NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
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617968 |
5xk5   |
36082 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
# Restraints file 1: major_NOE.tbl
assign (segid " " and resid 36 and name HB) (segid " " and resid 36 and name HN) 2.833 0.623 0.623 weight 1.000 ! spec=CNOE, no=1, id=4, vol=1.979747e+08
assign (segid " " and resid 36 and name HB) (segid " " and resid 36 and name HA) 2.833 0.623 0.623 weight 1.000 ! spec=CNOE, no=2, id=4, vol=1.979747e+08
assign (segid " " and resid 43 and name HD2*) (segid " " and resid 69 and name HA) 2.833 0.823 0.823 weight 1.000 ! spec=CNOE, no=5, id=4, vol=1.979747e+08
assign (segid " " and resid 71 and name HA) (segid " " and resid 71 and name HB2) 2.233 0.623 0.623 weight 1.000 ! spec=CNOE, no=11, id=4, vol=1.979747e+08
assign (segid " " and resid 71 and name HA) (segid " " and resid 71 and name HD12) 3.408 0.725 0.725 weight 1.000 ! +1A, spec=CNOE, no=13, id=5, vol=1.260860e+08
or (segid " " and resid 71 and name HA) (segid " " and resid 71 and name HD11)
or (segid " " and resid 71 and name HA) (segid " " and resid 71 and name HD13)
assign (segid " " and resid 71 and name HA) (segid " " and resid 71 and name HD22) 2.425 0.735 0.735 weight 1.000 ! spec=CNOE, no=14, id=6, vol=1.207356e+08
or (segid " " and resid 71 and name HA) (segid " " and resid 71 and name HD21)
or (segid " " and resid 71 and name HA) (segid " " and resid 71 and name HD23)
assign (segid " " and resid 50 and name HD22) (segid " " and resid 50 and name HA) 2.340 0.685 0.685 weight 1.000 ! spec=CNOE, no=19, id=8, vol=1.494445e+08
or (segid " " and resid 50 and name HD21) (segid " " and resid 50 and name HA)
or (segid " " and resid 50 and name HD23) (segid " " and resid 50 and name HA)
assign (segid " " and resid 50 and name HD22) (segid " " and resid 45 and name HB2) 2.802 0.721 0.721 weight 1.000 ! spec=CNOE, no=20, id=9, vol=1.277488e+08
or (segid " " and resid 50 and name HD21) (segid " " and resid 45 and name HB2)
or (segid " " and resid 50 and name HD23) (segid " " and resid 45 and name HB2)
assign (segid " " and resid 17 and name HG1*) (segid " " and resid 17 and name HB) 2.864 0.641 0.641 weight 1.000 ! spec=CNOE, no=43, id=10, vol=1.824686e+08
assign (segid " " and resid 17 and name HG1*) (segid " " and resid 29 and name HD2) 2.611 0.852 0.852 weight 1.000 ! spec=CNOE, no=46, id=13, vol=7.743971e+07
assign (segid " " and resid 17 and name HG1*) (segid " " and resid 17 and name HA) 2.933 1.075 1.075 weight 1.000 ! spec=CNOE, no=49, id=16, vol=3.859243e+07
assign (segid " " and resid 17 and name HG1*) (segid " " and resid 16 and name HA) 2.977 1.108 1.108 weight 1.000 ! spec=CNOE, no=53, id=18, vol=3.530623e+07
assign (segid " " and resid 17 and name HG1*) (segid " " and resid 17 and name HN) 2.574 0.828 0.828 weight 1.000 ! spec=CNOE, no=56, id=19, vol=8.437780e+07
assign (segid " " and resid 17 and name HG1*) (segid " " and resid 18 and name HN) 3.489 0.774 0.774 weight 1.000 ! +1A spec=CNOE, no=57, id=20, vol=1.032837e+08
assign (segid " " and resid 61 and name HD1*) (segid " " and resid 56 and name HA) 3.789 0.972 0.972 weight 1.000 ! +1A spec=CNOE, no=62, id=23, vol=5.216024e+07
assign (segid " " and resid 61 and name HD1*) (segid " " and resid 45 and name HB1) 3.012 1.134 1.134 weight 1.000 ! spec=CNOE, no=64, id=25, vol=3.291907e+07
*
assign (segid " " and resid 61 and name HD1*) (segid " " and resid 45 and name HB2) 3.077 1.184 1.184 weight 1.000 ! spec=CNOE, no=65, id=26, vol=2.892850e+07
*
assign (segid " " and resid 61 and name HD1*) (segid " " and resid 59 and name HB2) 2.773 0.961 0.961 weight 1.000 ! spec=CNOE, no=66, id=27, vol=5.399984e+07
*
assign (segid " " and resid 61 and name HD1*) (segid " " and resid 61 and name HB) 2.478 0.768 0.768 weight 1.000 ! spec=CNOE, no=67, id=28, vol=1.060706e+08
*
assign (segid " " and resid 61 and name HD1*) (segid " " and resid 61 and name HG11) 2.679 0.897 0.897 weight 1.000 ! spec=CNOE, no=68, id=29, vol=6.645395e+07
*
assign (segid " " and resid 61 and name HD1*) (segid " " and resid 61 and name HG12) 2.361 0.696 0.696 weight 1.000 ! spec=CNOE, no=69, id=30, vol=1.419875e+08
*
assign (segid " " and resid 61 and name HD1*) (segid " " and resid 67 and name HD1*) 3.504 0.807 0.807 weight 1.000 ! spec=CNOE, no=71, id=31, vol=7.130715e+08
