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 |
|
|
616322 |
5lo2   |
34031 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
# Restraints file 1: ambig.tbl
assign (segid " A" and resid 28 and name HN) (segid " A" and resid 30 and name HN) 3.568 1.591 1.591 weight 1.000 ! spec=Expt_40, no=22, id=20, vol=3.846000e+06
or (segid " A" and resid 28 and name HN) (segid " A" and resid 31 and name HN)
assign (segid " A" and resid 33 and name HN) (segid " A" and resid 30 and name HN) 3.570 1.593 1.593 weight 1.000 ! spec=Expt_40, no=23, id=21, vol=3.701899e+06
or (segid " A" and resid 33 and name HN) (segid " A" and resid 31 and name HN)
assign (segid " A" and resid 34 and name HN) (segid " A" and resid 33 and name HB1) 3.001 1.126 1.126 weight 1.000 ! spec=Expt_40, no=86, id=67, vol=1.038440e+07
or (segid " A" and resid 34 and name HN) (segid " A" and resid 33 and name HB2)
assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HB1) 2.381 0.709 0.709 weight 1.000 ! spec=Expt_40, no=114, id=91, vol=3.285602e+07
or (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HB1)
assign (segid " A" and resid 17 and name HN) (segid " A" and resid 16 and name HA) 2.592 0.840 0.840 weight 1.000 ! spec=Expt_40, no=131, id=108, vol=2.236365e+07
or (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HA)
or (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HA)
assign (segid " A" and resid 16 and name HN) (segid " A" and resid 15 and name HA) 2.548 0.812 0.812 weight 1.000 ! spec=Expt_40, no=136, id=113, vol=2.310176e+07
or (segid " A" and resid 16 and name HN) (segid " A" and resid 16 and name HA)
assign (segid " A" and resid 30 and name HN) (segid " A" and resid 27 and name HA) 3.110 1.209 1.209 weight 1.000 ! spec=Expt_40, no=145, id=121, vol=7.615576e+06
or (segid " A" and resid 31 and name HN) (segid " A" and resid 27 and name HA)
assign (segid " A" and resid 30 and name HN) (segid " A" and resid 30 and name HA) 2.641 0.872 0.872 weight 1.000 ! spec=Expt_40, no=146, id=122, vol=2.036184e+07
or (segid " A" and resid 31 and name HN) (segid " A" and resid 30 and name HA)
assign (segid " A" and resid 11 and name HN) (segid " A" and resid 11 and name HB1) 2.854 1.018 1.018 weight 1.000 ! spec=Expt_40, no=171, id=146, vol=1.275416e+07
or (segid " A" and resid 11 and name HN) (segid " A" and resid 11 and name HB2)
assign (segid " A" and resid 30 and name HN) (segid " A" and resid 30 and name HB2) 2.869 1.029 1.029 weight 1.000 ! spec=Expt_40, no=180, id=153, vol=1.096924e+07
or (segid " A" and resid 31 and name HN) (segid " A" and resid 30 and name HB2)
assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD21) 3.364 1.415 1.415 weight 1.000 ! spec=Expt_40, no=202, id=171, vol=1.085928e+07
or (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD23)
or (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD22)
or (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HD21)
or (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HD23)
or (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HD22)
assign (segid " A" and resid 20 and name HN) (segid " A" and resid 20 and name HB1) 2.438 0.743 0.743 weight 1.000 ! spec=Expt_40, no=236, id=199, vol=3.200656e+07
or (segid " A" and resid 34 and name HB2) (segid " A" and resid 34 and name HN)
assign (segid " A" and resid 11 and name HD22) (segid " A" and resid 11 and name HB1) 2.454 0.753 0.753 weight 1.000 ! spec=Expt_40, no=240, id=203, vol=2.749970e+07
or (segid " A" and resid 11 and name HD22) (segid " A" and resid 11 and name HB2)
assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HA) 2.591 0.839 0.839 weight 1.000 ! spec=Expt_40, no=275, id=238, vol=2.241378e+07
or (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HA)
assign (segid " A" and resid 11 and name HB2) (segid " A" and resid 11 and name HD21) 3.629 1.646 1.646 weight 1.000 ! spec=Expt_40, no=304, id=264, vol=7.175836e+06
or (segid " A" and resid 11 and name HB1) (segid " A" and resid 11 and name HD21)
assign (segid " A" and resid 21 and name HN) (segid " A" and resid 20 and name HN) 2.467 0.761 0.761 weight 1.000 ! spec=Expt_40, no=417, id=343, vol=2.722090e+07
or (segid " A" and resid 21 and name HN) (segid " A" and resid 22 and name HN)
assign (segid " A" and resid 28 and name HG1) (segid " A" and resid 27 and name HD1) 3.686 1.699 1.699 weight 1.000 ! spec=Expt_40, no=433, id=353, vol=6.545236e+06
or (segid " A" and resid 28 and name HG1) (segid " A" and resid 27 and name HD2)
or (segid " A" and resid 28 and name HG1) (segid " A" and resid 28 and name HE22)
assign (segid " A" and resid 7 and name HA) (segid " A" and resid 7 and name HB1) 2.629 0.864 0.864 weight 1.000 ! spec=Expt_40, no=467, id=380, vol=1.730003e+07
or (segid " A" and resid 5 and name HD2) (segid " A" and resid 5 and name HG1)
assign (segid " A" and resid 1 and name HD2) (segid " A" and resid 1 and name HB2) 3.430 1.471 1.471 weight 1.000 ! spec=Expt_40, no=476, id=388, vol=6.799105e+06
or (segid " A" and resid 1 and name HD2) (segid " A" and resid 1 and name HG1)
assign (segid " A" and resid 15 and name HB1) (segid " A" and resid 15 and name HA) 2.556 0.817 0.817 weight 1.000 ! spec=Expt_40, no=551, id=459, vol=3.296158e+07
or (segid " A" and resid 19 and name HB1) (segid " A" and resid 16 and name HA)
assign (segid " A" and resid 26 and name HB1) (segid " A" and resid 26 and name HA) 2.230 0.622 0.622 weight 1.000 ! spec=Expt_40, no=552, id=460, vol=4.864318e+07
or (segid " A" and resid 29 and name HB1) (segid " A" and resid 29 and name HA)
assign (segid " A" and resid 16 and name HA) (segid " A" and resid 19 and name HB2) 2.491 0.775 0.775 weight 1.000 ! spec=Expt_40, no=553, id=461, vol=2.275772e+07
or (segid " A" and resid 25 and name HA) (segid " A" and resid 28 and name HB2)
assign (segid " A" and resid 14 and name HB1) (segid " A" and resid 14 and name HD2) 3.696 1.707 1.707 weight 1.000 ! spec=Expt_40, no=575, id=478, vol=5.059276e+06
or (segid " A" and resid 15 and name HB1) (segid " A" and resid 14 and name HD2)
assign (segid " A" and resid 24 and name HD13) (segid " A" and resid 24 and name HB2) 3.091 1.195 1.195 weight 1.000 ! spec=Expt_40, no=613, id=510, vol=1.340395e+07
or (segid " A" and resid 24 and name HD12) (segid " A" and resid 24 and name HB2)
or (segid " A" and resid 24 and name HD11) (segid " A" and resid 24 and name HB2)
or (segid " A" and resid 31 and name HD11) (segid " A" and resid 31 and name HB1)
or (segid " A" and resid 31 and name HD13) (segid " A" and resid 31 and name HB1)
or (segid " A" and resid 31 and name HD12) (segid " A" and resid 31 and name HB1)
assign (segid " A" and resid 32 and name HN) (segid " A" and resid 31 and name HN) 2.486 0.772 0.772 weight 1.000 ! spec=Expt_41, no=18, id=534, vol=4.289036e+07
or (segid " A" and resid 30 and name HN) (segid " A" and resid 29 and name HN)
assign (segid " A" and resid 34 and name HD1) (segid " A" and resid 34 and name HN) 3.060 1.170 1.170 weight 1.000 ! spec=Expt_41, no=41, id=555, vol=3.523913e+07
or (segid " A" and resid 34 and name HD2) (segid " A" and resid 34 and name HN)
or (segid " A" and resid 20 and name HD1) (segid " A" and resid 20 and name HN)
or (segid " A" and resid 20 and name HD2) (segid " A" and resid 20 and name HN)
assign (segid " A" and resid 12 and name HN) (segid " A" and resid 11 and name HD22) 3.892 1.894 1.894 weight 1.000 ! spec=Expt_41, no=42, id=556, vol=7.972998e+06
or (segid " A" and resid 12 and name HN) (segid " A" and resid 13 and name HN)
assign (segid " A" and resid 30 and name HN) (segid " A" and resid 26 and name HA) 2.944 1.083 1.083 weight 1.000 ! spec=Expt_41, no=79, id=584, vol=2.132325e+07
or (segid " A" and resid 30 and name HN) (segid " A" and resid 29 and name HA)
or (segid " A" and resid 31 and name HN) (segid " A" and resid 29 and name HA)
assign (segid " A" and resid 28 and name HG1) (segid " A" and resid 31 and name HN) 3.381 1.429 1.429 weight 1.000 ! spec=Expt_41, no=84, id=588, vol=1.740250e+07
or (segid " A" and resid 33 and name HB1) (segid " A" and resid 30 and name HN)
or (segid " A" and resid 33 and name HB1) (segid " A" and resid 31 and name HN)
or (segid " A" and resid 33 and name HB2) (segid " A" and resid 30 and name HN)
or (segid " A" and resid 33 and name HB2) (segid " A" and resid 31 and name HN)
assign (segid " A" and resid 21 and name HG2) (segid " A" and resid 21 and name HE21) 3.766 1.773 1.773 weight 1.000 ! spec=Expt_41, no=105, id=607, vol=1.305612e+07
or (segid " A" and resid 21 and name HG1) (segid " A" and resid 21 and name HE21)
assign (segid " A" and resid 14 and name HA) (segid " A" and resid 17 and name HN) 2.441 0.745 0.745 weight 1.000 ! spec=Expt_41, no=176, id=671, vol=5.475820e+07
or (segid " A" and resid 18 and name HN) (segid " A" and resid 18 and name HA)
assign (segid " A" and resid 19 and name HA) (segid " A" and resid 20 and name HN) 2.923 1.068 1.068 weight 1.000 ! spec=Expt_41, no=183, id=677, vol=1.847086e+07
or (segid " A" and resid 19 and name HA) (segid " A" and resid 22 and name HN)
assign (segid " A" and resid 20 and name HN) (segid " A" and resid 17 and name HA) 2.741 0.939 0.939 weight 1.000 ! spec=Expt_41, no=189, id=681, vol=3.100705e+07
or (segid " A" and resid 34 and name HN) (segid " A" and resid 34 and name HA)
assign (segid " A" and resid 29 and name HA) (segid " A" and resid 29 and name HN) 2.358 0.695 0.695 weight 1.000 ! spec=Expt_41, no=195, id=687, vol=6.362777e+07
or (segid " A" and resid 32 and name HN) (segid " A" and resid 32 and name HA)
assign (segid " A" and resid 27 and name HD1) (segid " A" and resid 3 and name HB) 3.457 1.494 1.494 weight 1.000 ! spec=Expt_41, no=202, id=694, vol=1.316737e+07
or (segid " A" and resid 27 and name HD2) (segid " A" and resid 3 and name HB)
or (segid " A" and resid 27 and name HD1) (segid " A" and resid 24 and name HA)
or (segid " A" and resid 27 and name HD2) (segid " A" and resid 24 and name HA)
assign (segid " A" and resid 7 and name HA) (segid " A" and resid 20 and name HD1) 4.002 1.282 1.282 weight 1.000 ! spec=Expt_41, no=210, id=702, vol=1.285211e+07
or (segid " A" and resid 7 and name HA) (segid " A" and resid 20 and name HD2)
or (segid " A" and resid 5 and name HA) (segid " A" and resid 20 and name HD1)
or (segid " A" and resid 5 and name HA) (segid " A" and resid 20 and name HD2)
or (segid " A" and resid 1 and name HD2) (segid " A" and resid 34 and name HD1)
or (segid " A" and resid 1 and name HD2) (segid " A" and resid 34 and name HD2)
assign (segid " A" and resid 20 and name HB1) (segid " A" and resid 20 and name HD1) 2.262 0.640 0.640 weight 1.000 ! spec=Expt_41, no=218, id=710, vol=7.325562e+07
or (segid " A" and resid 20 and name HB1) (segid " A" and resid 20 and name HD2)
or (segid " A" and resid 34 and name HD1) (segid " A" and resid 34 and name HB2)
or (segid " A" and resid 34 and name HD2) (segid " A" and resid 34 and name HB2)
assign (segid " A" and resid 11 and name HB1) (segid " A" and resid 12 and name HN) 3.613 1.632 1.632 weight 1.000 ! spec=Expt_41, no=234, id=721, vol=1.150230e+07
or (segid " A" and resid 11 and name HB2) (segid " A" and resid 12 and name HN)
assign (segid " A" and resid 33 and name HN) (segid " A" and resid 33 and name HB1) 2.480 0.769 0.769 weight 1.000 ! spec=Expt_41, no=241, id=726, vol=4.854184e+07
or (segid " A" and resid 33 and name HN) (segid " A" and resid 33 and name HB2)
assign (segid " A" and resid 29 and name HN) (segid " A" and resid 28 and name HB2) 2.482 0.770 0.770 weight 1.000 ! spec=Expt_41, no=275, id=753, vol=3.350354e+07
or (segid " A" and resid 29 and name HN) (segid " A" and resid 29 and name HB2)
assign (segid " A" and resid 34 and name HE1) (segid " A" and resid 1 and name HB2) 3.653 1.243 1.243 weight 1.000 ! spec=Expt_41, no=290, id=765, vol=1.157109e+07
or (segid " A" and resid 34 and name HE2) (segid " A" and resid 1 and name HB2)
or (segid " A" and resid 34 and name HE1) (segid " A" and resid 1 and name HG1)
or (segid " A" and resid 34 and name HE2) (segid " A" and resid 1 and name HG1)
assign (segid " A" and resid 27 and name HN) (segid " A" and resid 25 and name HB1) 3.401 1.445 1.445 weight 1.000 ! spec=Expt_41, no=303, id=776, vol=1.255871e+07
or (segid " A" and resid 27 and name HN) (segid " A" and resid 25 and name HB2)
or (segid " A" and resid 27 and name HN) (segid " A" and resid 25 and name HB3)
or (segid " A" and resid 27 and name HN) (segid " A" and resid 26 and name HG1)
or (segid " A" and resid 27 and name HN) (segid " A" and resid 26 and name HG2)
assign (segid " A" and resid 20 and name HN) (segid " A" and resid 18 and name HB3) 3.250 1.320 1.320 weight 1.000 ! spec=Expt_41, no=304, id=777, vol=1.479512e+07
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 HB2)
or (segid " A" and resid 20 and name HN) (segid " A" and resid 19 and name HG1)
or (segid " A" and resid 20 and name HN) (segid " A" and resid 19 and name HG2)
or (segid " A" and resid 22 and name HN) (segid " A" and resid 18 and name HB3)
or (segid " A" and resid 22 and name HN) (segid " A" and resid 18 and name HB1)
or (segid " A" and resid 22 and name HN) (segid " A" and resid 18 and name HB2)
