and name HG21) (segid " C" and resid 6 and name HB) 1.950 0.476 0.476 weight 1.000 ! spec=200m..._H2O, no=514, id=206, vol=1.720002e+06
or (segid " C" and resid 6 and name HG22) (segid " C" and resid 6 and name HB)
or (segid " C" and resid 6 and name HG23) (segid " C" and resid 6 and name HB)
assign (segid " C" and resid 6 and name HG21) (segid " C" and resid 6 and name HA) 2.265 0.641 0.641 weight 1.000 ! spec=200m..._H2O, no=516, id=207, vol=7.275302e+05
or (segid " C" and resid 6 and name HG22) (segid " C" and resid 6 and name HA)
or (segid " C" and resid 6 and name HG23) (segid " C" and resid 6 and name HA)
assign (segid " C" and resid 11 and name HN) (segid " C" and resid 12 and name HN) 2.685 0.901 0.901 weight 1.000 ! spec=200m..._H2O, no=518, id=208, vol=6.153522e+05
assign (segid " C" and resid 15 and name HB1) (segid " C" and resid 16 and name HN) 2.187 0.598 0.598 weight 1.000 ! spec=200m..._H2O, no=534, id=210, vol=1.827776e+06
assign (segid " C" and resid 7 and name HA) (segid " C" and resid 17 and name HB2) 2.964 1.098 1.098 weight 1.000 ! spec=200m..._H2O, no=548, id=214, vol=2.118264e+05
or (segid " C" and resid 7 and name HA) (segid " C" and resid 17 and name HB1)
or (segid " C" and resid 7 and name HA) (segid " C" and resid 17 and name HB3)
assign (segid " C" and resid 9 and name HG2) (segid " C" and resid 8 and name HD1) 2.687 0.902 0.902 weight 1.000 ! spec=200m..._H2O, no=563, id=215, vol=3.728366e+05
or (segid " C" and resid 9 and name HG2) (segid " C" and resid 8 and name HD2)
assign (segid " C" and resid 8 and name HZ) (segid " C" and resid 17 and name HB2) 2.780 0.966 0.966 weight 1.000 ! spec=200m..._H2O, no=564, id=216, vol=2.359336e+05
or (segid " C" and resid 8 and name HZ) (segid " C" and resid 17 and name HB1)
or (segid " C" and resid 8 and name HZ) (segid " C" and resid 17 and name HB3)
assign (segid " C" and resid 16 and name HZ3) (segid " C" and resid 16 and name HZ2) 2.560 0.819 3.440 weight 1.000 ! spec=200m..._H2O, no=576, id=217, vol=2.265018e+06
assign (segid " C" and resid 16 and name HE3) (segid " C" and resid 16 and name HH2) 2.737 0.937 3.263 weight 1.000 ! spec=200m..._H2O, no=577, id=218, vol=1.450937e+06
assign (segid " C" and resid 10 and name HN) (segid " C" and resid 10 and name HB1) 3.908 1.909 1.909 weight 1.000 ! spec=200m..._H2O, no=585, id=220, vol=1.427831e+05
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