assign (segid " " and resid 61 and name HD1*) (segid " " and resid 59 and name HD*) 3.282 0.967 0.967 weight 1.000 ! spec=CNOE, no=72, id=32, vol=5.300791e+07
assign (segid " " and resid 61 and name HD1*) (segid " " and resid 67 and name HD2*) 2.972 1.104 1.104 weight 1.000 ! spec=CNOE, no=73, id=33, vol=3.562116e+07
assign (segid " " and resid 3 and name HD1*) (segid " " and resid 17 and name HB) 3.883 1.299 1.299 weight 1.000 ! spec=CNOE, no=78, id=37, vol=6.591875e+07
assign (segid " " and resid 3 and name HD12) (segid " " and resid 3 and name HN) 2.824 0.997 0.997 weight 1.000 ! spec=CNOE, no=83, id=39, vol=4.847811e+07
or (segid " " and resid 3 and name HD11) (segid " " and resid 3 and name HN)
or (segid " " and resid 3 and name HD13) (segid " " and resid 3 and name HN)
assign (segid " " and resid 46 and name HB2) (segid " " and resid 46 and name HA) 2.263 0.640 0.640 weight 1.000 ! spec=CNOE, no=106, id=43, vol=1.827160e+08
or (segid " " and resid 46 and name HB1) (segid " " and resid 46 and name HA)
or (segid " " and resid 46 and name HB3) (segid " " and resid 46 and name HA)
assign (segid " " and resid 61 and name HG22) (segid " " and resid 61 and name HB) 2.218 0.615 0.615 weight 1.000 ! spec=CNOE, no=112, id=45, vol=2.061537e+08
or (segid " " and resid 61 and name HG21) (segid " " and resid 61 and name HB)
or (segid " " and resid 61 and name HG23) (segid " " and resid 61 and name HB)
assign (segid " " and resid 61 and name HG22) (segid " " and resid 61 and name HA) 2.605 0.848 0.848 weight 1.000 ! spec=CNOE, no=115, id=48, vol=7.862744e+07
or (segid " " and resid 61 and name HG21) (segid " " and resid 61 and name HA)
or (segid " " and resid 61 and name HG23) (segid " " and resid 61 and name HA)
assign (segid " " and resid 36 and name HG22) (segid " " and resid 40 and name HB2) 2.102 0.552 0.552 weight 1.000 ! spec=CNOE, no=116, id=49, vol=2.847916e+08
or (segid " " and resid 36 and name HG21) (segid " " and resid 40 and name HB2)
or (segid " " and resid 36 and name HG23) (segid " " and resid 40 and name HB2)
assign (segid " " and resid 30 and name HG22) (segid " " and resid 30 and name HB) 2.807 0.498 0.498 weight 1.000 ! spec=CNOE, no=123, id=54, vol=3.877329e+08
or (segid " " and resid 30 and name HG21) (segid " " and resid 30 and name HB)
or (segid " " and resid 30 and name HG23) (segid " " and resid 30 and name HB)
assign (segid " " and resid 30 and name HG22) (segid " " and resid 30 and name HA) 2.896 0.603 0.603 weight 1.000 ! spec=CNOE, no=126, id=55, vol=2.187513e+08
or (segid " " and resid 30 and name HG21) (segid " " and resid 30 and name HA)
or (segid " " and resid 30 and name HG23) (segid " " and resid 30 and name HA)
assign (segid " " and resid 3 and name HG22) (segid " " and resid 3 and name HA) 2.676 0.895 0.895 weight 1.000 ! spec=CNOE, no=128, id=57, vol=6.693757e+07
or (segid " " and resid 3 and name HG21) (segid " " and resid 3 and name HA)
or (segid " " and resid 3 and name HG23) (segid " " and resid 3 and name HA)
assign (segid " " and resid 30 and name HG22) (segid " " and resid 31 and name HA) 2.800 0.925 0.925 weight 1.000 ! spec=CNOE, no=129, id=58, vol=6.067811e+07
or (segid " " and resid 30 and name HG21) (segid " " and resid 31 and name HA)
or (segid " " and resid 30 and name HG23) (segid " " and resid 31 and name HA)
assign (segid " " and resid 13 and name HG22) (segid " " and resid 13 and name HA) 2.844 0.629 0.629 weight 1.000 ! spec=CNOE, no=135, id=60, vol=1.924593e+08
or (segid " " and resid 13 and name HG21) (segid " " and resid 13 and name HA)
or (segid " " and resid 13 and name HG23) (segid " " and resid 13 and name HA)
assign (segid " " and resid 13 and name HG22) (segid " " and resid 12 and name HA) 2.868 1.028 1.028 weight 1.000 ! spec=CNOE, no=136, id=61, vol=4.412823e+07
or (segid " " and resid 13 and name HG21) (segid " " and resid 12 and name HA)
or (segid " " and resid 13 and name HG23) (segid " " and resid 12 and name HA)
assign (segid " " and resid 36 and name HG22) (segid " " and resid 36 and name HN) 2.559 0.819 0.819 weight 1.000 ! spec=CNOE, no=137, id=62, vol=8.746347e+07
or (segid " " and resid 36 and name HG21) (segid " " and resid 36 and name HN)
or (segid " " and resid 36 and name HG23) (segid " " and resid 36 and name HN)
assign (segid " " and resid 30 and name HG22) (segid " " and resid 36 and name HN) 3.277 0.896 0.896 weight 1.000 ! spec=CNOE, no=138, id=63, vol=6.670539e+07