or (segid " A" and resid 34 and name HN) (segid " A" and resid 32 and name HB3)
or (segid " A" and resid 34 and name HN) (segid " A" and resid 32 and name HB1)
or (segid " A" and resid 34 and name HN) (segid " A" and resid 32 and name HB2)
assign (segid " A" and resid 31 and name HN) (segid " A" and resid 31 and name HB2) 3.128 1.223 1.223 weight 1.000 ! spec=Expt_41, no=311, id=783, vol=2.752271e+07
or (segid " A" and resid 31 and name HN) (segid " A" and resid 32 and name HB3)
or (segid " A" and resid 31 and name HN) (segid " A" and resid 32 and name HB1)
or (segid " A" and resid 31 and name HN) (segid " A" and resid 32 and name HB2)
assign (segid " A" and resid 17 and name HN) (segid " A" and resid 12 and name HB1) 3.338 1.392 1.392 weight 1.000 ! spec=Expt_41, no=316, id=787, vol=1.217959e+07
or (segid " A" and resid 17 and name HN) (segid " A" and resid 12 and name HB2)
or (segid " A" and resid 17 and name HN) (segid " A" and resid 12 and name HB3)
or (segid " A" and resid 28 and name HN) (segid " A" and resid 31 and name HB1)
assign (segid " A" and resid 29 and name HN) (segid " A" and resid 24 and name HD21) 3.390 1.436 1.436 weight 1.000 ! spec=Expt_41, no=332, id=803, vol=1.321325e+07
or (segid " A" and resid 29 and name HN) (segid " A" and resid 24 and name HD22)
or (segid " A" and resid 29 and name HN) (segid " A" and resid 24 and name HD23)
or (segid " A" and resid 32 and name HN) (segid " A" and resid 31 and name HD21)
or (segid " A" and resid 32 and name HN) (segid " A" and resid 31 and name HD22)
or (segid " A" and resid 32 and name HN) (segid " A" and resid 31 and name HD23)
assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD13) 3.225 1.300 1.300 weight 1.000 ! spec=Expt_41, no=354, id=825, vol=1.773763e+07
or (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD11)
or (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD12)
or (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HD13)
or (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HD11)
or (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HD12)
assign (segid " A" and resid 21 and name HE22) (segid " A" and resid 21 and name HG2) 2.564 0.822 0.822 weight 1.000 ! spec=Expt_41, no=370, id=839, vol=2.943145e+07
or (segid " A" and resid 21 and name HE22) (segid " A" and resid 21 and name HG1)
assign (segid " A" and resid 21 and name HG1) (segid " A" and resid 21 and name HA) 2.649 0.877 0.877 weight 1.000 ! spec=Expt_41, no=453, id=918, vol=3.374142e+07
or (segid " A" and resid 21 and name HG2) (segid " A" and resid 21 and name HA)
assign (segid " A" and resid 11 and name HB1) (segid " A" and resid 11 and name HA) 2.309 0.667 0.667 weight 1.000 ! spec=Expt_41, no=465, id=930, vol=8.159458e+07
or (segid " A" and resid 11 and name HB2) (segid " A" and resid 11 and name HA)
assign (segid " A" and resid 33 and name HB1) (segid " A" and resid 33 and name HA) 2.528 0.799 0.799 weight 1.000 ! spec=Expt_41, no=470, id=935, vol=5.051369e+07
or (segid " A" and resid 33 and name HB2) (segid " A" and resid 33 and name HA)
assign (segid " A" and resid 30 and name HA) (segid " A" and resid 33 and name HB1) 2.747 0.943 0.943 weight 1.000 ! spec=Expt_41, no=473, id=936, vol=2.894640e+07
or (segid " A" and resid 30 and name HA) (segid " A" and resid 33 and name HB2)
assign (segid " A" and resid 21 and name HB1) (segid " A" and resid 18 and name HA) 3.746 1.755 1.755 weight 1.000 ! spec=Expt_41, no=480, id=943, vol=1.367810e+07
or (segid " A" and resid 21 and name HB1) (segid " A" and resid 22 and name HA)
assign (segid " A" and resid 19 and name HG2) (segid " A" and resid 19 and name HA) 2.033 0.516 0.516 weight 1.000 ! spec=Expt_41, no=497, id=960, vol=1.155587e+08
or (segid " A" and resid 25 and name HB1) (segid " A" and resid 25 and name HA)
or (segid " A" and resid 25 and name HB2) (segid " A" and resid 25 and name HA)
or (segid " A" and resid 25 and name HB3) (segid " A" and resid 25 and name HA)
assign (segid " A" and resid 18 and name HB3) (segid " A" and resid 15 and name HA) 3.013 1.089 1.089 weight 1.000 ! spec=Expt_41, no=498, id=961, vol=5.581042e+07
or (segid " A" and resid 18 and name HB1) (segid " A" and resid 15 and name HA)
or (segid " A" and resid 18 and name HB2) (segid " A" and resid 15 and name HA)
or (segid " A" and resid 18 and name HB3) (segid " A" and resid 16 and name HA)
or (segid " A" and resid 18 and name HB1) (segid " A" and resid 16 and name HA)
or (segid " A" and resid 18 and name HB2) (segid " A" and resid 16 and name HA)
or (segid " A" and resid 19 and name HG1) (segid " A" and resid 16 and name HA)
or (segid " A" and resid 19 and name HG2) (segid " A" and resid 16 and name HA)
assign (segid " A" and resid 28 and name HA) (segid " A" and resid 24 and name HD13) 3.877 1.879 1.879 weight 1.000 ! spec=Expt_41, no=530, id=991, vol=7.858335e+06
or (segid " A" and resid 28 and name HA) (segid " A" and resid 24 and name HD12)
or (segid " A" and resid 28 and name HA) (segid " A" and resid 24 and name HD11)
or (segid " A" and resid 28 and name HA) (segid " A" and resid 31 and name HD11)
or (segid " A" and resid 28 and name HA) (segid " A" and resid 31 and name HD13)
or (segid " A" and resid 28 and name HA) (segid " A" and resid 31 and name HD12)
assign (segid " A" and resid 23 and name HA) (segid " A" and resid 25 and name HB1) 3.083 1.188 1.188 weight 1.000 ! spec=Expt_41, no=546, id=1005, vol=1.569774e+07
or (segid " A" and resid 23 and name HA) (segid " A" and resid 25 and name HB2)
or (segid " A" and resid 23 and name HA) (segid " A" and resid 25 and name HB3)
or (segid " A" and resid 23 and name HA) (segid " A" and resid 26 and name HG1)
or (segid " A" and resid 27 and name HA) (segid " A" and resid 26 and name HG1)
or (segid " A" and resid 33 and name HA) (segid " A" and resid 32 and name HB3)
or (segid " A" and resid 33 and name HA) (segid " A" and resid 32 and name HB1)
or (segid " A" and resid 33 and name HA) (segid " A" and resid 32 and name HB2)
assign (segid " A" and resid 14 and name HG1) (segid " A" and resid 13 and name HA) 4.246 2.253 2.253 weight 1.000 ! spec=Expt_41, no=551, id=1010, vol=1.124181e+07
or (segid " A" and resid 16 and name HB2) (segid " A" and resid 13 and name HA)
assign (segid " A" and resid 14 and name HB1) (segid " A" and resid 13 and name HA) 4.120 2.121 2.121 weight 1.000 ! spec=Expt_41, no=552, id=1011, vol=6.785771e+06
or (segid " A" and resid 15 and name HB1) (segid " A" and resid 13 and name HA)
or (segid " A" and resid 19 and name HB1) (segid " A" and resid 20 and name HA)
assign (segid " A" and resid 26 and name HB1) (segid " A" and resid 23 and name HA) 3.363 1.414 1.414 weight 1.000 ! spec=Expt_41, no=554, id=1013, vol=1.219269e+07
or (segid " A" and resid 26 and name HB1) (segid " A" and resid 27 and name HA)
assign (segid " A" and resid 27 and name HB2) (segid " A" and resid 24 and name HD21) 2.843 1.010 1.010 weight 1.000 ! spec=Expt_41, no=582, id=1038, vol=2.607501e+07
or (segid " A" and resid 27 and name HB2) (segid " A" and resid 24 and name HD22)
or (segid " A" and resid 27 and name HB2) (segid " A" and resid 24 and name HD23)
or (segid " A" and resid 34 and name HB2) (segid " A" and resid 31 and name HD21)
or (segid " A" and resid 34 and name HB2) (segid " A" and resid 31 and name HD22)
or (segid " A" and resid 34 and name HB2) (segid " A" and resid 31 and name HD23)
assign (segid " A" and resid 20 and name HN) (segid " A" and resid 21 and name HG2) 3.910 1.911 1.911 weight 1.000 ! spec=Expt_41, no=600, id=1054, vol=9.859130e+06
or (segid " A" and resid 22 and name HN) (segid " A" and resid 21 and name HG2)
or (segid " A" and resid 22 and name HN) (segid " A" and resid 21 and name HG1)
assign (segid " A" and resid 21 and name HG1) (segid " A" and resid 21 and name HB2) 2.454 0.753 0.753 weight 1.000 ! spec=Expt_41, no=643, id=1093, vol=4.120051e+07
or (segid " A" and resid 21 and name HG2) (segid " A" and resid 21 and name HB2)
assign (segid " A" and resid 21 and name HG2) (segid " A" and resid 21 and name HB1) 2.529 0.799 0.799 weight 1.000 ! spec=Expt_41, no=645, id=1095, vol=4.340129e+07
or (segid " A" and resid 21 and name HG1) (segid " A" and resid 21 and name HB1)
assign (segid " A" and resid 21 and name HG2) (segid " A" and resid 18 and name HA) 3.133 1.227 1.227 weight 1.000 ! spec=Expt_41, no=648, id=1098, vol=1.527673e+07
or (segid " A" and resid 21 and name HG1) (segid " A" and resid 18 and name HA)
!assign (segid " A" and resid 8 and name HB2) (segid " A" and resid 12 and name HB1) 2.993 1.120 1.120 weight 1.000 ! spec=Expt_41, no=651, id=1100, vol=2.911045e+07
! or (segid " A" and resid 8 and name HB2) (segid " A" and resid 12 and name HB2)
! or (segid " A" and resid 8 and name HB2) (segid " A" and resid 12 and name HB3)
! or (segid " A" and resid 8 and name HG1) (segid " A" and resid 12 and name HB1)
! or (segid " A" and resid 8 and name HG1) (segid " A" and resid 12 and name HB2)
! or (segid " A" and resid 8 and name HG1) (segid " A" and resid 12 and name HB3)
assign (segid " A" and resid 7 and name HA) (segid " A" and resid 7 and name HD2) 2.849 1.015 1.015 weight 1.000 ! spec=Expt_41, no=680, id=1124, vol=2.105734e+07
or (segid " A" and resid 7 and name HA) (segid " A" and resid 7 and name HB1)
assign (segid " A" and resid 28 and name HG1) (segid " A" and resid 25 and name HB1) 3.444 1.482 1.482 weight 1.000 ! spec=Expt_41, no=702, id=1142, vol=9.471033e+06
or (segid " A" and resid 28 and name HG1) (segid " A" and resid 25 and name HB2)
or (segid " A" and resid 28 and name HG1) (segid " A" and resid 25 and name HB3)
or (segid " A" and resid 33 and name HB1) (segid " A" and resid 32 and name HB3)
or (segid " A" and resid 33 and name HB1) (segid " A" and resid 32 and name HB1)
or (segid " A" and resid 33 and name HB1) (segid " A" and resid 32 and name HB2)
or (segid " A" and resid 33 and name HB2) (segid " A" and resid 32 and name HB3)
or (segid " A" and resid 33 and name HB2) (segid " A" and resid 32 and name HB1)
or (segid " A" and resid 33 and name HB2) (segid " A" and resid 32 and name HB2)
assign (segid " A" and resid 7 and name HE2) (segid " A" and resid 7 and name HD2) 2.511 0.788 0.788 weight 1.000 ! spec=Expt_41, no=718, id=1156, vol=3.424788e+07
or (segid " A" and resid 7 and name HE2) (segid " A" and resid 7 and name HD1)
assign (segid " A" and resid 34 and name HE1) (segid " A" and resid 2 and name HD1) 3.275 1.340 1.340 weight 1.000 ! spec=Expt_41, no=734, id=1171, vol=9.716512e+06
or (segid " A" and resid 34 and name HE2) (segid " A" and resid 2 and name HD1)
or (segid " A" and resid 34 and name HE1) (segid " A" and resid 34 and name HB2)
or (segid " A" and resid 34 and name HE2) (segid " A" and resid 34 and name HB2)
assign (segid " A" and resid 34 and name HE1) (segid " A" and resid 1 and name HB1) 4.122 2.124 2.124 weight 1.000 ! spec=Expt_41, no=737, id=1174, vol=6.505652e+06
or (segid " A" and resid 34 and name HE2) (segid " A" and resid 1 and name HB1)
or (segid " A" and resid 34 and name HE1) (segid " A" and resid 2 and name HG2)
or (segid " A" and resid 34 and name HE2) (segid " A" and resid 2 and name HG2)
assign (segid " A" and resid 27 and name HE1) (segid " A" and resid 2 and name HD1) 3.521 1.549 1.549 weight 1.000 ! spec=Expt_41, no=742, id=1179, vol=8.479592e+06
or (segid " A" and resid 27 and name HE2) (segid " A" and resid 2 and name HD1)
or (segid " A" and resid 27 and name HE1) (segid " A" and resid 27 and name HB2)
or (segid " A" and resid 27 and name HE2) (segid " A" and resid 27 and name HB2)
assign (segid " A" and resid 34 and name HD1) (segid " A" and resid 1 and name HB2) 3.438 1.477 1.477 weight 1.000 ! spec=Expt_41, no=817, id=1243, vol=8.445785e+06
or (segid " A" and resid 34 and name HD2) (segid " A" and resid 1 and name HB2)
or (segid " A" and resid 34 and name HD1) (segid " A" and resid 1 and name HG1)
or (segid " A" and resid 34 and name HD2) (segid " A" and resid 1 and name HG1)
assign (segid " A" and resid 29 and name HG1) (segid " A" and resid 30 and name HN) 3.076 1.183 1.183 weight 1.000 ! spec=Expt_41, no=819, id=1245, vol=2.974954e+07
or (segid " A" and resid 31 and name HN) (segid " A" and resid 31 and name HB2)
or (segid " A" and resid 31 and name HN) (segid " A" and resid 32 and name HB3)
or (segid " A" and resid 31 and name HN) (segid " A" and resid 32 and name HB1)
or (segid " A" and resid 31 and name HN) (segid " A" and resid 32 and name HB2)
assign (segid " A" and resid 19 and name HB2) (segid " A" and resid 19 and name HG1) 2.563 0.821 0.821 weight 1.000 ! spec=Expt_41, no=835, id=1258, vol=3.025719e+07
or (segid " A" and resid 19 and name HB2) (segid " A" and resid 19 and name HG2)
or (segid " A" and resid 26 and name HB2) (segid " A" and resid 26 and name HG1)
or (segid " A" and resid 26 and name HB2) (segid " A" and resid 26 and name HG2)
assign (segid " A" and resid 29 and name HB1) (segid " A" and resid 29 and name HG2) 2.637 0.869 0.869 weight 1.000 ! spec=Expt_41, no=836, id=1259, vol=3.060827e+07
or (segid " A" and resid 29 and name HB1) (segid " A" and resid 29 and name HG1)