or (segid " " and resid 30 and name HG21) (segid " " and resid 36 and name HN)
or (segid " " and resid 30 and name HG23) (segid " " and resid 36 and name HN)
assign (segid " " and resid 44 and name HG22) (segid " " and resid 48 and name HN) 3.500 0.690 0.690 weight 1.000 ! spec=CNOE, no=144, id=67, vol=1.457866e+08
or (segid " " and resid 44 and name HG21) (segid " " and resid 48 and name HN)
or (segid " " and resid 44 and name HG23) (segid " " and resid 48 and name HN)
assign (segid " " and resid 30 and name HG22) (segid " " and resid 31 and name HN) 2.853 0.815 0.815 weight 1.000 ! spec=CNOE, no=145, id=68, vol=8.870824e+07
or (segid " " and resid 30 and name HG21) (segid " " and resid 31 and name HN)
or (segid " " and resid 30 and name HG23) (segid " " and resid 31 and name HN)
assign (segid " " and resid 61 and name HG22) (segid " " and resid 62 and name HN) 2.870 1.030 1.030 weight 1.000 ! spec=CNOE, no=148, id=70, vol=4.395641e+07
or (segid " " and resid 61 and name HG21) (segid " " and resid 62 and name HN)
or (segid " " and resid 61 and name HG23) (segid " " and resid 62 and name HN)
assign (segid " " and resid 1 and name HE*) (segid " " and resid 56 and name HD1*) 3.504 0.802 0.802 weight 1.000 ! spec=CNOE, no=153, id=74, vol=3.797062e+08
assign (segid " " and resid 17 and name HG1*) (segid " " and resid 1 and name HE*) 3.824 0.564 0.564 weight 1.000 ! +1A, spec=CNOE, no=154, id=75, vol=2.674860e+08
assign (segid " " and resid 61 and name HG22) (segid " " and resid 61 and name HG11) 2.835 1.005 1.005 weight 1.000 ! spec=CNOE, no=160, id=76, vol=4.728612e+07
or (segid " " and resid 61 and name HG21) (segid " " and resid 61 and name HG11)
or (segid " " and resid 61 and name HG23) (segid " " and resid 61 and name HG11)
assign (segid " " and resid 5 and name HG12) (segid " " and resid 69 and name HB2) 2.857 0.529 0.529 weight 1.000 ! spec=CNOE, no=162, id=78, vol=3.246722e+08
or (segid " " and resid 5 and name HG11) (segid " " and resid 69 and name HB2)
or (segid " " and resid 5 and name HG13) (segid " " and resid 69 and name HB2)
assign (segid " " and resid 5 and name HG12) (segid " " and resid 5 and name HA) 2.822 0.733 0.733 weight 1.000 ! spec=CNOE, no=164, id=80, vol=1.216521e+08
or (segid " " and resid 5 and name HG11) (segid " " and resid 5 and name HA)
or (segid " " and resid 5 and name HG13) (segid " " and resid 5 and name HA)
assign (segid " " and resid 69 and name HD22) (segid " " and resid 69 and name HB2) 2.848 0.689 0.689 weight 1.000 ! spec=CNOE, no=173, id=87, vol=1.466405e+08
or (segid " " and resid 69 and name HD21) (segid " " and resid 69 and name HB2)
or (segid " " and resid 69 and name HD23) (segid " " and resid 69 and name HB2)
assign (segid " " and resid 17 and name HG2*) (segid " " and resid 17 and name HB) 2.803 0.462 0.462 weight 1.000 ! spec=CNOE, no=180, id=92, vol=4.853221e+08
assign (segid " " and resid 17 and name HG2*) (segid " " and resid 29 and name HD2) 3.556 0.873 0.873 weight 1.000 ! spec=CNOE, no=181, id=93, vol=4.524635e+08
assign (segid " " and resid 5 and name HG1*) (segid " " and resid 5 and name HB) 2.806 0.503 0.503 weight 1.000 ! spec=CNOE, no=183, id=95, vol=3.765438e+08
assign (segid " " and resid 56 and name HD1*) (segid " " and resid 56 and name HD2*) 2.895 0.549 0.549 weight 1.000 ! spec=CNOE, no=184, id=96, vol=2.903029e+08
assign (segid " " and resid 66 and name HG2*) (segid " " and resid 4 and name HB2) 3.213 0.854 0.854 weight 1.000 ! spec=CNOE, no=195, id=100, vol=7.715197e+07
assign (segid " " and resid 66 and name HG2*) (segid " " and resid 66 and name HB) 2.827 0.620 0.620 weight 1.000 ! spec=CNOE, no=200, id=103, vol=2.013649e+08
assign (segid " " and resid 22 and name HG2*) (segid " " and resid 22 and name HN) 2.877 0.767 0.767 weight 1.000 ! spec=CNOE, no=206, id=106, vol=1.062271e+08
assign (segid " " and resid 5 and name HG1*) (segid " " and resid 5 and name HN) 2.878 0.768 0.768 weight 1.000 ! spec=CNOE, no=213, id=109, vol=1.060661e+08
assign (segid " " and resid 7 and name HG2*) (segid " " and resid 7 and name HN) 2.852 0.634 0.634 weight 1.000 ! spec=CNOE, no=216, id=111, vol=1.883079e+08
assign (segid " " and resid 5 and name HG2*) (segid " " and resid 6 and name HN) 2.805 0.848 0.848 weight 1.000 ! spec=CNOE, no=220, id=115, vol=7.858596e+07
assign (segid " " and resid 17 and name HG2*) (segid " " and resid 18 and name HN) 2.524 0.796 0.796 weight 1.000 ! spec=CNOE, no=222, id=117, vol=9.502004e+07