or (segid " A" and resid 26 and name HB1) (segid " A" and resid 26 and name HG2)
assign (segid " A" and resid 26 and name HA) (segid " A" and resid 29 and name HB2) 2.576 0.830 0.830 weight 1.000 ! spec=Expt_41, no=838, id=1260, vol=3.735745e+07
or (segid " A" and resid 29 and name HA) (segid " A" and resid 29 and name HB2)
assign (segid " A" and resid 19 and name HB2) (segid " A" and resid 19 and name HA) 2.706 0.916 0.916 weight 1.000 ! spec=Expt_41, no=846, id=1266, vol=3.220671e+07
or (segid " A" and resid 25 and name HA) (segid " A" and resid 28 and name HB2)
assign (segid " A" and resid 26 and name HG2) (segid " A" and resid 26 and name HA) 1.947 0.474 0.474 weight 1.000 ! spec=Expt_41, no=848, id=1268, vol=1.773333e+08
or (segid " A" and resid 29 and name HG2) (segid " A" and resid 29 and name HA)
or (segid " A" and resid 32 and name HB3) (segid " A" and resid 32 and name HA)
or (segid " A" and resid 32 and name HB1) (segid " A" and resid 32 and name HA)
or (segid " A" and resid 32 and name HB2) (segid " A" and resid 32 and name HA)
assign (segid " A" and resid 30 and name HB2) (segid " A" and resid 30 and name HA) 2.932 1.074 1.074 weight 1.000 ! spec=Expt_41, no=852, id=1272, vol=2.883759e+07
or (segid " A" and resid 10 and name HB1) (segid " A" and resid 10 and name HA)
# Restraints file 2: unambig.tbl
assign (segid " A" and resid 23 and name HN) (segid " A" and resid 22 and name HN) 2.482 0.770 0.770 weight 1.000 ! spec=Expt_40, no=2, id=1, vol=2.715402e+07
assign (segid " A" and resid 15 and name HN) (segid " A" and resid 16 and name HN) 2.624 0.860 0.860 weight 1.000 ! spec=Expt_40, no=3, id=2, vol=1.830369e+07
assign (segid " A" and resid 24 and name HN) (segid " A" and resid 25 and name HN) 2.604 0.848 0.848 weight 1.000 ! spec=Expt_40, no=5, id=4, vol=2.025370e+07
assign (segid " A" and resid 30 and name HN) (segid " A" and resid 29 and name HN) 2.465 0.760 0.760 weight 1.000 ! spec=Expt_40, no=6, id=5, vol=2.746728e+07
assign (segid " A" and resid 11 and name HN) (segid " A" and resid 12 and name HN) 2.817 0.992 0.992 weight 1.000 ! spec=Expt_40, no=9, id=7, vol=1.314365e+07
assign (segid " A" and resid 27 and name HN) (segid " A" and resid 26 and name HN) 2.600 0.845 0.845 weight 1.000 ! spec=Expt_40, no=12, id=10, vol=1.991331e+07
assign (segid " A" and resid 33 and name HN) (segid " A" and resid 32 and name HN) 2.496 0.779 0.779 weight 1.000 ! spec=Expt_40, no=13, id=11, vol=2.641890e+07
assign (segid " A" and resid 18 and name HN) (segid " A" and resid 19 and name HN) 2.465 0.759 0.759 weight 1.000 ! spec=Expt_40, no=14, id=12, vol=2.819410e+07
assign (segid " A" and resid 17 and name HN) (segid " A" and resid 16 and name HN) 2.442 0.745 0.745 weight 1.000 ! spec=Expt_40, no=15, id=13, vol=2.732358e+07
assign (segid " A" and resid 28 and name HN) (segid " A" and resid 29 and name HN) 2.622 0.860 0.860 weight 1.000 ! spec=Expt_40, no=17, id=15, vol=1.853224e+07
assign (segid " A" and resid 32 and name HN) (segid " A" and resid 31 and name HN) 2.413 0.728 0.728 weight 1.000 ! spec=Expt_40, no=21, id=19, vol=3.214108e+07
assign (segid " A" and resid 27 and name HD1) (segid " A" and resid 28 and name HN) 3.503 1.533 1.533 weight 1.000 ! spec=Expt_40, no=29, id=26, vol=8.591011e+06
or (segid " A" and resid 27 and name HD2) (segid " A" and resid 28 and name HN)
assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 24 and name HD21) 4.020 1.065 1.065 weight 1.000 ! spec=Expt_40, no=49, id=42, vol=1.538291e+07
or (segid " A" and resid 20 and name HD1) (segid " A" and resid 24 and name HD22)
or (segid " A" and resid 20 and name HD1) (segid " A" and resid 24 and name HD23)
or (segid " A" and resid 20 and name HD2) (segid " A" and resid 24 and name HD21)
or (segid " A" and resid 20 and name HD2) (segid " A" and resid 24 and name HD22)
or (segid " A" and resid 20 and name HD2) (segid " A" and resid 24 and name HD23)
assign (segid " A" and resid 29 and name HN) (segid " A" and resid 28 and name HB1) 3.268 1.335 1.335 weight 1.000 ! spec=Expt_40, no=53, id=45, vol=8.851293e+06
assign (segid " A" and resid 29 and name HN) (segid " A" and resid 29 and name HB1) 2.625 0.861 0.861 weight 1.000 ! spec=Expt_40, no=55, id=47, vol=1.954785e+07
assign (segid " A" and resid 32 and name HN) (segid " A" and resid 32 and name HA) 2.336 0.682 0.682 weight 1.000 ! spec=Expt_40, no=60, id=50, vol=4.153811e+07
assign (segid " A" and resid 34 and name HD1) (segid " A" and resid 34 and name HB2) 2.436 0.742 0.742 weight 1.000 ! spec=Expt_40, no=67, id=57, vol=4.518430e+07
or (segid " A" and resid 34 and name HD2) (segid " A" and resid 34 and name HB2)
assign (segid " A" and resid 20 and name HN) (segid " A" and resid 20 and name HB1) 2.389 0.714 0.714 weight 1.000 ! spec=Expt_40, no=76, id=61, vol=3.703565e+07
assign (segid " A" and resid 21 and name HN) (segid " A" and resid 20 and name HB2) 2.851 1.016 1.016 weight 1.000 ! spec=Expt_40, no=78, id=62, vol=1.036060e+07
assign (segid " A" and resid 20 and name HN) (segid " A" and resid 20 and name HB2) 2.545 0.810 0.810 weight 1.000 ! spec=Expt_40, no=79, id=63, vol=2.214700e+07
assign (segid " A" and resid 34 and name HN) (segid " A" and resid 34 and name HB1) 2.604 0.847 0.847 weight 1.000 ! spec=Expt_40, no=81, id=64, vol=2.146973e+07
assign (segid " A" and resid 13 and name HN) (segid " A" and resid 13 and name HA) 2.638 0.870 0.870 weight 1.000 ! spec=Expt_40, no=90, id=71, vol=1.828412e+07
assign (segid " A" and resid 13 and name HN) (segid " A" and resid 12 and name HA) 2.141 0.573 0.573 weight 1.000 ! spec=Expt_40, no=91, id=72, vol=6.536268e+07
assign (segid " A" and resid 19 and name HN) (segid " A" and resid 19 and name HB2) 2.525 0.797 0.797 weight 1.000 ! spec=Expt_40, no=99, id=79, vol=2.266320e+07
assign (segid " A" and resid 19 and name HN) (segid " A" and resid 19 and name HB1) 2.525 0.797 0.797 weight 1.000 ! spec=Expt_40, no=100, id=80, vol=2.429498e+07
assign (segid " A" and resid 26 and name HN) (segid " A" and resid 26 and name HB2) 2.544 0.809 0.809 weight 1.000 ! spec=Expt_40, no=101, id=81, vol=2.102913e+07
assign (segid " A" and resid 26 and name HN) (segid " A" and resid 26 and name HB1) 2.631 0.865 0.865 weight 1.000 ! spec=Expt_40, no=102, id=82, vol=2.094033e+07
assign (segid " A" and resid 13 and name HN) (segid " A" and resid 16 and name HB2) 3.105 1.205 1.205 weight 1.000 ! spec=Expt_40, no=108, id=86, vol=8.781435e+06
assign (segid " A" and resid 28 and name HN) (segid " A" and resid 28 and name HB1) 3.106 1.206 1.206 weight 1.000 ! spec=Expt_40, no=111, id=89, vol=1.814188e+07
assign (segid " A" and resid 17 and name HN) (segid " A" and resid 16 and name HB1) 3.007 1.130 1.130 weight 1.000 ! spec=Expt_40, no=115, id=92, vol=7.569255e+06
assign (segid " A" and resid 10 and name HN) (segid " A" and resid 9 and name HA1) 2.742 0.940 0.940 weight 1.000 ! spec=Expt_40, no=122, id=99, vol=2.004914e+07
assign (segid " A" and resid 9 and name HN) (segid " A" and resid 9 and name HA2) 2.543 0.809 0.809 weight 1.000 ! spec=Expt_40, no=123, id=100, vol=2.192516e+07
assign (segid " A" and resid 27 and name HN) (segid " A" and resid 27 and name HB1) 2.624 0.861 0.861 weight 1.000 ! spec=Expt_40, no=129, id=106, vol=2.222901e+07
assign (segid " A" and resid 9 and name HN) (segid " A" and resid 8 and name HA) 2.171 0.589 0.589 weight 1.000 ! spec=Expt_40, no=132, id=109, vol=5.385299e+07
assign (segid " A" and resid 18 and name HN) (segid " A" and resid 18 and name HA) 2.411 0.727 0.727 weight 1.000 ! spec=Expt_40, no=133, id=110, vol=3.297630e+07
assign (segid " A" and resid 27 and name HN) (segid " A" and resid 27 and name HA) 2.720 0.925 0.925 weight 1.000 ! spec=Expt_40, no=134, id=111, vol=1.634167e+07
assign (segid " A" and resid 33 and name HN) (segid " A" and resid 33 and name HA) 2.605 0.848 0.848 weight 1.000 ! spec=Expt_40, no=135, id=112, vol=2.305369e+07
assign (segid " A" and resid 26 and name HN) (segid " A" and resid 26 and name HA) 2.619 0.858 0.858 weight 1.000 ! spec=Expt_40, no=137, id=114, vol=2.038770e+07
assign (segid " A" and resid 22 and name HN) (segid " A" and resid 22 and name HA) 2.524 0.796 0.796 weight 1.000 ! spec=Expt_40, no=139, id=116, vol=2.659497e+07
assign (segid " A" and resid 34 and name HN) (segid " A" and resid 34 and name HA) 2.752 0.947 0.947 weight 1.000 ! spec=Expt_40, no=140, id=117, vol=1.659067e+07
assign (segid " A" and resid 3 and name HN) (segid " A" and resid 2 and name HA) 2.181 0.595 0.595 weight 1.000 ! spec=Expt_40, no=143, id=119, vol=5.871160e+07
assign (segid " A" and resid 6 and name HN) (segid " A" and resid 5 and name HA) 2.120 0.562 0.562 weight 1.000 ! spec=Expt_40, no=144, id=120, vol=6.676087e+07
assign (segid " A" and resid 4 and name HN) (segid " A" and resid 3 and name HA) 2.103 0.553 0.553 weight 1.000 ! spec=Expt_40, no=148, id=124, vol=7.171202e+07
assign (segid " A" and resid 15 and name HN) (segid " A" and resid 15 and name HA) 2.564 0.822 0.822 weight 1.000 ! spec=Expt_40, no=149, id=125, vol=2.465387e+07
assign (segid " A" and resid 7 and name HN) (segid " A" and resid 6 and name HA) 2.802 0.652 0.652 weight 1.000 ! spec=Expt_40, no=151, id=127, vol=7.930968e+07
assign (segid " A" and resid 15 and name HN) (segid " A" and resid 13 and name HB) 2.695 0.908 0.908 weight 1.000 ! spec=Expt_40, no=153, id=129, vol=1.575591e+07
assign (segid " A" and resid 11 and name HN) (segid " A" and resid 11 and name HA) 2.744 0.941 0.941 weight 1.000 ! spec=Expt_40, no=154, id=130, vol=1.610263e+07
assign (segid " A" and resid 23 and name HN) (segid " A" and resid 23 and name HA) 2.741 0.939 0.939 weight 1.000 ! spec=Expt_40, no=156, id=131, vol=1.600980e+07
assign (segid " A" and resid 11 and name HN) (segid " A" and resid 10 and name HA) 2.909 1.058 1.058 weight 1.000 ! spec=Expt_40, no=157, id=132, vol=1.378566e+07
assign (segid " A" and resid 10 and name HN) (segid " A" and resid 10 and name HA) 2.872 1.031 1.031 weight 1.000 ! spec=Expt_40, no=158, id=133, vol=1.149717e+07
assign (segid " A" and resid 23 and name HN) (segid " A" and resid 22 and name HA) 3.215 1.292 1.292 weight 1.000 ! spec=Expt_40, no=159, id=134, vol=6.614177e+06
assign (segid " A" and resid 6 and name HN) (segid " A" and resid 6 and name HB) 2.435 0.741 0.741 weight 1.000 ! spec=Expt_40, no=161, id=136, vol=3.042778e+07
assign (segid " A" and resid 3 and name HN) (segid " A" and resid 3 and name HB) 2.571 0.826 0.826 weight 1.000 ! spec=Expt_40, no=162, id=137, vol=2.265416e+07
assign (segid " A" and resid 15 and name HN) (segid " A" and resid 14 and name HD2) 2.999 1.125 1.125 weight 1.000 ! spec=Expt_40, no=163, id=138, vol=7.882142e+06
assign (segid " A" and resid 7 and name HN) (segid " A" and resid 7 and name HA) 2.799 0.980 0.980 weight 1.000 ! spec=Expt_40, no=165, id=140, vol=1.267361e+07
assign (segid " A" and resid 28 and name HN) (segid " A" and resid 27 and name HB1) 2.818 0.993 0.993 weight 1.000 ! spec=Expt_40, no=166, id=141, vol=1.061677e+07
assign (segid " A" and resid 4 and name HN) (segid " A" and resid 4 and name HA) 2.914 1.061 1.061 weight 1.000 ! spec=Expt_40, no=169, id=144, vol=1.107578e+07
assign (segid " A" and resid 23 and name HN) (segid " A" and resid 23 and name HB2) 2.686 0.902 0.902 weight 1.000 ! spec=Expt_40, no=172, id=147, vol=1.540668e+07
assign (segid " A" and resid 20 and name HN) (segid " A" and resid 20 and name HA) 2.800 0.980 0.980 weight 1.000 ! spec=Expt_40, no=173, id=148, vol=1.419409e+07
assign (segid " A" and resid 30 and name HN) (segid " A" and resid 30 and name HB1) 2.646 0.875 0.875 weight 1.000 ! spec=Expt_40, no=178, id=152, vol=2.053075e+07
assign (segid " A" and resid 15 and name HN) (segid " A" and resid 15 and name HB2) 2.720 0.925 0.925 weight 1.000 ! spec=Expt_40, no=184, id=155, vol=1.718030e+07
assign (segid " A" and resid 30 and name HN) (segid " A" and resid 29 and name HB2) 2.731 0.932 0.932 weight 1.000 ! spec=Expt_40, no=185, id=156, vol=1.403921e+07
assign (segid " A" and resid 15 and name HN) (segid " A" and resid 15 and name HB1) 2.502 0.782 0.782 weight 1.000 ! spec=Expt_40, no=186, id=157, vol=2.429863e+07
assign (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HB1) 2.572 0.827 0.827 weight 1.000 ! spec=Expt_40, no=188, id=159, vol=2.061721e+07
assign (segid " A" and resid 31 and name HN) (segid " A" and resid 31 and name HB2) 2.998 1.123 1.123 weight 1.000 ! spec=Expt_40, no=192, id=161, vol=1.815118e+07
assign (segid " A" and resid 4 and name HN) (segid " A" and resid 4 and name HB2) 2.726 0.929 0.929 weight 1.000 ! spec=Expt_40, no=194, id=163, vol=1.767782e+07
assign (segid " A" and resid 4 and name HN) (segid " A" and resid 4 and name HB1) 2.699 0.911 0.911 weight 1.000 ! spec=Expt_40, no=195, id=164, vol=1.554790e+07
assign (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HD13) 3.039 1.154 1.154 weight 1.000 ! spec=Expt_40, no=198, id=167, vol=1.902084e+07
or (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HD12)
or (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HD11)
assign (segid " A" and resid 31 and name HN) (segid " A" and resid 31 and name HD11) 3.050 1.163 1.163 weight 1.000 ! spec=Expt_40, no=199, id=168, vol=1.896601e+07