assign (segid " " and resid 22 and name HG21) (segid " " and resid 22 and name HB) 2.015 0.508 0.508 weight 1.000 ! spec=CNOE, no=229, id=121, vol=3.666934e+08
or (segid " " and resid 22 and name HG22) (segid " " and resid 22 and name HB)
or (segid " " and resid 22 and name HG23) (segid " " and resid 22 and name HB)
assign (segid " " and resid 22 and name HG21) (segid " " and resid 55 and name HA) 2.787 0.971 0.971 weight 1.000 ! spec=CNOE, no=231, id=123, vol=5.242142e+07
or (segid " " and resid 22 and name HG22) (segid " " and resid 55 and name HA)
or (segid " " and resid 22 and name HG23) (segid " " and resid 55 and name HA)
assign (segid " " and resid 55 and name HG21) (segid " " and resid 22 and name HA) 2.811 0.668 0.668 weight 1.000 ! spec=CNOE, no=233, id=125, vol=1.610609e+08
or (segid " " and resid 55 and name HG22) (segid " " and resid 22 and name HA)
or (segid " " and resid 55 and name HG23) (segid " " and resid 22 and name HA)
assign (segid " " and resid 7 and name HG21) (segid " " and resid 7 and name HA) 2.027 0.513 0.513 weight 1.000 ! spec=CNOE, no=234, id=126, vol=3.545699e+08
or (segid " " and resid 7 and name HG22) (segid " " and resid 7 and name HA)
or (segid " " and resid 7 and name HG23) (segid " " and resid 7 and name HA)
assign (segid " " and resid 55 and name HG21) (segid " " and resid 55 and name HA) 2.416 0.730 0.730 weight 1.000 ! spec=CNOE, no=236, id=128, vol=1.234064e+08
or (segid " " and resid 55 and name HG22) (segid " " and resid 55 and name HA)
or (segid " " and resid 55 and name HG23) (segid " " and resid 55 and name HA)
assign (segid " " and resid 12 and name HG21) (segid " " and resid 12 and name HA) 2.859 0.695 0.695 weight 1.000 ! spec=CNOE, no=237, id=129, vol=1.427015e+08
or (segid " " and resid 12 and name HG22) (segid " " and resid 12 and name HA)
or (segid " " and resid 12 and name HG23) (segid " " and resid 12 and name HA)
assign (segid " " and resid 55 and name HG21) (segid " " and resid 55 and name HB) 2.888 0.654 0.654 weight 1.000 ! spec=CNOE, no=238, id=130, vol=1.712894e+08
or (segid " " and resid 55 and name HG22) (segid " " and resid 55 and name HB)
or (segid " " and resid 55 and name HG23) (segid " " and resid 55 and name HB)
assign (segid " " and resid 26 and name HG12) (segid " " and resid 27 and name HA) 2.809 0.787 0.787 weight 1.000 ! spec=CNOE, no=244, id=132, vol=9.854089e+07
or (segid " " and resid 26 and name HG11) (segid " " and resid 27 and name HA)
or (segid " " and resid 26 and name HG13) (segid " " and resid 27 and name HA)
assign (segid " " and resid 66 and name HG21) (segid " " and resid 66 and name HA) 2.827 0.798 0.798 weight 1.000 ! spec=CNOE, no=245, id=133, vol=9.425760e+07
or (segid " " and resid 66 and name HG22) (segid " " and resid 66 and name HA)
or (segid " " and resid 66 and name HG23) (segid " " and resid 66 and name HA)
assign (segid " " and resid 33 and name HG2) (segid " " and resid 33 and name HA) 2.802 0.721 0.721 weight 1.000 ! spec=CNOE, no=252, id=137, vol=1.279193e+08
assign (segid " " and resid 56 and name HD12) (segid " " and resid 26 and name HB) 2.832 0.801 0.801 weight 1.000 ! spec=CNOE, no=261, id=140, vol=9.321952e+07
or (segid " " and resid 56 and name HD11) (segid " " and resid 26 and name HB)
or (segid " " and resid 56 and name HD13) (segid " " and resid 26 and name HB)
assign (segid " " and resid 56 and name HD12) (segid " " and resid 56 and name HB2) 2.825 0.735 0.735 weight 1.000 ! spec=CNOE, no=262, id=141, vol=1.209298e+08
or (segid " " and resid 56 and name HD11) (segid " " and resid 56 and name HB2)
or (segid " " and resid 56 and name HD13) (segid " " and resid 56 and name HB2)
assign (segid " " and resid 61 and name HG11) (segid " " and resid 61 and name HG12) 2.819 0.731 0.731 weight 1.000 ! spec=CNOE, no=276, id=144, vol=1.226628e+08
assign (segid " " and resid 50 and name HD12) (segid " " and resid 45 and name HB1) 2.703 0.913 0.913 weight 1.000 ! spec=CNOE, no=282, id=147, vol=6.304065e+07
or (segid " " and resid 50 and name HD11) (segid " " and resid 45 and name HB1)
or (segid " " and resid 50 and name HD13) (segid " " and resid 45 and name HB1)
assign (segid " " and resid 31 and name HB2) (segid " " and resid 28 and name HA) 2.827 0.737 0.737 weight 1.000 ! spec=CNOE, no=288, id=152, vol=1.200709e+08