or (segid " A" and resid 31 and name HN) (segid " A" and resid 31 and name HD13)
or (segid " A" and resid 31 and name HN) (segid " A" and resid 31 and name HD12)
assign (segid " A" and resid 7 and name HN) (segid " A" and resid 7 and name HB2) 3.083 1.188 1.188 weight 1.000 ! spec=Expt_40, no=205, id=174, vol=1.925727e+07
assign (segid " A" and resid 10 and name HN) (segid " A" and resid 10 and name HB1) 2.623 0.860 0.860 weight 1.000 ! spec=Expt_40, no=213, id=179, vol=1.709522e+07
assign (segid " A" and resid 10 and name HN) (segid " A" and resid 10 and name HB2) 2.873 1.032 1.032 weight 1.000 ! spec=Expt_40, no=217, id=181, vol=1.343684e+07
assign (segid " A" and resid 28 and name HN) (segid " A" and resid 28 and name HG2) 3.529 1.556 1.556 weight 1.000 ! spec=Expt_40, no=220, id=184, vol=9.458972e+06
assign (segid " A" and resid 11 and name HN) (segid " A" and resid 11 and name HB1) 2.911 1.059 1.059 weight 1.000 ! spec=Expt_40, no=230, id=193, vol=1.015324e+07
assign (segid " A" and resid 20 and name HB1) (segid " A" and resid 21 and name HN) 3.640 1.656 1.656 weight 1.000 ! spec=Expt_40, no=234, id=197, vol=6.947971e+06
assign (segid " A" and resid 21 and name HB1) (segid " A" and resid 21 and name HN) 3.268 1.335 1.335 weight 1.000 ! spec=Expt_40, no=242, id=205, vol=1.358580e+07
assign (segid " A" and resid 28 and name HN) (segid " A" and resid 27 and name HB2) 3.557 1.581 1.581 weight 1.000 ! spec=Expt_40, no=250, id=213, vol=6.923765e+06
assign (segid " A" and resid 28 and name HN) (segid " A" and resid 28 and name HA) 2.700 0.911 0.911 weight 1.000 ! spec=Expt_40, no=251, id=214, vol=1.602817e+07
assign (segid " A" and resid 27 and name HN) (segid " A" and resid 27 and name HB2) 2.572 0.827 0.827 weight 1.000 ! spec=Expt_40, no=254, id=217, vol=1.973232e+07
assign (segid " A" and resid 21 and name HN) (segid " A" and resid 21 and name HA) 2.705 0.915 0.915 weight 1.000 ! spec=Expt_40, no=255, id=218, vol=1.646582e+07
assign (segid " A" and resid 3 and name HN) (segid " A" and resid 3 and name HA) 2.969 1.102 1.102 weight 1.000 ! spec=Expt_40, no=261, id=224, vol=9.681728e+06
assign (segid " A" and resid 6 and name HN) (segid " A" and resid 6 and name HA) 2.676 0.895 0.895 weight 1.000 ! spec=Expt_40, no=265, id=228, vol=1.851845e+07
assign (segid " A" and resid 6 and name HB) (segid " A" and resid 7 and name HN) 3.049 1.162 1.162 weight 1.000 ! spec=Expt_40, no=269, id=232, vol=1.133526e+07
assign (segid " A" and resid 10 and name HN) (segid " A" and resid 9 and name HA2) 2.722 0.926 0.926 weight 1.000 ! spec=Expt_40, no=273, id=236, vol=1.570561e+07
assign (segid " A" and resid 9 and name HN) (segid " A" and resid 9 and name HA1) 2.734 0.934 0.934 weight 1.000 ! spec=Expt_40, no=277, id=240, vol=1.684509e+07
assign (segid " A" and resid 19 and name HN) (segid " A" and resid 19 and name HA) 2.582 0.833 0.833 weight 1.000 ! spec=Expt_40, no=283, id=246, vol=2.248748e+07
assign (segid " A" and resid 25 and name HN) (segid " A" and resid 25 and name HA) 2.602 0.846 0.846 weight 1.000 ! spec=Expt_40, no=289, id=252, vol=2.108208e+07
assign (segid " A" and resid 29 and name HA) (segid " A" and resid 29 and name HN) 2.466 0.760 0.760 weight 1.000 ! spec=Expt_40, no=291, id=254, vol=2.932947e+07
assign (segid " A" and resid 28 and name HA) (segid " A" and resid 27 and name HD1) 3.382 1.430 1.430 weight 1.000 ! spec=Expt_40, no=306, id=266, vol=6.180899e+06
or (segid " A" and resid 28 and name HA) (segid " A" and resid 27 and name HD2)
assign (segid " A" and resid 4 and name HG1) (segid " A" and resid 4 and name HN) 3.172 1.257 1.257 weight 1.000 ! spec=Expt_40, no=318, id=271, vol=6.764714e+06
assign (segid " A" and resid 14 and name HD2) (segid " A" and resid 13 and name HB) 2.467 0.761 0.761 weight 1.000 ! spec=Expt_40, no=359, id=298, vol=2.254562e+07
assign (segid " A" and resid 14 and name HD1) (segid " A" and resid 13 and name HB) 3.100 1.201 1.201 weight 1.000 ! spec=Expt_40, no=360, id=299, vol=1.581462e+07
assign (segid " A" and resid 14 and name HD1) (segid " A" and resid 13 and name HA) 2.116 0.560 0.560 weight 1.000 ! spec=Expt_40, no=365, id=302, vol=5.693288e+07
assign (segid " A" and resid 14 and name HD2) (segid " A" and resid 13 and name HA) 2.651 0.878 0.878 weight 1.000 ! spec=Expt_40, no=366, id=303, vol=3.009741e+07
assign (segid " A" and resid 20 and name HB1) (segid " A" and resid 20 and name HA) 2.576 0.829 0.829 weight 1.000 ! spec=Expt_40, no=370, id=305, vol=2.029541e+07
assign (segid " A" and resid 20 and name HB2) (segid " A" and resid 20 and name HA) 3.267 1.334 1.334 weight 1.000 ! spec=Expt_40, no=371, id=306, vol=7.808862e+06
assign (segid " A" and resid 23 and name HB2) (segid " A" and resid 20 and name HA) 3.064 1.174 1.174 weight 1.000 ! spec=Expt_40, no=372, id=307, vol=7.440532e+06
assign (segid " A" and resid 6 and name HA) (segid " A" and resid 6 and name HG23) 2.447 0.748 0.748 weight 1.000 ! spec=Expt_40, no=378, id=311, vol=4.922907e+07
or (segid " A" and resid 6 and name HA) (segid " A" and resid 6 and name HG22)
or (segid " A" and resid 6 and name HA) (segid " A" and resid 6 and name HG21)
assign (segid " A" and resid 8 and name HD2) (segid " A" and resid 8 and name HD1) 2.071 0.536 0.536 weight 1.000 ! spec=Expt_40, no=392, id=324, vol=5.199521e+07
assign (segid " A" and resid 5 and name HD1) (segid " A" and resid 5 and name HD2) 1.932 0.467 0.467 weight 1.000 ! spec=Expt_40, no=393, id=325, vol=8.165619e+07
assign (segid " A" and resid 34 and name HB2) (segid " A" and resid 34 and name HA) 2.421 0.733 0.733 weight 1.000 ! spec=Expt_40, no=397, id=328, vol=3.217556e+07
assign (segid " A" and resid 15 and name HG1) (segid " A" and resid 15 and name HA) 2.899 1.051 1.051 weight 1.000 ! spec=Expt_40, no=398, id=329, vol=1.362205e+07
assign (segid " A" and resid 20 and name HB2) (segid " A" and resid 17 and name HA) 2.784 0.969 0.969 weight 1.000 ! spec=Expt_40, no=404, id=332, vol=1.240769e+07
assign (segid " A" and resid 27 and name HB1) (segid " A" and resid 24 and name HA) 2.828 1.000 1.000 weight 1.000 ! spec=Expt_40, no=405, id=333, vol=1.244086e+07
assign (segid " A" and resid 27 and name HB2) (segid " A" and resid 24 and name HA) 2.716 0.922 0.922 weight 1.000 ! spec=Expt_40, no=406, id=334, vol=1.516378e+07
assign (segid " A" and resid 34 and name HB2) (segid " A" and resid 31 and name HA) 3.343 1.157 1.157 weight 1.000 ! spec=Expt_40, no=407, id=335, vol=9.023076e+06
assign (segid " A" and resid 34 and name HB1) (segid " A" and resid 31 and name HA) 3.041 1.156 1.156 weight 1.000 ! spec=Expt_40, no=408, id=336, vol=7.652072e+06
assign (segid " A" and resid 14 and name HG2) (segid " A" and resid 14 and name HD2) 3.097 1.199 1.199 weight 1.000 ! spec=Expt_40, no=410, id=338, vol=1.361390e+07
assign (segid " A" and resid 33 and name HN) (segid " A" and resid 34 and name HN) 2.580 0.832 0.832 weight 1.000 ! spec=Expt_40, no=415, id=342, vol=2.196123e+07
assign (segid " A" and resid 25 and name HN) (segid " A" and resid 26 and name HN) 2.610 0.851 0.851 weight 1.000 ! spec=Expt_40, no=418, id=344, vol=1.989306e+07
assign (segid " A" and resid 28 and name HE21) (segid " A" and resid 28 and name HG2) 3.351 1.403 1.403 weight 1.000 ! spec=Expt_40, no=432, id=352, vol=7.120530e+06
assign (segid " A" and resid 28 and name HG2) (segid " A" and resid 28 and name HE22) 3.608 1.627 1.627 weight 1.000 ! spec=Expt_40, no=434, id=354, vol=6.123927e+06
assign (segid " A" and resid 8 and name HA) (segid " A" and resid 8 and name HB1) 2.741 0.939 0.939 weight 1.000 ! spec=Expt_40, no=445, id=364, vol=2.024288e+07
assign (segid " A" and resid 8 and name HG2) (segid " A" and resid 8 and name HD2) 2.992 1.119 1.119 weight 1.000 ! spec=Expt_40, no=448, id=366, vol=1.488981e+07
assign (segid " A" and resid 8 and name HD2) (segid " A" and resid 7 and name HA) 2.451 0.751 0.751 weight 1.000 ! spec=Expt_40, no=450, id=368, vol=3.028013e+07
assign (segid " A" and resid 8 and name HD2) (segid " A" and resid 8 and name HB1) 3.307 1.367 1.367 weight 1.000 ! spec=Expt_40, no=453, id=370, vol=6.008847e+06
assign (segid " A" and resid 6 and name HN) (segid " A" and resid 5 and name HB1) 3.826 1.830 1.830 weight 1.000 ! spec=Expt_40, no=460, id=376, vol=4.898451e+06
assign (segid " A" and resid 6 and name HN) (segid " A" and resid 5 and name HB2) 3.449 1.487 1.487 weight 1.000 ! spec=Expt_40, no=463, id=377, vol=5.538561e+06
assign (segid " A" and resid 3 and name HN) (segid " A" and resid 2 and name HB1) 3.351 1.404 1.404 weight 1.000 ! spec=Expt_40, no=464, id=378, vol=5.404479e+06
assign (segid " A" and resid 7 and name HA) (segid " A" and resid 7 and name HG1) 2.997 1.123 1.123 weight 1.000 ! spec=Expt_40, no=466, id=379, vol=8.264376e+06
assign (segid " A" and resid 7 and name HA) (segid " A" and resid 7 and name HB2) 2.737 0.936 0.936 weight 1.000 ! spec=Expt_40, no=468, id=381, vol=1.273098e+07
assign (segid " A" and resid 14 and name HG2) (segid " A" and resid 14 and name HG1) 2.196 0.603 0.603 weight 1.000 ! spec=Expt_40, no=486, id=397, vol=4.056856e+07
assign (segid " A" and resid 28 and name HB1) (segid " A" and resid 28 and name HB2) 2.130 0.567 0.567 weight 1.000 ! spec=Expt_40, no=488, id=399, vol=4.546262e+07
assign (segid " A" and resid 27 and name HA) (segid " A" and resid 27 and name HB1) 3.164 1.252 1.252 weight 1.000 ! spec=Expt_40, no=489, id=400, vol=7.954358e+06
!assign (segid " A" and resid 1 and name HD1) (segid " A" and resid 34 and name HB2) 4.007 1.367 1.367 weight 1.000 ! spec=Expt_40, no=494, id=405, vol=8.879884e+06 !Diagonal not real nOE
assign (segid " A" and resid 28 and name HA) (segid " A" and resid 28 and name HG1) 3.050 1.163 1.163 weight 1.000 ! spec=Expt_40, no=496, id=407, vol=7.683478e+06
assign (segid " A" and resid 28 and name HG2) (segid " A" and resid 28 and name HA) 2.972 1.104 1.104 weight 1.000 ! spec=Expt_40, no=500, id=411, vol=1.025673e+07
assign (segid " A" and resid 14 and name HB2) (segid " A" and resid 14 and name HA) 2.614 0.854 0.854 weight 1.000 ! spec=Expt_40, no=502, id=413, vol=3.173612e+07
assign (segid " A" and resid 14 and name HD1) (segid " A" and resid 14 and name HG1) 3.052 1.164 1.164 weight 1.000 ! spec=Expt_40, no=506, id=416, vol=1.063833e+07
assign (segid " A" and resid 28 and name HA) (segid " A" and resid 28 and name HB2) 2.817 0.992 0.992 weight 1.000 ! spec=Expt_40, no=507, id=417, vol=1.625468e+07
assign (segid " A" and resid 21 and name HA) (segid " A" and resid 21 and name HB1) 2.478 0.768 0.768 weight 1.000 ! spec=Expt_40, no=509, id=419, vol=2.481053e+07
assign (segid " A" and resid 28 and name HA) (segid " A" and resid 28 and name HB1) 2.712 0.919 0.919 weight 1.000 ! spec=Expt_40, no=511, id=420, vol=1.438895e+07
assign (segid " A" and resid 4 and name HD1) (segid " A" and resid 4 and name HA) 3.501 1.281 1.281 weight 1.000 ! spec=Expt_40, no=515, id=424, vol=1.217556e+07
assign (segid " A" and resid 28 and name HA) (segid " A" and resid 31 and name HB2) 3.428 1.469 1.469 weight 1.000 ! spec=Expt_40, no=516, id=425, vol=1.261407e+07
assign (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HA) 2.790 0.973 0.973 weight 1.000 ! spec=Expt_40, no=520, id=429, vol=1.364277e+07
assign (segid " A" and resid 21 and name HA) (segid " A" and resid 24 and name HN) 3.181 1.265 1.265 weight 1.000 ! spec=Expt_40, no=521, id=430, vol=7.128978e+06
assign (segid " A" and resid 28 and name HA) (segid " A" and resid 29 and name HN) 3.450 1.488 1.488 weight 1.000 ! spec=Expt_40, no=525, id=433, vol=4.624925e+06
!assign (segid " A" and resid 1 and name HD1) (segid " A" and resid 2 and name HD1) 3.505 1.536 1.536 weight 1.000 ! spec=Expt_40, no=531, id=439, vol=7.350436e+06 !Diagonal not real nOE
assign (segid " A" and resid 19 and name HB1) (segid " A" and resid 19 and name HA) 2.383 0.710 0.710 weight 1.000 ! spec=Expt_40, no=537, id=445, vol=3.031344e+07
assign (segid " A" and resid 22 and name HB2) (segid " A" and resid 19 and name HA) 2.462 0.758 0.758 weight 1.000 ! spec=Expt_40, no=542, id=450, vol=3.046837e+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 5 and name HB2) (segid " A" and resid 5 and name HA) 2.700 0.911 0.911 weight 1.000 ! spec=Expt_40, no=545, id=453, vol=2.150534e+07
assign (segid " A" and resid 12 and name HB1) (segid " A" and resid 16 and name HB2) 3.427 1.468 1.468 weight 1.000 ! spec=Expt_40, no=548, id=456, vol=1.182573e+07
or (segid " A" and resid 12 and name HB2) (segid " A" and resid 16 and name HB2)
or (segid " A" and resid 12 and name HB3) (segid " A" and resid 16 and name HB2)
assign (segid " A" and resid 31 and name HA) (segid " A" and resid 31 and name HB2) 2.909 1.058 1.058 weight 1.000 ! spec=Expt_40, no=549, id=457, vol=1.148215e+07
assign (segid " A" and resid 18 and name HA) (segid " A" and resid 21 and name HB2) 2.758 0.951 0.951 weight 1.000 ! spec=Expt_40, no=554, id=462, vol=1.271626e+07
assign (segid " A" and resid 15 and name HG2) (segid " A" and resid 15 and name HA) 2.673 0.893 0.893 weight 1.000 ! spec=Expt_40, no=556, id=464, vol=1.790199e+07