assign (segid " " and resid 31 and name HB2) (segid " " and resid 31 and name HA) 2.827 0.737 0.737 weight 1.000 ! spec=CNOE, no=289, id=152, vol=1.200709e+08
assign (segid " " and resid 42 and name HG2) (segid " " and resid 42 and name HD2) 2.827 0.737 0.737 weight 1.000 ! spec=CNOE, no=300, id=152, vol=1.200709e+08
assign (segid " " and resid 31 and name HB1) (segid " " and resid 31 and name HA) 2.827 0.737 0.737 weight 1.000 ! spec=CNOE, no=309, id=152, vol=1.200709e+08
assign (segid " " and resid 15 and name HD2*) (segid " " and resid 15 and name HD1*) 2.885 0.844 0.844 weight 1.000 ! spec=CNOE, no=318, id=158, vol=5.477275e+08
assign (segid " " and resid 31 and name HB2) (segid " " and resid 31 and name HB1) 2.427 0.737 0.737 weight 1.000 ! spec=CNOE, no=322, id=152, vol=1.200709e+08
assign (segid " " and resid 31 and name HB2) (segid " " and resid 32 and name HN) 2.885 0.844 0.844 weight 1.000 ! spec=CNOE, no=324, id=158, vol=5.477275e+08
assign (segid " " and resid 31 and name HB1) (segid " " and resid 31 and name HN) 2.885 0.844 0.844 weight 1.000 ! spec=CNOE, no=327, id=158, vol=5.477275e+08
assign (segid " " and resid 31 and name HB2) (segid " " and resid 31 and name HN) 2.885 0.844 0.844 weight 1.000 ! spec=CNOE, no=329, id=158, vol=5.477275e+08
assign (segid " " and resid 56 and name HD2*) (segid " " and resid 56 and name HN) 3.633 0.866 0.866 weight 1.000 ! +1A spec=CNOE, no=336, id=164, vol=7.378588e+07
assign (segid " " and resid 29 and name HG2) (segid " " and resid 29 and name HN) 2.922 1.067 1.067 weight 1.000 ! spec=CNOE, no=338, id=165, vol=3.944271e+07
assign (segid " " and resid 23 and name HG12) (segid " " and resid 59 and name HE1) 3.102 1.203 1.203 weight 1.000 ! spec=CNOE, no=355, id=171, vol=2.757716e+07
assign (segid " " and resid 23 and name HG11) (segid " " and resid 59 and name HE1) 3.034 1.151 1.151 weight 1.000 ! spec=CNOE, no=356, id=172, vol=3.147453e+07
assign (segid " " and resid 69 and name HD2*) (segid " " and resid 69 and name HN) 3.034 1.151 1.151 weight 1.000 ! spec=CNOE, no=358, id=172, vol=3.147453e+07
assign (segid " " and resid 67 and name HD2*) (segid " " and resid 67 and name HD1*) 2.261 0.639 0.639 weight 1.000 ! spec=CNOE, no=363, id=174, vol=1.840300e+08
assign (segid " " and resid 67 and name HD2*) (segid " " and resid 67 and name HN) 3.155 1.244 1.244 weight 1.000 ! spec=CNOE, no=370, id=179, vol=2.492655e+07
assign (segid " " and resid 26 and name HB) (segid " " and resid 26 and name HG1*) 2.330 0.679 0.679 weight 1.000 ! spec=CNOE, no=371, id=180, vol=1.533897e+08
assign (segid " " and resid 26 and name HB) (segid " " and resid 26 and name HG2*) 2.156 0.581 0.581 weight 1.000 ! spec=CNOE, no=372, id=181, vol=2.445582e+08
assign (segid " " and resid 26 and name HB) (segid " " and resid 27 and name HN) 2.578 0.830 0.830 weight 1.000 ! spec=CNOE, no=392, id=188, vol=8.375040e+07
assign (segid " " and resid 51 and name HB2) (segid " " and resid 54 and name HN) 3.579 0.965 0.965 weight 1.000 ! spec=CNOE, no=394, id=189, vol=5.333772e+07
assign (segid " " and resid 18 and name HB2) (segid " " and resid 18 and name HN) 2.484 0.771 0.771 weight 1.000 ! spec=CNOE, no=397, id=191, vol=1.046379e+08
assign (segid " " and resid 68 and name HB1) (segid " " and resid 68 and name HA) 2.865 1.026 1.026 weight 1.000 ! spec=CNOE, no=407, id=195, vol=4.443672e+07
assign (segid " " and resid 68 and name HB1) (segid " " and resid 44 and name HB) 3.562 1.586 1.586 weight 1.000 ! spec=CNOE, no=410, id=197, vol=1.201700e+07
assign (segid " " and resid 68 and name HB2) (segid " " and resid 44 and name HB) 3.103 1.204 1.204 weight 1.000 ! spec=CNOE, no=411, id=198, vol=2.750850e+07
assign (segid " " and resid 68 and name HB1) (segid " " and resid 68 and name HN) 3.019 1.139 1.139 weight 1.000 ! spec=CNOE, no=421, id=199, vol=3.246558e+07
assign (segid " " and resid 27 and name HB2) (segid " " and resid 27 and name HN) 2.465 0.759 0.759 weight 1.000 ! spec=CNOE, no=432, id=205, vol=1.095527e+08
assign (segid " " and resid 30 and name HB) (segid " " and resid 27 and name HA) 2.336 0.682 0.682 weight 1.000 ! spec=CNOE, no=501, id=225, vol=1.512338e+08
assign (segid " " and resid 25 and name HB2) (segid " " and resid 25 and name HN) 2.463 0.758 0.758 weight 1.000 ! spec=CNOE, no=515, id=232, vol=1.101442e+08
assign (segid " " and resid 61 and name HD12) (segid " " and resid 59 and name HB1) 3.179 1.263 1.263 weight 1.000 ! spec=CNOE, no=536, id=239, vol=2.381218e+07
or (segid " " and resid 61 and name HD11) (segid " " and resid 59 and name HB1)
or (segid " " and resid 61 and name HD13) (segid " " and resid 59 and name HB1)
assign (segid " " and resid 59 and name HB1) (segid " " and resid 61 and name HG12) 3.078 1.184 1.184 weight 1.000 ! spec=CNOE, no=538, id=240, vol=2.890479e+07
assign (segid " " and resid 59 and name HB1) (segid " " and resid 59 and name HB2) 2.253 0.635 0.635 weight 1.000 ! spec=CNOE, no=540, id=241, vol=1.875909e+08
assign (segid " " and resid 59 and name HB1) (segid " " and resid 59 and name HN) 2.861 0.820 0.820 weight 1.000 ! spec=CNOE, no=541, id=242, vol=8.700223e+07
assign (segid " " and resid 59 and name HB2) (segid " " and resid 59 and name HN) 2.841 0.807 0.807 weight 1.000 ! spec=CNOE, no=545, id=243, vol=9.118689e+07
assign (segid " " and resid 60 and name HB2) (segid " " and resid 60 and name HB1) 2.148 0.577 0.577 weight 1.000 ! spec=CNOE, no=556, id=248, vol=2.497653e+08
assign (segid " " and resid 21 and name HB1) (segid " " and resid 26 and name HG12) 3.287 0.903 0.903 weight 1.000 ! spec=CNOE, no=564, id=251, vol=6.526075e+07
or (segid " " and resid 21 and name HB1) (segid " " and resid 26 and name HG11)
or (segid " " and resid 21 and name HB1) (segid " " and resid 26 and name HG13)
assign (segid " " and resid 21 and name HB1) (segid " " and resid 21 and name HB2) 1.904 0.453 0.453 weight 1.000 ! spec=CNOE, no=570, id=256, vol=5.148462e+08
assign (segid " " and resid 21 and name HB1) (segid " " and resid 21 and name HN) 2.494 0.778 0.778 weight 1.000 ! spec=CNOE, no=571, id=257, vol=1.020534e+08
assign (segid " " and resid 56 and name HB2) (segid " " and resid 57 and name HN) 3.145 1.236 1.236 weight 1.000 ! spec=CNOE, no=583, id=261, vol=2.539778e+07
assign (segid " " and resid 58 and name HB2) (segid " " and resid 55 and name HN) 3.058 1.169 1.169 weight 1.000 ! spec=CNOE, no=585, id=263, vol=3.001254e+07
assign (segid " " and resid 58 and name HB2) (segid " " and resid 58 and name HB1) 2.190 0.599 0.599 weight 1.000 ! spec=CNOE, no=593, id=266, vol=2.226620e+08
assign (segid " " and resid 50 and name HB1) (segid " " and resid 50 and name HD22) 3.057 1.168 1.168 weight 1.000 ! spec=CNOE, no=608, id=273, vol=3.011712e+07
or (segid " " and resid 50 and name HB1) (segid " " and resid 50 and name HD21)
or (segid " " and resid 50 and name HB1) (segid " " and resid 50 and name HD23)
assign (segid " " and resid 50 and name HB2) (segid " " and resid 50 and name HD22) 2.870 1.030 1.030 weight 1.000 ! spec=CNOE, no=609, id=274, vol=4.393961e+07
or (segid " " and resid 50 and name HB2) (segid " " and resid 50 and name HD21)
or (segid " " and resid 50 and name HB2) (segid " " and resid 50 and name HD23)
assign (segid " " and resid 56 and name HB2) (segid " " and resid 56 and name HB1) 2.198 0.604 0.604 weight 1.000 ! spec=CNOE, no=610, id=275, vol=2.176931e+08
assign (segid " " and resid 50 and name HB2) (segid " " and resid 50 and name HD12) 2.477 0.767 0.767 weight 1.000 ! spec=CNOE, no=611, id=276, vol=1.062689e+08
or (segid " " and resid 50 and name HB2) (segid " " and resid 50 and name HD11)
or (segid " " and resid 50 and name HB2) (segid " " and resid 50 and name HD13)
assign (segid " " and resid 56 and name HB2) (segid " " and resid 56 and name HA) 2.584 0.835 0.835 weight 1.000 ! spec=CNOE, no=618, id=280, vol=8.252159e+07
assign (segid " " and resid 58 and name HB1) (segid " " and resid 58 and name HA) 2.561 0.820 0.820 weight 1.000 ! spec=CNOE, no=620, id=282, vol=8.706961e+07
assign (segid " " and resid 50 and name HB1) (segid " " and resid 50 and name HA) 2.985 1.114 1.114 weight 1.000 ! spec=CNOE, no=623, id=283, vol=3.470098e+07
assign (segid " " and resid 44 and name HB) (segid " " and resid 44 and name HN) 2.615 0.855 0.855 weight 1.000 ! spec=CNOE, no=625, id=284, vol=7.687652e+07
assign (segid " " and resid 27 and name HE*) (segid " " and resid 43 and name HD1*) 2.615 0.855 0.855 weight 1.000 ! spec=CNOE, no=625, id=284, vol=7.687652e+07
assign (segid " " and resid 47 and name HA2) (segid " " and resid 44 and name HG22) 2.895 1.048 1.048 weight 1.000 ! spec=CNOE, no=651, id=288, vol=4.170842e+07
or (segid " " and resid 47 and name HA2) (segid " " and resid 44 and name HG21)
or (segid " " and resid 47 and name HA2) (segid " " and resid 44 and name HG23)