assign (segid " A" and resid 14 and name HA) (segid " A" and resid 17 and name HB1) 2.730 0.932 0.932 weight 1.000 ! spec=Expt_40, no=557, id=465, vol=1.552125e+07
assign (segid " A" and resid 14 and name HA) (segid " A" and resid 14 and name HG1) 3.468 1.503 1.503 weight 1.000 ! spec=Expt_40, no=559, id=467, vol=8.339517e+06
assign (segid " A" and resid 28 and name HA) (segid " A" and resid 31 and name HN) 3.419 1.461 1.461 weight 1.000 ! spec=Expt_40, no=562, id=469, vol=6.181005e+06
assign (segid " A" and resid 31 and name HA) (segid " A" and resid 34 and name HN) 3.190 1.272 1.272 weight 1.000 ! spec=Expt_40, no=565, id=471, vol=6.616686e+06
assign (segid " A" and resid 24 and name HA) (segid " A" and resid 24 and name HB1) 3.056 1.168 1.168 weight 1.000 ! spec=Expt_40, no=566, id=472, vol=1.089531e+07
assign (segid " A" and resid 15 and name HG2) (segid " A" and resid 15 and name HB1) 2.940 1.080 1.080 weight 1.000 ! spec=Expt_40, no=571, id=475, vol=1.458372e+07
assign (segid " A" and resid 16 and name HB2) (segid " A" and resid 16 and name HB1) 2.127 0.566 0.566 weight 1.000 ! spec=Expt_40, no=573, id=477, vol=4.167389e+07
assign (segid " A" and resid 20 and name HB1) (segid " A" and resid 20 and name HB2) 2.048 0.524 0.524 weight 1.000 ! spec=Expt_40, no=576, id=479, vol=6.176707e+07
assign (segid " A" and resid 4 and name HD2) (segid " A" and resid 4 and name HD1) 2.398 0.719 0.719 weight 1.000 ! spec=Expt_40, no=603, id=500, vol=2.330342e+07
assign (segid " A" and resid 4 and name HG1) (segid " A" and resid 4 and name HD1) 2.540 0.806 0.806 weight 1.000 ! spec=Expt_40, no=604, id=501, vol=2.728224e+07
assign (segid " A" and resid 4 and name HB1) (segid " A" and resid 4 and name HB2) 2.218 0.615 0.615 weight 1.000 ! spec=Expt_40, no=607, id=504, vol=3.733259e+07
assign (segid " A" and resid 4 and name HG1) (segid " A" and resid 4 and name HB2) 2.809 0.986 0.986 weight 1.000 ! spec=Expt_40, no=608, id=505, vol=2.101401e+07
assign (segid " A" and resid 16 and name HA) (segid " A" and resid 16 and name HB1) 2.702 0.913 0.913 weight 1.000 ! spec=Expt_40, no=617, id=514, vol=2.016322e+07
assign (segid " A" and resid 6 and name HA) (segid " A" and resid 6 and name HB) 2.284 0.652 0.652 weight 1.000 ! spec=Expt_40, no=621, id=518, vol=4.687464e+07
assign (segid " A" and resid 3 and name HA) (segid " A" and resid 3 and name HB) 2.749 0.944 0.944 weight 1.000 ! spec=Expt_40, no=622, id=519, vol=1.630290e+07
assign (segid " A" and resid 27 and name HN) (segid " A" and resid 28 and name HN) 2.835 1.004 1.004 weight 1.000 ! spec=Expt_41, no=22, id=538, vol=1.662830e+07
assign (segid " A" and resid 27 and name HE1) (segid " A" and resid 4 and name HN) 3.326 1.383 1.383 weight 1.000 ! spec=Expt_41, no=24, id=540, vol=1.100731e+07
or (segid " A" and resid 27 and name HE2) (segid " A" and resid 4 and name HN)
assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 21 and name HN) 3.438 1.477 1.477 weight 1.000 ! spec=Expt_41, no=27, id=543, vol=9.264230e+06
or (segid " A" and resid 20 and name HD2) (segid " A" and resid 21 and name HN)
assign (segid " A" and resid 19 and name HN) (segid " A" and resid 20 and name HN) 3.087 1.191 1.191 weight 1.000 ! spec=Expt_41, no=44, id=558, vol=1.103114e+07
assign (segid " A" and resid 27 and name HN) (segid " A" and resid 27 and name HD1) 3.521 1.550 1.550 weight 1.000 ! spec=Expt_41, no=47, id=561, vol=1.569015e+07
or (segid " A" and resid 27 and name HN) (segid " A" and resid 27 and name HD2)
assign (segid " A" and resid 21 and name HE22) (segid " A" and resid 21 and name HE21) 1.577 0.311 0.311 weight 1.000 ! spec=Expt_41, no=54, id=568, vol=2.791126e+08
assign (segid " A" and resid 11 and name HD22) (segid " A" and resid 11 and name HD21) 1.678 0.352 0.352 weight 1.000 ! spec=Expt_41, no=55, id=569, vol=2.352689e+08
assign (segid " A" and resid 28 and name HE21) (segid " A" and resid 28 and name HE22) 1.592 0.317 0.317 weight 1.000 ! spec=Expt_41, no=56, id=570, vol=2.798399e+08
assign (segid " A" and resid 27 and name HD1) (segid " A" and resid 27 and name HE1) 1.951 0.476 0.476 weight 1.000 ! spec=Expt_41, no=59, id=572, vol=1.180912e+08
or (segid " A" and resid 27 and name HD1) (segid " A" and resid 27 and name HE2)
or (segid " A" and resid 27 and name HD2) (segid " A" and resid 27 and name HE1)
or (segid " A" and resid 27 and name HD2) (segid " A" and resid 27 and name HE2)
assign (segid " A" and resid 34 and name HD1) (segid " A" and resid 34 and name HE1) 1.849 0.427 0.427 weight 1.000 ! spec=Expt_41, no=62, id=574, vol=1.714970e+08
or (segid " A" and resid 34 and name HD1) (segid " A" and resid 34 and name HE2)
or (segid " A" and resid 34 and name HD2) (segid " A" and resid 34 and name HE1)
or (segid " A" and resid 34 and name HD2) (segid " A" and resid 34 and name HE2)
assign (segid " A" and resid 31 and name HN) (segid " A" and resid 31 and name HA) 2.811 0.988 0.988 weight 1.000 ! spec=Expt_41, no=82, id=586, vol=1.965008e+07
assign (segid " A" and resid 5 and name HB1) (segid " A" and resid 5 and name HA) 2.562 0.820 0.820 weight 1.000 ! spec=Expt_41, no=93, id=596, vol=2.659734e+07
assign (segid " A" and resid 13 and name HG23) (segid " A" and resid 13 and name HA) 1.994 0.497 0.497 weight 1.000 ! spec=Expt_41, no=95, id=598, vol=7.485365e+07
or (segid " A" and resid 13 and name HG21) (segid " A" and resid 13 and name HA)
or (segid " A" and resid 13 and name HG22) (segid " A" and resid 13 and name HA)
assign (segid " A" and resid 1 and name HA) (segid " A" and resid 2 and name HD1) 2.385 0.711 0.711 weight 1.000 ! spec=Expt_41, no=96, id=599, vol=3.911434e+07
assign (segid " A" and resid 28 and name HG1) (segid " A" and resid 28 and name HE22) 3.898 1.900 1.900 weight 1.000 ! spec=Expt_41, no=102, id=604, vol=1.072337e+07
assign (segid " A" and resid 28 and name HG1) (segid " A" and resid 28 and name HE21) 3.023 1.143 1.143 weight 1.000 ! spec=Expt_41, no=106, id=608, vol=6.851100e+06
assign (segid " A" and resid 2 and name HB1) (segid " A" and resid 2 and name HA) 3.145 1.236 1.236 weight 1.000 ! spec=Expt_41, no=126, id=627, vol=1.476567e+07
assign (segid " A" and resid 1 and name HD2) (segid " A" and resid 0 and name HA1) 2.414 0.507 0.507 weight 1.000 ! spec=Expt_41, no=127, id=628, vol=6.084082e+07
or (segid " A" and resid 1 and name HD2) (segid " A" and resid 0 and name HA2)
or (segid " A" and resid 1 and name HD2) (segid " A" and resid 0 and name HA3)
assign (segid " A" and resid 1 and name HD1) (segid " A" and resid 0 and name HA1) 2.202 0.552 0.552 weight 1.000 ! spec=Expt_41, no=128, id=629, vol=7.156329e+07
or (segid " A" and resid 1 and name HD1) (segid " A" and resid 0 and name HA2)
or (segid " A" and resid 1 and name HD1) (segid " A" and resid 0 and name HA3)
assign (segid " A" and resid 1 and name HD2) (segid " A" and resid 1 and name HG1) 3.404 1.448 1.448 weight 1.000 ! spec=Expt_41, no=131, id=631, vol=1.540119e+07
assign (segid " A" and resid 1 and name HD1) (segid " A" and resid 1 and name HG1) 2.718 0.924 0.924 weight 1.000 ! spec=Expt_41, no=133, id=633, vol=1.730931e+07
assign (segid " A" and resid 1 and name HA) (segid " A" and resid 0 and name HA1) 3.784 0.969 0.969 weight 1.000 ! spec=Expt_41, no=137, id=637, vol=6.970672e+06
or (segid " A" and resid 1 and name HA) (segid " A" and resid 0 and name HA2)
assign (segid " A" and resid 1 and name HA) (segid " A" and resid 1 and name HB2) 2.485 0.772 0.772 weight 1.000 ! spec=Expt_41, no=138, id=638, vol=2.597987e+07
assign (segid " A" and resid 1 and name HG2) (segid " A" and resid 1 and name HD2) 2.842 1.009 1.009 weight 1.000 ! spec=Expt_41, no=140, id=640, vol=1.294116e+07
assign (segid " A" and resid 1 and name HG2) (segid " A" and resid 1 and name HD1) 3.149 1.240 1.240 weight 1.000 ! spec=Expt_41, no=141, id=641, vol=1.417565e+07
assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HB2) 2.876 0.766 0.766 weight 1.000 ! spec=Expt_41, no=158, id=655, vol=4.350225e+07
assign (segid " A" and resid 18 and name HN) (segid " A" and resid 18 and name HB3) 2.045 0.523 0.523 weight 1.000 ! spec=Expt_41, no=160, id=657, vol=1.066620e+08
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 HB2)
assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD21) 3.156 1.245 1.245 weight 1.000 ! spec=Expt_41, no=161, id=658, vol=2.687456e+07
or (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD23)
or (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD22)
assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD13) 3.050 1.162 1.162 weight 1.000 ! spec=Expt_41, no=162, id=659, vol=2.540146e+07
or (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD11)
or (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD12)
assign (segid " A" and resid 26 and name HN) (segid " A" and resid 23 and name HA) 3.196 1.276 1.276 weight 1.000 ! spec=Expt_41, no=164, id=661, vol=1.298331e+07
assign (segid " A" and resid 27 and name HD1) (segid " A" and resid 27 and name HA) 2.716 0.922 0.922 weight 1.000 ! spec=Expt_41, no=166, id=663, vol=2.861059e+07
or (segid " A" and resid 27 and name HD2) (segid " A" and resid 27 and name HA)
assign (segid " A" and resid 33 and name HN) (segid " A" and resid 30 and name HA) 3.191 1.273 1.273 weight 1.000 ! spec=Expt_41, no=172, id=667, vol=1.176970e+07
assign (segid " A" and resid 12 and name HN) (segid " A" and resid 12 and name HA) 2.654 0.880 0.880 weight 1.000 ! spec=Expt_41, no=174, id=669, vol=3.063616e+07
assign (segid " A" and resid 21 and name HN) (segid " A" and resid 18 and name HA) 2.997 1.123 1.123 weight 1.000 ! spec=Expt_41, no=177, id=672, vol=1.747054e+07
assign (segid " A" and resid 25 and name HN) (segid " A" and resid 22 and name HA) 3.049 1.162 1.162 weight 1.000 ! spec=Expt_41, no=180, id=675, vol=1.378689e+07
assign (segid " A" and resid 19 and name HN) (segid " A" and resid 16 and name HA) 2.860 1.022 1.022 weight 1.000 ! spec=Expt_41, no=187, id=679, vol=2.015938e+07
assign (segid " A" and resid 34 and name HD1) (segid " A" and resid 34 and name HA) 2.594 0.841 0.841 weight 1.000 ! spec=Expt_41, no=190, id=682, vol=4.396208e+07
or (segid " A" and resid 34 and name HD2) (segid " A" and resid 34 and name HA)
assign (segid " A" and resid 33 and name HN) (segid " A" and resid 32 and name HA) 3.009 1.132 1.132 weight 1.000 ! spec=Expt_41, no=194, id=686, vol=1.742865e+07
assign (segid " A" and resid 27 and name HN) (segid " A" and resid 24 and name HA) 3.034 1.150 1.150 weight 1.000 ! spec=Expt_41, no=201, id=693, vol=1.384766e+07
assign (segid " A" and resid 1 and name HA) (segid " A" and resid 34 and name HD1) 3.017 1.137 1.137 weight 1.000 ! spec=Expt_41, no=211, id=703, vol=1.316885e+07
or (segid " A" and resid 1 and name HA) (segid " A" and resid 34 and name HD2)
assign (segid " A" and resid 34 and name HE1) (segid " A" and resid 1 and name HA) 2.929 1.073 1.073 weight 1.000 ! spec=Expt_41, no=212, id=704, vol=1.397521e+07
or (segid " A" and resid 34 and name HE2) (segid " A" and resid 1 and name HA)
assign (segid " A" and resid 27 and name HD1) (segid " A" and resid 27 and name HB1) 2.592 0.840 0.840 weight 1.000 ! spec=Expt_41, no=213, id=705, vol=3.263103e+07
or (segid " A" and resid 27 and name HD2) (segid " A" and resid 27 and name HB1)
assign (segid " A" and resid 27 and name HD1) (segid " A" and resid 27 and name HB2) 2.483 0.770 0.770 weight 1.000 ! spec=Expt_41, no=216, id=708, vol=4.020409e+07
or (segid " A" and resid 27 and name HD2) (segid " A" and resid 27 and name HB2)
assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 20 and name HB2) 2.638 0.870 0.870 weight 1.000 ! spec=Expt_41, no=220, id=711, vol=2.878929e+07
or (segid " A" and resid 20 and name HD2) (segid " A" and resid 20 and name HB2)
assign (segid " A" and resid 27 and name HD1) (segid " A" and resid 4 and name HA) 2.644 0.874 0.874 weight 1.000 ! spec=Expt_41, no=225, id=715, vol=2.972839e+07
or (segid " A" and resid 27 and name HD2) (segid " A" and resid 4 and name HA)
assign (segid " A" and resid 27 and name HE1) (segid " A" and resid 4 and name HA) 3.029 1.147 1.147 weight 1.000 ! spec=Expt_41, no=226, id=716, vol=1.681606e+07
or (segid " A" and resid 27 and name HE2) (segid " A" and resid 4 and name HA)
assign (segid " A" and resid 34 and name HD1) (segid " A" and resid 34 and name HB1) 2.386 0.712 0.712 weight 1.000 ! spec=Expt_41, no=230, id=718, vol=5.255652e+07
or (segid " A" and resid 34 and name HD2) (segid " A" and resid 34 and name HB1)
assign (segid " A" and resid 28 and name HN) (segid " A" and resid 28 and name HG1) 2.702 0.913 0.913 weight 1.000 ! spec=Expt_41, no=240, id=725, vol=1.689662e+07
assign (segid " A" and resid 21 and name HN) (segid " A" and resid 21 and name HG2) 2.486 0.772 0.772 weight 1.000 ! spec=Expt_41, no=246, id=730, vol=4.178533e+07
assign (segid " A" and resid 21 and name HG2) (segid " A" and resid 20 and name HD1) 3.273 1.339 1.339 weight 1.000 ! spec=Expt_41, no=249, id=733, vol=1.151229e+07
or (segid " A" and resid 21 and name HG2) (segid " A" and resid 20 and name HD2)
assign (segid " A" and resid 30 and name HN) (segid " A" and resid 30 and name HB2) 2.772 0.960 0.960 weight 1.000 ! spec=Expt_41, no=254, id=737, vol=2.049390e+07