assign (segid " " and resid 45 and name HB1) (segid " " and resid 50 and name HD22) 3.061 1.171 1.171 weight 1.000 ! spec=CNOE, no=652, id=289, vol=2.987677e+07
or (segid " " and resid 45 and name HB1) (segid " " and resid 50 and name HD21)
or (segid " " and resid 45 and name HB1) (segid " " and resid 50 and name HD23)
assign (segid " " and resid 45 and name HB2) (segid " " and resid 50 and name HD12) 2.860 1.023 1.023 weight 1.000 ! spec=CNOE, no=654, id=291, vol=4.487605e+07
or (segid " " and resid 45 and name HB2) (segid " " and resid 50 and name HD11)
or (segid " " and resid 45 and name HB2) (segid " " and resid 50 and name HD13)
assign (segid " " and resid 35 and name HA2) (segid " " and resid 34 and name HN) 3.246 1.317 1.317 weight 1.000 ! spec=CNOE, no=663, id=296, vol=2.099006e+07
assign (segid " " and resid 35 and name HA2) (segid " " and resid 36 and name HN) 3.012 1.134 1.134 weight 1.000 ! spec=CNOE, no=665, id=298, vol=3.289265e+07
assign (segid " " and resid 10 and name HA1) (segid " " and resid 10 and name HA2) 1.925 0.463 0.463 weight 1.000 ! spec=CNOE, no=666, id=299, vol=4.830654e+08
assign (segid " " and resid 45 and name HB1) (segid " " and resid 45 and name HD1) 2.776 0.963 0.963 weight 1.000 ! spec=CNOE, no=668, id=300, vol=5.366606e+07
assign (segid " " and resid 45 and name HB2) (segid " " and resid 45 and name HD1) 2.595 0.842 0.842 weight 1.000 ! spec=CNOE, no=669, id=301, vol=8.046670e+07
assign (segid " " and resid 45 and name HB1) (segid " " and resid 45 and name HN) 3.170 1.256 1.256 weight 1.000 ! spec=CNOE, no=671, id=303, vol=2.419515e+07
assign (segid " " and resid 45 and name HB1) (segid " " and resid 45 and name HA) 2.790 0.973 0.973 weight 1.000 ! spec=CNOE, no=672, id=304, vol=5.205129e+07
assign (segid " " and resid 45 and name HB2) (segid " " and resid 45 and name HA) 2.891 1.045 1.045 weight 1.000 ! spec=CNOE, no=673, id=305, vol=4.206086e+07
assign (segid " " and resid 47 and name HA1) (segid " " and resid 47 and name HA2) 2.118 0.561 0.561 weight 1.000 ! spec=CNOE, no=682, id=307, vol=2.719167e+08
assign (segid " " and resid 50 and name HB2) (segid " " and resid 50 and name HA) 2.664 0.887 0.887 weight 1.000 ! spec=CNOE, no=712, id=314, vol=6.866892e+07
assign (segid " " and resid 2 and name HA) (segid " " and resid 2 and name HB2) 2.663 0.886 0.886 weight 1.000 ! spec=CNOE, no=714, id=316, vol=6.894199e+07
assign (segid " " and resid 43 and name HA) (segid " " and resid 43 and name HB2) 2.665 0.888 0.888 weight 1.000 ! spec=CNOE, no=715, id=317, vol=6.856684e+07
assign (segid " " and resid 43 and name HA) (segid " " and resid 43 and name HB1) 2.755 0.949 0.949 weight 1.000 ! spec=CNOE, no=716, id=318, vol=5.611796e+07
assign (segid " " and resid 69 and name HA) (segid " " and resid 69 and name HB2) 2.160 0.583 0.583 weight 1.000 ! spec=CNOE, no=719, id=321, vol=2.419127e+08
assign (segid " " and resid 69 and name HA) (segid " " and resid 69 and name HB1) 2.343 0.686 0.686 weight 1.000 ! spec=CNOE, no=720, id=322, vol=1.485084e+08
assign (segid " " and resid 2 and name HA) (segid " " and resid 2 and name HB1) 2.597 0.843 0.843 weight 1.000 ! spec=CNOE, no=721, id=323, vol=8.010363e+07
assign (segid " " and resid 48 and name HA) (segid " " and resid 48 and name HG*) 2.277 0.648 0.648 weight 1.000 ! spec=CNOE, no=725, id=326, vol=1.764679e+08
assign (segid " " and resid 60 and name HA) (segid " " and resid 60 and name HB2) 2.639 0.871 0.871 weight 1.000 ! spec=CNOE, no=728, id=328, vol=7.265406e+07
assign (segid " " and resid 62 and name HA) (segid " " and resid 63 and name HN) 2.416 0.730 0.730 weight 1.000 ! spec=CNOE, no=731, id=331, vol=1.235536e+08
assign (segid " " and resid 1 and name HA) (segid " " and resid 2 and name HN) 2.432 0.739 0.739 weight 1.000 ! spec=CNOE, no=732, id=332, vol=1.186946e+08
assign (segid " " and resid 42 and name HA) (segid " " and resid 43 and name HN) 2.135 0.570 0.570 weight 1.000 ! spec=CNOE, no=733, id=333, vol=2.590494e+08
assign (segid " " and resid 48 and name HA) (segid " " and resid 48 and name HN) 2.632 0.866 0.866 weight 1.000 ! spec=CNOE, no=734, id=334, vol=7.389164e+07
assign (segid " " and resid 2 and name HA) (segid " " and resid 3 and name HN) 2.314 0.669 0.669 weight 1.000 ! spec=CNOE, no=735, id=335, vol=1.599561e+08
assign (segid " " and resid 43 and name HA) (segid " " and resid 44 and name HN) 2.348 0.689 0.689 weight 1.000 ! spec=CNOE, no=737, id=337, vol=1.466482e+08