assign (segid " A" and resid 15 and name HN) (segid " A" and resid 14 and name HB2) 2.903 1.054 1.054 weight 1.000 ! spec=Expt_41, no=259, id=738, vol=1.298327e+07
assign (segid " A" and resid 22 and name HN) (segid " A" and resid 21 and name HB2) 2.977 1.108 1.108 weight 1.000 ! spec=Expt_41, no=260, id=739, vol=1.355760e+07
assign (segid " A" and resid 21 and name HN) (segid " A" and resid 21 and name HB2) 2.576 0.830 0.830 weight 1.000 ! spec=Expt_41, no=261, id=740, vol=2.250907e+07
assign (segid " A" and resid 22 and name HN) (segid " A" and resid 21 and name HB1) 3.559 1.583 1.583 weight 1.000 ! spec=Expt_41, no=266, id=744, vol=1.193604e+07
assign (segid " A" and resid 16 and name HN) (segid " A" and resid 15 and name HB2) 3.872 1.874 1.874 weight 1.000 ! spec=Expt_41, no=268, id=746, vol=1.208289e+07
assign (segid " A" and resid 27 and name HE1) (segid " A" and resid 2 and name HB1) 2.938 1.079 1.079 weight 1.000 ! spec=Expt_41, no=269, id=747, vol=1.218211e+07
or (segid " A" and resid 27 and name HE2) (segid " A" and resid 2 and name HB1)
assign (segid " A" and resid 27 and name HD1) (segid " A" and resid 2 and name HB1) 2.543 0.808 0.808 weight 1.000 ! spec=Expt_41, no=270, id=748, vol=2.820786e+07
or (segid " A" and resid 27 and name HD2) (segid " A" and resid 2 and name HB1)
assign (segid " A" and resid 34 and name HE1) (segid " A" and resid 0 and name HA1) 3.327 0.899 0.99 weight 1.000 ! spec=Expt_41, no=271, id=749, vol=2.526997e+07
or (segid " A" and resid 34 and name HE1) (segid " A" and resid 0 and name HA2)
or (segid " A" and resid 34 and name HE1) (segid " A" and resid 0 and name HA3)
or (segid " A" and resid 34 and name HE2) (segid " A" and resid 0 and name HA1)
or (segid " A" and resid 34 and name HE2) (segid " A" and resid 0 and name HA2)
or (segid " A" and resid 34 and name HE2) (segid " A" and resid 0 and name HA3)
assign (segid " A" and resid 16 and name HN) (segid " A" and resid 16 and name HB2) 2.806 0.785 0.785 weight 1.000 ! spec=Expt_41, no=272, id=750, vol=2.529209e+07
assign (segid " A" and resid 28 and name HN) (segid " A" and resid 28 and name HB2) 2.501 0.782 0.782 weight 1.000 ! spec=Expt_41, no=276, id=754, vol=2.636489e+07
assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 5 and name HB2) 2.863 1.025 1.025 weight 1.000 ! spec=Expt_41, no=277, id=755, vol=2.092512e+07
or (segid " A" and resid 20 and name HD2) (segid " A" and resid 5 and name HB2)
assign (segid " A" and resid 20 and name HN) (segid " A" and resid 19 and name HB2) 2.857 1.020 1.020 weight 1.000 ! spec=Expt_41, no=279, id=757, vol=1.315939e+07
assign (segid " A" and resid 26 and name HB2) (segid " A" and resid 27 and name HN) 2.900 1.051 1.051 weight 1.000 ! spec=Expt_41, no=280, id=758, vol=1.282680e+07
assign (segid " A" and resid 30 and name HN) (segid " A" and resid 29 and name HB1) 3.529 1.556 1.556 weight 1.000 ! spec=Expt_41, no=289, id=764, vol=1.523527e+07
assign (segid " A" and resid 16 and name HN) (segid " A" and resid 16 and name HB1) 2.765 0.956 0.956 weight 1.000 ! spec=Expt_41, no=291, id=766, vol=1.908185e+07
assign (segid " A" and resid 27 and name HE1) (segid " A" and resid 2 and name HG2) 3.124 1.220 1.220 weight 1.000 ! spec=Expt_41, no=292, id=767, vol=1.205930e+07
or (segid " A" and resid 27 and name HE2) (segid " A" and resid 2 and name HG2)
assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 5 and name HG2) 3.356 1.408 1.408 weight 1.000 ! spec=Expt_41, no=294, id=768, vol=1.183288e+07
or (segid " A" and resid 20 and name HD2) (segid " A" and resid 5 and name HG2)
assign (segid " A" and resid 7 and name HN) (segid " A" and resid 7 and name HB1) 2.466 0.760 0.760 weight 1.000 ! spec=Expt_41, no=295, id=769, vol=2.731680e+07
assign (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HB1) 2.834 0.867 0.867 weight 1.000 ! spec=Expt_41, no=297, id=771, vol=2.180620e+07
assign (segid " A" and resid 23 and name HN) (segid " A" and resid 22 and name HB2) 2.346 0.688 0.688 weight 1.000 ! spec=Expt_41, no=298, id=772, vol=5.279494e+07
or (segid " A" and resid 23 and name HN) (segid " A" and resid 22 and name HB1)
or (segid " A" and resid 23 and name HN) (segid " A" and resid 22 and name HB3)
assign (segid " A" and resid 22 and name HN) (segid " A" and resid 22 and name HB2) 1.930 0.465 0.465 weight 1.000 ! spec=Expt_41, no=299, id=773, vol=9.003594e+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 33 and name HN) (segid " A" and resid 32 and name HB3) 2.248 0.631 0.631 weight 1.000 ! spec=Expt_41, no=302, id=775, vol=4.377230e+07
or (segid " A" and resid 33 and name HN) (segid " A" and resid 32 and name HB1)
or (segid " A" and resid 33 and name HN) (segid " A" and resid 32 and name HB2)
assign (segid " A" and resid 32 and name HN) (segid " A" and resid 32 and name HB3) 2.082 0.542 0.542 weight 1.000 ! spec=Expt_41, no=305, id=778, vol=1.074452e+08
or (segid " A" and resid 32 and name HN) (segid " A" and resid 32 and name HB1)
or (segid " A" and resid 32 and name HN) (segid " A" and resid 32 and name HB2)
assign (segid " A" and resid 26 and name HN) (segid " A" and resid 25 and name HB1) 2.446 0.748 0.748 weight 1.000 ! spec=Expt_41, no=307, id=779, vol=5.367843e+07
or (segid " A" and resid 26 and name HN) (segid " A" and resid 25 and name HB2)
or (segid " A" and resid 26 and name HN) (segid " A" and resid 25 and name HB3)
assign (segid " A" and resid 25 and name HN) (segid " A" and resid 25 and name HB1) 1.957 0.479 0.479 weight 1.000 ! spec=Expt_41, no=308, id=780, vol=9.162731e+07
or (segid " A" and resid 25 and name HN) (segid " A" and resid 25 and name HB2)
or (segid " A" and resid 25 and name HN) (segid " A" and resid 25 and name HB3)
assign (segid " A" and resid 19 and name HN) (segid " A" and resid 18 and name HB3) 2.446 0.748 0.748 weight 1.000 ! spec=Expt_41, no=310, id=782, vol=4.360656e+07
or (segid " A" and resid 19 and name HN) (segid " A" and resid 18 and name HB1)
or (segid " A" and resid 19 and name HN) (segid " A" and resid 18 and name HB2)
assign (segid " A" and resid 13 and name HN) (segid " A" and resid 13 and name HG23) 2.018 0.509 0.509 weight 1.000 ! spec=Expt_41, no=314, id=785, vol=7.178056e+07
or (segid " A" and resid 13 and name HN) (segid " A" and resid 13 and name HG21)
or (segid " A" and resid 13 and name HN) (segid " A" and resid 13 and name HG22)
assign (segid " A" and resid 12 and name HN) (segid " A" and resid 12 and name HB1) 1.947 0.474 0.474 weight 1.000 ! spec=Expt_41, no=315, id=786, vol=9.337473e+07
or (segid " A" and resid 12 and name HN) (segid " A" and resid 12 and name HB2)
or (segid " A" and resid 12 and name HN) (segid " A" and resid 12 and name HB3)
assign (segid " A" and resid 13 and name HN) (segid " A" and resid 12 and name HB1) 2.350 0.690 0.690 weight 1.000 ! spec=Expt_41, no=317, id=788, vol=4.351436e+07
or (segid " A" and resid 13 and name HN) (segid " A" and resid 12 and name HB2)
or (segid " A" and resid 13 and name HN) (segid " A" and resid 12 and name HB3)
assign (segid " A" and resid 6 and name HN) (segid " A" and resid 6 and name HG23) 2.825 0.797 0.797 weight 1.000 ! spec=Expt_41, no=319, id=790, vol=1.852071e+07
or (segid " A" and resid 6 and name HN) (segid " A" and resid 6 and name HG22)
or (segid " A" and resid 6 and name HN) (segid " A" and resid 6 and name HG21)
assign (segid " A" and resid 7 and name HN) (segid " A" and resid 6 and name HG23) 2.823 0.618 0.618 weight 1.000 ! spec=Expt_41, no=320, id=791, vol=3.662492e+07
or (segid " A" and resid 7 and name HN) (segid " A" and resid 6 and name HG22)
or (segid " A" and resid 7 and name HN) (segid " A" and resid 6 and name HG21)
assign (segid " A" and resid 3 and name HN) (segid " A" and resid 3 and name HG21) 3.330 1.387 1.387 weight 1.000 ! spec=Expt_41, no=321, id=792, vol=1.442041e+07
or (segid " A" and resid 3 and name HN) (segid " A" and resid 3 and name HG22)
or (segid " A" and resid 3 and name HN) (segid " A" and resid 3 and name HG23)
assign (segid " A" and resid 4 and name HN) (segid " A" and resid 3 and name HG21) 2.298 0.660 0.660 weight 1.000 ! spec=Expt_41, no=322, id=793, vol=3.605564e+07
or (segid " A" and resid 4 and name HN) (segid " A" and resid 3 and name HG22)
or (segid " A" and resid 4 and name HN) (segid " A" and resid 3 and name HG23)
assign (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HD21) 3.068 1.177 1.177 weight 1.000 ! spec=Expt_41, no=325, id=796, vol=2.440872e+07
or (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HD22)
or (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HD23)
assign (segid " A" and resid 28 and name HN) (segid " A" and resid 24 and name HD21) 3.013 1.135 1.135 weight 1.000 ! spec=Expt_41, no=326, id=797, vol=1.241238e+07
or (segid " A" and resid 28 and name HN) (segid " A" and resid 24 and name HD22)
or (segid " A" and resid 28 and name HN) (segid " A" and resid 24 and name HD23)
assign (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HD21) 3.312 1.211 1.211 weight 1.000 ! spec=Expt_41, no=327, id=798, vol=1.448921e+07
or (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HD22)
or (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HD23)
assign (segid " A" and resid 28 and name HE21) (segid " A" and resid 24 and name HD21) 3.370 0.902 0.902 weight 1.000 ! spec=Expt_41, no=328, id=799, vol=1.974161e+07
or (segid " A" and resid 28 and name HE21) (segid " A" and resid 24 and name HD22)
or (segid " A" and resid 28 and name HE21) (segid " A" and resid 24 and name HD23)
assign (segid " A" and resid 27 and name HD1) (segid " A" and resid 31 and name HD21) 2.880 0.594 0.594 weight 1.000 ! spec=Expt_41, no=329, id=800, vol=8.258516e+07
or (segid " A" and resid 27 and name HD1) (segid " A" and resid 31 and name HD22)
or (segid " A" and resid 27 and name HD1) (segid " A" and resid 31 and name HD23)
or (segid " A" and resid 27 and name HD2) (segid " A" and resid 31 and name HD21)
or (segid " A" and resid 27 and name HD2) (segid " A" and resid 31 and name HD22)
or (segid " A" and resid 27 and name HD2) (segid " A" and resid 31 and name HD23)
assign (segid " A" and resid 31 and name HN) (segid " A" and resid 31 and name HD21) 3.365 1.026 1.026 weight 1.000 ! spec=Expt_41, no=331, id=802, vol=2.487835e+07
or (segid " A" and resid 31 and name HN) (segid " A" and resid 31 and name HD22)
or (segid " A" and resid 31 and name HN) (segid " A" and resid 31 and name HD23)
assign (segid " A" and resid 27 and name HE1) (segid " A" and resid 31 and name HD21) 2.810 0.5456 0.5456 weight 1.000 ! spec=Expt_41, no=333, id=804, vol=4.978103e+07
or (segid " A" and resid 27 and name HE1) (segid " A" and resid 31 and name HD22)
or (segid " A" and resid 27 and name HE1) (segid " A" and resid 31 and name HD23)
or (segid " A" and resid 27 and name HE2) (segid " A" and resid 31 and name HD21)
or (segid " A" and resid 27 and name HE2) (segid " A" and resid 31 and name HD22)
or (segid " A" and resid 27 and name HE2) (segid " A" and resid 31 and name HD23)
assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HA) 2.607 0.849 0.849 weight 1.000 ! spec=Expt_41, no=350, id=821, vol=3.426706e+07
assign (segid " A" and resid 13 and name HA) (segid " A" and resid 13 and name HB) 2.747 0.944 0.944 weight 1.000 ! spec=Expt_41, no=440, id=905, vol=2.004402e+07
assign (segid " A" and resid 1 and name HA) (segid " A" and resid 2 and name HD2) 2.420 0.732 0.732 weight 1.000 ! spec=Expt_41, no=457, id=922, vol=3.736355e+07
assign (segid " A" and resid 34 and name HA) (segid " A" and resid 34 and name HB1) 3.146 1.237 1.237 weight 1.000 ! spec=Expt_41, no=458, id=923, vol=2.034274e+07
assign (segid " A" and resid 27 and name HA) (segid " A" and resid 27 and name HB2) 2.751 0.946 0.946 weight 1.000 ! spec=Expt_41, no=469, id=934, vol=2.018225e+07
assign (segid " A" and resid 8 and name HA) (segid " A" and resid 8 and name HB2) 2.505 0.784 0.784 weight 1.000 ! spec=Expt_41, no=475, id=938, vol=3.567812e+07
assign (segid " A" and resid 14 and name HB1) (segid " A" and resid 14 and name HA) 2.666 0.889 0.889 weight 1.000 ! spec=Expt_41, no=479, id=942, vol=2.307975e+07
assign (segid " A" and resid 16 and name HA) (segid " A" and resid 19 and name HB2) 2.744 0.941 0.941 weight 1.000 ! spec=Expt_41, no=484, id=947, vol=1.641944e+07
assign (segid " A" and resid 26 and name HB1) (segid " A" and resid 26 and name HA) 2.303 0.663 0.663 weight 1.000 ! spec=Expt_41, no=490, id=953, vol=5.261502e+07
assign (segid " A" and resid 17 and name HB2) (segid " A" and resid 14 and name HA) 3.057 1.168 1.168 weight 1.000 ! spec=Expt_41, no=494, id=957, vol=1.224661e+07
assign (segid " A" and resid 18 and name HB3) (segid " A" and resid 18 and name HA) 1.793 0.402 0.402 weight 1.000 ! spec=Expt_41, no=495, id=958, vol=1.380249e+08
or (segid " A" and resid 18 and name HB1) (segid " A" and resid 18 and name HA)
or (segid " A" and resid 18 and name HB2) (segid " A" and resid 18 and name HA)
assign (segid " A" and resid 17 and name HB2) (segid " A" and resid 17 and name HA) 2.657 0.882 0.882 weight 1.000 ! spec=Expt_41, no=499, id=962, vol=2.251053e+07
assign (segid " A" and resid 26 and name HG2) (segid " A" and resid 26 and name HA) 2.827 0.514 0.514 weight 1.000 ! spec=Expt_41, no=501, id=963, vol=1.522877e+08
or (segid " A" and resid 26 and name HG1) (segid " A" and resid 26 and name HA)
assign (segid " A" and resid 15 and name HN) (segid " A" and resid 14 and name HD1) 3.892 1.893 1.893 weight 1.000 ! spec=Expt_41, no=503, id=965, vol=8.365236e+06
assign (segid " A" and resid 2 and name HB2) (segid " A" and resid 3 and name HN) 3.785 1.791 1.791 weight 1.000 ! spec=Expt_41, no=512, id=973, vol=9.273707e+06
assign (segid " A" and resid 15 and name HG2) (segid " A" and resid 15 and name HN) 4.406 2.427 2.427 weight 1.000 ! spec=Expt_41, no=515, id=976, vol=6.848619e+06
assign (segid " A" and resid 14 and name HG2) (segid " A" and resid 14 and name HD1) 2.612 0.853 0.853 weight 1.000 ! spec=Expt_41, no=517, id=978, vol=1.999937e+07
assign (segid " A" and resid 14 and name HD1) (segid " A" and resid 13 and name HG23) 3.261 1.330 1.330 weight 1.000 ! spec=Expt_41, no=519, id=980, vol=1.734297e+07
or (segid " A" and resid 14 and name HD1) (segid " A" and resid 13 and name HG21)
or (segid " A" and resid 14 and name HD1) (segid " A" and resid 13 and name HG22)
assign (segid " A" and resid 14 and name HD2) (segid " A" and resid 13 and name HG23) 3.155 1.244 1.244 weight 1.000 ! spec=Expt_41, no=520, id=981, vol=1.832322e+07
or (segid " A" and resid 14 and name HD2) (segid " A" and resid 13 and name HG21)
or (segid " A" and resid 14 and name HD2) (segid " A" and resid 13 and name HG22)
assign (segid " A" and resid 6 and name HB) (segid " A" and resid 6 and name HG23) 1.873 0.439 0.439 weight 1.000 ! spec=Expt_41, no=521, id=982, vol=9.687602e+07
or (segid " A" and resid 6 and name HB) (segid " A" and resid 6 and name HG22)
or (segid " A" and resid 6 and name HB) (segid " A" and resid 6 and name HG21)
assign (segid " A" and resid 3 and name HB) (segid " A" and resid 3 and name HG21) 1.924 0.463 0.463 weight 1.000 ! spec=Expt_41, no=522, id=983, vol=8.937722e+07
or (segid " A" and resid 3 and name HB) (segid " A" and resid 3 and name HG22)
or (segid " A" and resid 3 and name HB) (segid " A" and resid 3 and name HG23)
assign (segid " A" and resid 24 and name HA) (segid " A" and resid 24 and name HD21) 1.990 0.495 0.495 weight 1.000 ! spec=Expt_41, no=523, id=984, vol=6.498695e+07
or (segid " A" and resid 24 and name HA) (segid " A" and resid 24 and name HD22)
or (segid " A" and resid 24 and name HA) (segid " A" and resid 24 and name HD23)
assign (segid " A" and resid 31 and name HA) (segid " A" and resid 31 and name HD21) 2.823 0.8511 0.811 weight 1.000 ! spec=Expt_41, no=524, id=985, vol=5.955529e+07
or (segid " A" and resid 31 and name HA) (segid " A" and resid 31 and name HD22)
or (segid " A" and resid 31 and name HA) (segid " A" and resid 31 and name HD23)
assign (segid " A" and resid 28 and name HA) (segid " A" and resid 31 and name HD21) 3.341 1.082 1.082 weight 1.000 ! spec=Expt_41, no=526, id=987, vol=1.786031e+07
or (segid " A" and resid 28 and name HA) (segid " A" and resid 31 and name HD22)
or (segid " A" and resid 28 and name HA) (segid " A" and resid 31 and name HD23)
assign (segid " A" and resid 21 and name HA) (segid " A" and resid 24 and name HD13) 3.207 1.285 1.285 weight 1.000 ! spec=Expt_41, no=528, id=989, vol=1.052504e+07
or (segid " A" and resid 21 and name HA) (segid " A" and resid 24 and name HD12)
or (segid " A" and resid 21 and name HA) (segid " A" and resid 24 and name HD11)
assign (segid " A" and resid 31 and name HA) (segid " A" and resid 31 and name HD11) 2.515 0.790 0.790 weight 1.000 ! spec=Expt_41, no=529, id=990, vol=1.825556e+07
or (segid " A" and resid 31 and name HA) (segid " A" and resid 31 and name HD13)
or (segid " A" and resid 31 and name HA) (segid " A" and resid 31 and name HD12)
assign (segid " A" and resid 1 and name HA) (segid " A" and resid 1 and name HB1) 3.070 1.178 1.178 weight 1.000 ! spec=Expt_41, no=531, id=992, vol=1.987930e+07
assign (segid " A" and resid 7 and name HA) (segid " A" and resid 7 and name HB1) 2.873 1.032 1.032 weight 1.000 ! spec=Expt_41, no=534, id=994, vol=2.492201e+07
assign (segid " A" and resid 21 and name HA) (segid " A" and resid 24 and name HB1) 2.637 0.869 0.869 weight 1.000 ! spec=Expt_41, no=535, id=995, vol=2.072873e+07
assign (segid " A" and resid 3 and name HA) (segid " A" and resid 3 and name HG21) 2.130 0.567 0.567 weight 1.000 ! spec=Expt_41, no=541, id=1000, vol=5.925466e+07
or (segid " A" and resid 3 and name HA) (segid " A" and resid 3 and name HG22)
or (segid " A" and resid 3 and name HA) (segid " A" and resid 3 and name HG23)
assign (segid " A" and resid 14 and name HA) (segid " A" and resid 17 and name HD21) 2.353 0.692 0.692 weight 1.000 ! spec=Expt_41, no=542, id=1001, vol=3.778380e+07
or (segid " A" and resid 14 and name HA) (segid " A" and resid 17 and name HD23)
or (segid " A" and resid 14 and name HA) (segid " A" and resid 17 and name HD22)
assign (segid " A" and resid 17 and name HA) (segid " A" and resid 17 and name HD21) 2.965 1.099 1.099 weight 1.000 ! spec=Expt_41, no=543, id=1002, vol=2.330152e+07
or (segid " A" and resid 17 and name HA) (segid " A" and resid 17 and name HD23)
or (segid " A" and resid 17 and name HA) (segid " A" and resid 17 and name HD22)
assign (segid " A" and resid 17 and name HA) (segid " A" and resid 17 and name HD13) 2.029 0.515 0.515 weight 1.000 ! spec=Expt_41, no=544, id=1003, vol=6.680200e+07
or (segid " A" and resid 17 and name HA) (segid " A" and resid 17 and name HD11)
or (segid " A" and resid 17 and name HA) (segid " A" and resid 17 and name HD12)
assign (segid " A" and resid 22 and name HB2) (segid " A" and resid 22 and name HA) 1.881 0.442 0.442 weight 1.000 ! spec=Expt_41, no=547, id=1006, vol=1.149133e+08
or (segid " A" and resid 22 and name HB1) (segid " A" and resid 22 and name HA)
or (segid " A" and resid 22 and name HB3) (segid " A" and resid 22 and name HA)
assign (segid " A" and resid 13 and name HG23) (segid " A" and resid 13 and name HB) 1.963 0.482 0.482 weight 1.000 ! spec=Expt_41, no=549, id=1008, vol=6.213408e+07
or (segid " A" and resid 13 and name HG21) (segid " A" and resid 13 and name HB)
or (segid " A" and resid 13 and name HG22) (segid " A" and resid 13 and name HB)
assign (segid " A" and resid 14 and name HG2) (segid " A" and resid 13 and name HA) 4.236 2.242 2.242 weight 1.000 ! spec=Expt_41, no=550, id=1009, vol=1.008775e+07
assign (segid " A" and resid 8 and name HG2) (segid " A" and resid 8 and name HA) 3.227 1.302 1.302 weight 1.000 ! spec=Expt_41, no=556, id=1015, vol=1.511146e+07
assign (segid " A" and resid 13 and name HG23) (segid " A" and resid 12 and name HA) 3.398 1.443 1.443 weight 1.000 ! spec=Expt_41, no=558, id=1017, vol=1.664166e+07
or (segid " A" and resid 13 and name HG21) (segid " A" and resid 12 and name HA)
or (segid " A" and resid 13 and name HG22) (segid " A" and resid 12 and name HA)
assign (segid " A" and resid 12 and name HB1) (segid " A" and resid 12 and name HA) 1.988 0.494 0.494 weight 1.000 ! spec=Expt_41, no=571, id=1029, vol=6.814751e+07
or (segid " A" and resid 12 and name HB2) (segid " A" and resid 12 and name HA)
or (segid " A" and resid 12 and name HB3) (segid " A" and resid 12 and name HA)
assign (segid " A" and resid 14 and name HG2) (segid " A" and resid 14 and name HB1) 2.485 0.772 0.772 weight 1.000 ! spec=Expt_41, no=576, id=1032, vol=3.081924e+07
assign (segid " A" and resid 28 and name HG1) (segid " A" and resid 24 and name HD21) 2.548 0.812 0.812 weight 1.000 ! spec=Expt_41, no=580, id=1036, vol=1.126368e+07
or (segid " A" and resid 28 and name HG1) (segid " A" and resid 24 and name HD22)
or (segid " A" and resid 28 and name HG1) (segid " A" and resid 24 and name HD23)
assign (segid " A" and resid 28 and name HG2) (segid " A" and resid 24 and name HD21) 3.382 1.430 1.430 weight 1.000 ! spec=Expt_41, no=581, id=1037, vol=9.951443e+06
or (segid " A" and resid 28 and name HG2) (segid " A" and resid 24 and name HD22)
or (segid " A" and resid 28 and name HG2) (segid " A" and resid 24 and name HD23)
assign (segid " A" and resid 14 and name HB1) (segid " A" and resid 14 and name HD2) 3.864 1.867 1.867 weight 1.000 ! spec=Expt_41, no=588, id=1043, vol=1.054080e+07
assign (segid " A" and resid 14 and name HB1) (segid " A" and resid 14 and name HD1) 4.147 2.150 2.150 weight 1.000 ! spec=Expt_41, no=589, id=1044, vol=7.442449e+06
assign (segid " A" and resid 12 and name HN) (segid " A" and resid 11 and name HA) 2.730 0.931 0.931 weight 1.000 ! spec=Expt_41, no=591, id=1045, vol=2.737224e+07
assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 20 and name HA) 2.829 1.001 1.001 weight 1.000 ! spec=Expt_41, no=594, id=1048, vol=2.467988e+07
or (segid " A" and resid 20 and name HD2) (segid " A" and resid 20 and name HA)
assign (segid " A" and resid 13 and name HN) (segid " A" and resid 16 and name HB1) 3.993 1.119 1.119 weight 1.000 ! spec=Expt_41, no=601, id=1055, vol=1.047275e+07
assign (segid " A" and resid 11 and name HD21) (segid " A" and resid 8 and name HB1) 4.051 1.489 1.489 weight 1.000 ! spec=Expt_41, no=602, id=1056, vol=1.059406e+07
assign (segid " A" and resid 22 and name HN) (segid " A" and resid 21 and name HA) 3.327 1.384 1.384 weight 1.000 ! spec=Expt_41, no=604, id=1058, vol=1.049348e+07
assign (segid " A" and resid 21 and name HA) (segid " A" and resid 25 and name HN) 3.610 1.629 1.629 weight 1.000 ! spec=Expt_41, no=605, id=1059, vol=7.506580e+06
assign (segid " A" and resid 31 and name HA) (segid " A" and resid 32 and name HN) 3.400 1.445 1.445 weight 1.000 ! spec=Expt_41, no=608, id=1061, vol=8.786051e+06
assign (segid " A" and resid 21 and name HA) (segid " A" and resid 21 and name HB2) 2.963 1.097 1.097 weight 1.000 ! spec=Expt_41, no=619, id=1072, vol=2.395600e+07
assign (segid " A" and resid 23 and name HB1) (segid " A" and resid 23 and name HA) 3.008 1.131 1.131 weight 1.000 ! spec=Expt_41, no=625, id=1077, vol=1.328517e+07
assign (segid " A" and resid 26 and name HB2) (segid " A" and resid 23 and name HA) 3.009 1.131 1.131 weight 1.000 ! spec=Expt_41, no=631, id=1082, vol=1.221893e+07
assign (segid " A" and resid 15 and name HA) (segid " A" and resid 14 and name HB2) 3.439 1.478 1.478 weight 1.000 ! spec=Expt_41, no=634, id=1085, vol=7.178882e+06
assign (segid " A" and resid 14 and name HD1) (segid " A" and resid 14 and name HB2) 3.914 1.915 1.915 weight 1.000 ! spec=Expt_41, no=640, id=1090, vol=8.862004e+06
assign (segid " A" and resid 14 and name HD2) (segid " A" and resid 14 and name HB2) 3.330 1.386 1.386 weight 1.000 ! spec=Expt_41, no=641, id=1091, vol=6.954256e+06
assign (segid " A" and resid 15 and name HB2) (segid " A" and resid 15 and name HB1) 2.027 0.513 0.513 weight 1.000 ! spec=Expt_41, no=649, id=1099, vol=6.512785e+07
assign (segid " A" and resid 8 and name HB2) (segid " A" and resid 8 and name HB1) 2.158 0.582 0.582 weight 1.000 ! spec=Expt_41, no=652, id=1101, vol=4.580313e+07
assign (segid " A" and resid 8 and name HG1) (segid " A" and resid 8 and name HG2) 2.271 0.644 0.644 weight 1.000 ! spec=Expt_41, no=653, id=1102, vol=3.220199e+07
assign (segid " A" and resid 2 and name HB2) (segid " A" and resid 2 and name HB1) 2.221 0.617 0.617 weight 1.000 ! spec=Expt_41, no=656, id=1103, vol=3.261008e+07
assign (segid " A" and resid 28 and name HG1) (segid " A" and resid 28 and name HB2) 2.933 1.075 1.075 weight 1.000 ! spec=Expt_41, no=661, id=1108, vol=1.236637e+07
assign (segid " A" and resid 28 and name HG2) (segid " A" and resid 28 and name HB2) 3.025 1.143 1.143 weight 1.000 ! spec=Expt_41, no=662, id=1109, vol=1.174427e+07
assign (segid " A" and resid 14 and name HG2) (segid " A" and resid 14 and name HB2) 3.214 1.291 1.291 weight 1.000 ! spec=Expt_41, no=664, id=1111, vol=2.406479e+07
assign (segid " A" and resid 28 and name HG1) (segid " A" and resid 28 and name HB1) 3.481 1.514 1.514 weight 1.000 ! spec=Expt_41, no=669, id=1115, vol=1.181082e+07
assign (segid " A" and resid 34 and name HB2) (segid " A" and resid 34 and name HB1) 2.367 0.700 0.700 weight 1.000 ! spec=Expt_41, no=673, id=1119, vol=2.819839e+07
assign (segid " A" and resid 24 and name HA) (segid " A" and resid 24 and name HD13) 2.777 0.964 0.964 weight 1.000 ! spec=Expt_41, no=691, id=1133, vol=1.781781e+07
or (segid " A" and resid 24 and name HA) (segid " A" and resid 24 and name HD12)
or (segid " A" and resid 24 and name HA) (segid " A" and resid 24 and name HD11)
assign (segid " A" and resid 4 and name HA) (segid " A" and resid 4 and name HG1) 3.404 1.449 1.449 weight 1.000 ! spec=Expt_41, no=705, id=1144, vol=1.688726e+07
assign (segid " A" and resid 5 and name HB1) (segid " A" and resid 5 and name HB2) 2.238 0.626 0.626 weight 1.000 ! spec=Expt_41, no=707, id=1145, vol=3.626603e+07
assign (segid " A" and resid 14 and name HB2) (segid " A" and resid 14 and name HB1) 2.051 0.526 0.526 weight 1.000 ! spec=Expt_41, no=708, id=1146, vol=6.601747e+07
assign (segid " A" and resid 17 and name HB1) (segid " A" and resid 17 and name HA) 3.238 1.310 1.310 weight 1.000 ! spec=Expt_41, no=712, id=1150, vol=1.390209e+07
assign (segid " A" and resid 2 and name HD2) (segid " A" and resid 2 and name HG1) 2.890 1.044 1.044 weight 1.000 ! spec=Expt_41, no=714, id=1152, vol=1.380770e+07
assign (segid " A" and resid 2 and name HD2) (segid " A" and resid 31 and name HD21) 3.905 1.055 1.055 weight 1.000 ! spec=Expt_41, no=715, id=1153, vol=1.618193e+07
or (segid " A" and resid 2 and name HD2) (segid " A" and resid 31 and name HD22)
or (segid " A" and resid 2 and name HD2) (segid " A" and resid 31 and name HD23)
assign (segid " A" and resid 7 and name HN) (segid " A" and resid 7 and name HG2) 3.207 1.285 1.285 weight 1.000 ! spec=Expt_41, no=719, id=1157, vol=7.013243e+06
assign (segid " A" and resid 7 and name HN) (segid " A" and resid 7 and name HG1) 4.260 2.268 2.268 weight 1.000 ! spec=Expt_41, no=720, id=1158, vol=6.693418e+06
assign (segid " A" and resid 5 and name HD2) (segid " A" and resid 5 and name HG2) 3.189 1.271 1.271 weight 1.000 ! spec=Expt_41, no=722, id=1160, vol=1.731607e+07
assign (segid " A" and resid 7 and name HG1) (segid " A" and resid 7 and name HG2) 2.183 0.596 0.596 weight 1.000 ! spec=Expt_41, no=724, id=1162, vol=3.300599e+07
assign (segid " A" and resid 7 and name HG1) (segid " A" and resid 7 and name HE2) 3.038 1.154 1.154 weight 1.000 ! spec=Expt_41, no=725, id=1163, vol=9.359628e+06
assign (segid " A" and resid 7 and name HG2) (segid " A" and resid 7 and name HE2) 3.007 1.131 1.131 weight 1.000 ! spec=Expt_41, no=726, id=1164, vol=1.131819e+07
assign (segid " A" and resid 7 and name HG2) (segid " A" and resid 7 and name HA) 3.196 1.277 1.277 weight 1.000 ! spec=Expt_41, no=727, id=1165, vol=8.973814e+06
assign (segid " A" and resid 7 and name HE1) (segid " A" and resid 7 and name HG1) 3.537 1.564 1.564 weight 1.000 ! spec=Expt_41, no=729, id=1166, vol=5.901074e+06
assign (segid " A" and resid 7 and name HE1) (segid " A" and resid 7 and name HG2) 4.162 2.165 2.165 weight 1.000 ! spec=Expt_41, no=730, id=1167, vol=5.225141e+06
assign (segid " A" and resid 4 and name HA) (segid " A" and resid 4 and name HB1) 3.215 1.292 1.292 weight 1.000 ! spec=Expt_41, no=733, id=1170, vol=1.528404e+07
assign (segid " A" and resid 34 and name HB1) (segid " A" and resid 34 and name HE1) 3.555 1.580 1.580 weight 1.000 ! spec=Expt_41, no=735, id=1172, vol=6.115634e+06
or (segid " A" and resid 34 and name HB1) (segid " A" and resid 34 and name HE2)
assign (segid " A" and resid 34 and name HE1) (segid " A" and resid 1 and name HG2) 3.932 1.933 1.933 weight 1.000 ! spec=Expt_41, no=736, id=1173, vol=8.450688e+06
or (segid " A" and resid 34 and name HE2) (segid " A" and resid 1 and name HG2)
assign (segid " A" and resid 27 and name HE1) (segid " A" and resid 3 and name HA) 3.654 1.669 1.669 weight 1.000 ! spec=Expt_41, no=738, id=1175, vol=5.512882e+06
or (segid " A" and resid 27 and name HE2) (segid " A" and resid 3 and name HA)
assign (segid " A" and resid 34 and name HE1) (segid " A" and resid 34 and name HA) 3.711 1.721 1.721 weight 1.000 ! spec=Expt_41, no=739, id=1176, vol=5.336139e+06
or (segid " A" and resid 34 and name HE2) (segid " A" and resid 34 and name HA)
assign (segid " A" and resid 5 and name HD2) (segid " A" and resid 27 and name HD1) 3.373 1.422 1.422 weight 1.000 ! spec=Expt_41, no=741, id=1178, vol=8.862819e+06
or (segid " A" and resid 5 and name HD2) (segid " A" and resid 27 and name HD2)
assign (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HD13) 3.075 1.106 1.106 weight 1.000 ! spec=Expt_41, no=743, id=1180, vol=1.053356e+07
or (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HD12)
or (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HD11)
assign (segid " A" and resid 32 and name HN) (segid " A" and resid 31 and name HD11) 3.321 1.378 1.378 weight 1.000 ! spec=Expt_41, no=744, id=1181, vol=9.472996e+06
or (segid " A" and resid 32 and name HN) (segid " A" and resid 31 and name HD13)
or (segid " A" and resid 32 and name HN) (segid " A" and resid 31 and name HD12)
assign (segid " A" and resid 27 and name HN) (segid " A" and resid 24 and name HD21) 3.459 1.495 1.495 weight 1.000 ! spec=Expt_41, no=748, id=1182, vol=8.889096e+06
or (segid " A" and resid 27 and name HN) (segid " A" and resid 24 and name HD22)
or (segid " A" and resid 27 and name HN) (segid " A" and resid 24 and name HD23)
assign (segid " A" and resid 4 and name HN) (segid " A" and resid 4 and name HD1) 4.720 2.785 2.785 weight 1.000 ! spec=Expt_41, no=749, id=1183, vol=5.121058e+06
assign (segid " A" and resid 27 and name HE1) (segid " A" and resid 4 and name HD1) 4.085 1.349 1.349 weight 1.000 ! spec=Expt_41, no=750, id=1184, vol=8.461508e+06
or (segid " A" and resid 27 and name HE2) (segid " A" and resid 4 and name HD1)
assign (segid " A" and resid 33 and name HA) (segid " A" and resid 34 and name HN) 3.393 1.439 1.439 weight 1.000 ! spec=Expt_41, no=755, id=1189, vol=9.908907e+06
assign (segid " A" and resid 15 and name HN) (segid " A" and resid 13 and name HA) 3.682 1.694 1.694 weight 1.000 ! spec=Expt_41, no=758, id=1191, vol=8.334570e+06
assign (segid " A" and resid 19 and name HN) (segid " A" and resid 18 and name HA) 3.220 1.296 1.296 weight 1.000 ! spec=Expt_41, no=761, id=1194, vol=1.053742e+07
assign (segid " A" and resid 2 and name HB2) (segid " A" and resid 27 and name HD1) 3.646 1.662 1.662 weight 1.000 ! spec=Expt_41, no=767, id=1199, vol=9.031533e+06
or (segid " A" and resid 2 and name HB2) (segid " A" and resid 27 and name HD2)
assign (segid " A" and resid 14 and name HD2) (segid " A" and resid 14 and name HG1) 2.805 0.984 0.984 weight 1.000 ! spec=Expt_41, no=776, id=1208, vol=1.324874e+07
assign (segid " A" and resid 17 and name HB1) (segid " A" and resid 17 and name HD21) 2.249 0.632 0.632 weight 1.000 ! spec=Expt_41, no=777, id=1209, vol=3.211323e+07
or (segid " A" and resid 17 and name HB1) (segid " A" and resid 17 and name HD23)
or (segid " A" and resid 17 and name HB1) (segid " A" and resid 17 and name HD22)
assign (segid " A" and resid 17 and name HB1) (segid " A" and resid 17 and name HD13) 2.944 1.083 1.083 weight 1.000 ! spec=Expt_41, no=778, id=1210, vol=1.993311e+07
or (segid " A" and resid 17 and name HB1) (segid " A" and resid 17 and name HD11)
or (segid " A" and resid 17 and name HB1) (segid " A" and resid 17 and name HD12)
assign (segid " A" and resid 2 and name HG2) (segid " A" and resid 31 and name HD21) 3.344 0.687 0.687 weight 1.000 ! spec=Expt_41, no=779, id=1211, vol=1.932466e+07
or (segid " A" and resid 2 and name HG2) (segid " A" and resid 31 and name HD22)
or (segid " A" and resid 2 and name HG2) (segid " A" and resid 31 and name HD23)
assign (segid " A" and resid 17 and name HB2) (segid " A" and resid 17 and name HD21) 2.056 0.528 0.528 weight 1.000 ! spec=Expt_41, no=781, id=1213, vol=6.263761e+07
or (segid " A" and resid 17 and name HB2) (segid " A" and resid 17 and name HD23)
or (segid " A" and resid 17 and name HB2) (segid " A" and resid 17 and name HD22)
assign (segid " A" and resid 17 and name HB2) (segid " A" and resid 17 and name HD13) 1.988 0.494 0.494 weight 1.000 ! spec=Expt_41, no=782, id=1214, vol=5.615324e+07
or (segid " A" and resid 17 and name HB2) (segid " A" and resid 17 and name HD11)
or (segid " A" and resid 17 and name HB2) (segid " A" and resid 17 and name HD12)
assign (segid " A" and resid 31 and name HB2) (segid " A" and resid 31 and name HD21) 2.570 0.825 0.825 weight 1.000 ! spec=Expt_41, no=783, id=1215, vol=4.402854e+07
or (segid " A" and resid 31 and name HB2) (segid " A" and resid 31 and name HD22)
or (segid " A" and resid 31 and name HB2) (segid " A" and resid 31 and name HD23)
assign (segid " A" and resid 24 and name HB1) (segid " A" and resid 24 and name HD21) 2.403 0.722 0.722 weight 1.000 ! spec=Expt_41, no=784, id=1216, vol=5.358292e+07
or (segid " A" and resid 24 and name HB1) (segid " A" and resid 24 and name HD22)
or (segid " A" and resid 24 and name HB1) (segid " A" and resid 24 and name HD23)
assign (segid " A" and resid 24 and name HD13) (segid " A" and resid 24 and name HB1) 2.110 0.556 0.556 weight 1.000 ! spec=Expt_41, no=792, id=1224, vol=3.659776e+07
or (segid " A" and resid 24 and name HD12) (segid " A" and resid 24 and name HB1)
or (segid " A" and resid 24 and name HD11) (segid " A" and resid 24 and name HB1)
assign (segid " A" and resid 31 and name HD11) (segid " A" and resid 31 and name HB2) 2.223 0.618 0.618 weight 1.000 ! spec=Expt_41, no=794, id=1225, vol=3.141779e+07
or (segid " A" and resid 31 and name HD13) (segid " A" and resid 31 and name HB2)
or (segid " A" and resid 31 and name HD12) (segid " A" and resid 31 and name HB2)
assign (segid " A" and resid 5 and name HD1) (segid " A" and resid 5 and name HG2) 2.379 0.707 0.707 weight 1.000 ! spec=Expt_41, no=798, id=1229, vol=4.003075e+07
assign (segid " A" and resid 4 and name HG2) (segid " A" and resid 4 and name HA) 3.309 0.787 0.787 weight 1.000 ! spec=Expt_41, no=799, id=1230, vol=3.762924e+07
assign (segid " A" and resid 5 and name HG1) (segid " A" and resid 5 and name HD1) 3.251 1.321 1.321 weight 1.000 ! spec=Expt_41, no=800, id=1231, vol=1.734917e+07
assign (segid " A" and resid 2 and name HG2) (segid " A" and resid 2 and name HD1) 2.752 0.946 0.946 weight 1.000 ! spec=Expt_41, no=801, id=1232, vol=1.775001e+07
assign (segid " A" and resid 2 and name HG2) (segid " A" and resid 2 and name HD2) 2.860 1.022 1.022 weight 1.000 ! spec=Expt_41, no=803, id=1233, vol=1.817308e+07
assign (segid " A" and resid 2 and name HD1) (segid " A" and resid 2 and name HG1) 2.883 1.039 1.039 weight 1.000 ! spec=Expt_41, no=804, id=1234, vol=1.527633e+07
assign (segid " A" and resid 2 and name HG1) (segid " A" and resid 31 and name HA) 3.293 1.355 1.355 weight 1.000 ! spec=Expt_41, no=814, id=1240, vol=9.173115e+06
assign (segid " A" and resid 31 and name HA) (segid " A" and resid 31 and name HB1) 3.083 1.188 1.188 weight 1.000 ! spec=Expt_41, no=816, id=1242, vol=9.133730e+06
assign (segid " A" and resid 23 and name HN) (segid " A" and resid 23 and name HB1) 3.241 1.313 1.313 weight 1.000 ! spec=Expt_41, no=820, id=1246, vol=1.523755e+07
assign (segid " A" and resid 14 and name HG2) (segid " A" and resid 14 and name HA) 3.050 1.163 1.163 weight 1.000 ! spec=Expt_41, no=821, id=1247, vol=1.444478e+07
assign (segid " A" and resid 8 and name HB1) (segid " A" and resid 12 and name HB1) 5.000 1.100 1.100 weight 1.000 ! spec=Expt_41, no=829, id=1253, vol=4.068513e+07
or (segid " A" and resid 8 and name HB1) (segid " A" and resid 12 and name HB2)
or (segid " A" and resid 8 and name HB1) (segid " A" and resid 12 and name HB3)
assign (segid " A" and resid 26 and name HA) (segid " A" and resid 26 and name HB2) 3.056 1.167 1.167 weight 1.000 ! spec=Expt_41, no=839, id=1261, vol=2.049763e+07
assign (segid " A" and resid 15 and name HA) (segid " A" and resid 15 and name HB2) 2.609 0.851 0.851 weight 1.000 ! spec=Expt_41, no=843, id=1265, vol=3.032120e+07
assign (segid " A" and resid 10 and name HA) (segid " A" and resid 10 and name HB2) 2.598 0.843 0.843 weight 1.000 ! spec=Expt_41, no=851, id=1271, vol=3.537369e+07
assign (segid " A" and resid 23 and name HN) (segid " A" and resid 20 and name HA) 3.382 1.430 1.430 weight 1.000 ! spec=Expt_41, no=853, id=1273, vol=7.952244e+06
assign (segid " A" and resid 26 and name HB1) (segid " A" and resid 27 and name HN) 3.813 1.817 1.817 weight 1.000 ! spec=Expt_41, no=855, id=1274, vol=9.390240e+06
assign (segid " A" and resid 2 and name HB2) (segid " A" and resid 2 and name HA) 2.556 0.817 0.817 weight 1.000 ! spec=Expt_41, no=857, id=1275, vol=2.443996e+07
assign (segid " A" and resid 28 and name HN) (segid " A" and resid 25 and name HA) 3.130 1.225 1.225 weight 1.000 ! spec=Expt_41, no=865, id=1280, vol=1.427119e+07
assign (segid " A" and resid 8 and name HD1) (segid " A" and resid 8 and name HG1) 3.652 1.667 1.667 weight 1.000 ! spec=Expt_41, no=866, id=1281, vol=6.699110e+06
assign (segid " A" and resid 9 and name HN) (segid " A" and resid 8 and name HB1) 3.342 1.397 1.397 weight 1.000 ! spec=Expt_41, no=867, id=1282, vol=8.264299e+06
assign (segid " A" and resid 9 and name HN) (segid " A" and resid 12 and name HB1) 3.991 1.119 1.119 weight 1.000 ! spec=Expt_41, no=868, id=1283, vol=9.655450e+06
or (segid " A" and resid 9 and name HN) (segid " A" and resid 12 and name HB2)
or (segid " A" and resid 9 and name HN) (segid " A" and resid 12 and name HB3)
assign (segid " A" and resid 9 and name HN) (segid " A" and resid 8 and name HB2) 3.609 1.628 1.628 weight 1.000 ! spec=Expt_41, no=869, id=1284, vol=1.079513e+07
assign (segid " A" and resid 34 and name HE1) (segid " A" and resid 1 and name HD1) 3.809 1.128 1.128 weight 1.000 ! spec=Expt_41, no=875, id=1290, vol=6.061456e+06
or (segid " A" and resid 34 and name HE2) (segid " A" and resid 1 and name HD1)
assign (segid " A" and resid 21 and name HE22) (segid " A" and resid 17 and name HD21) 4.077 0.811 0.811 weight 1.000 ! spec=Expt_41, no=876, id=1291, vol=8.511145e+06
or (segid " A" and resid 21 and name HE22) (segid " A" and resid 17 and name HD22)
or (segid " A" and resid 21 and name HE22) (segid " A" and resid 17 and name HD23)
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