assign (segid " " and resid 67 and name HA) (segid " " and resid 68 and name HN) 2.275 0.647 0.647 weight 1.000 ! spec=CNOE, no=741, id=339, vol=1.773936e+08
assign (segid " " and resid 54 and name HA) (segid " " and resid 55 and name HN) 2.456 0.754 0.754 weight 1.000 ! spec=CNOE, no=743, id=340, vol=1.119152e+08
assign (segid " " and resid 15 and name HA) (segid " " and resid 16 and name HN) 2.259 0.638 0.638 weight 1.000 ! spec=CNOE, no=746, id=343, vol=1.847312e+08
assign (segid " " and resid 50 and name HA) (segid " " and resid 51 and name HN) 2.456 0.754 0.754 weight 1.000 ! spec=CNOE, no=749, id=345, vol=1.119981e+08
assign (segid " " and resid 42 and name HA) (segid " " and resid 42 and name HG2) 2.120 0.562 0.562 weight 1.000 ! spec=CNOE, no=751, id=346, vol=2.702186e+08
assign (segid " " and resid 18 and name HB2) (segid " " and resid 18 and name HA) 2.482 0.770 0.770 weight 1.000 ! spec=CNOE, no=753, id=347, vol=1.049982e+08
assign (segid " " and resid 62 and name HA) (segid " " and resid 62 and name HB2) 2.300 0.662 0.662 weight 1.000 ! spec=CNOE, no=754, id=348, vol=1.657232e+08
assign (segid " " and resid 60 and name HA) (segid " " and resid 60 and name HB1) 2.666 0.888 0.888 weight 1.000 ! spec=CNOE, no=755, id=349, vol=6.842995e+07
assign (segid " " and resid 28 and name HB2) (segid " " and resid 28 and name HA) 1.999 0.499 0.499 weight 1.000 ! spec=CNOE, no=758, id=351, vol=3.850886e+08
or (segid " " and resid 28 and name HB1) (segid " " and resid 28 and name HA)
or (segid " " and resid 28 and name HB3) (segid " " and resid 28 and name HA)
assign (segid " " and resid 49 and name HA) (segid " " and resid 44 and name HG22) 3.511 1.059 1.059 weight 1.000 ! spec=CNOE, no=761, id=354, vol=4.034627e+07
or (segid " " and resid 49 and name HA) (segid " " and resid 44 and name HG21)
or (segid " " and resid 49 and name HA) (segid " " and resid 44 and name HG23)
assign (segid " " and resid 42 and name HA) (segid " " and resid 43 and name HD2*) 3.729 1.231 1.231 weight 1.000 ! spec=CNOE, no=762, id=355, vol=5.940420e+07
assign (segid " " and resid 4 and name HA) (segid " " and resid 4 and name HB2) 3.193 1.275 1.275 weight 1.000 ! spec=CNOE, no=766, id=359, vol=2.316820e+07
assign (segid " " and resid 4 and name HA) (segid " " and resid 4 and name HB1) 2.873 1.031 1.031 weight 1.000 ! spec=CNOE, no=767, id=360, vol=4.371916e+07
assign (segid " " and resid 4 and name HA) (segid " " and resid 14 and name HA) 3.086 1.191 1.191 weight 1.000 ! spec=CNOE, no=769, id=362, vol=2.841415e+07
assign (segid " " and resid 4 and name HA) (segid " " and resid 4 and name HD1) 2.947 1.086 1.086 weight 1.000 ! spec=CNOE, no=770, id=363, vol=3.750055e+07
assign (segid " " and resid 4 and name HA) (segid " " and resid 5 and name HN) 2.469 0.762 0.762 weight 1.000 ! spec=CNOE, no=771, id=364, vol=1.083939e+08
assign (segid " " and resid 4 and name HA) (segid " " and resid 15 and name HN) 3.537 1.564 1.564 weight 1.000 ! spec=CNOE, no=772, id=365, vol=1.254726e+07
assign (segid " " and resid 39 and name HA) (segid " " and resid 39 and name HN) 2.630 0.864 0.864 weight 1.000 ! spec=CNOE, no=778, id=367, vol=7.425431e+07
assign (segid " " and resid 42 and name HA) (segid " " and resid 42 and name HN) 2.691 0.905 0.905 weight 1.000 ! spec=CNOE, no=779, id=368, vol=6.464896e+07
assign (segid " " and resid 2 and name HA) (segid " " and resid 2 and name HN) 2.816 0.992 0.992 weight 1.000 ! spec=CNOE, no=783, id=372, vol=4.921017e+07
assign (segid " " and resid 68 and name HB2) (segid " " and resid 68 and name HA) 2.322 0.674 0.674 weight 1.000 ! spec=CNOE, no=787, id=374, vol=1.567462e+08
assign (segid " " and resid 28 and name HB*) (segid " " and resid 25 and name HA) 2.102 0.552 0.552 weight 1.000 ! spec=CNOE, no=790, id=375, vol=2.846434e+08
assign (segid " " and resid 21 and name HB1) (segid " " and resid 21 and name HA) 2.415 0.729 0.729 weight 1.000 ! spec=CNOE, no=791, id=376, vol=1.237030e+08
assign (segid " " and resid 21 and name HA) (segid " " and resid 21 and name HB2) 2.479 0.768 0.768 weight 1.000 ! spec=CNOE, no=792, id=377, vol=1.059436e+08
assign (segid " " and resid 25 and name HB2) (segid " " and resid 25 and name HA) 2.346 0.688 0.688 weight 1.000 ! spec=CNOE, no=793, id=378, vol=1.472649e+08
assign (segid " " and resid 25 and name HB1) (segid " " and resid 25 and name HA) 2.436 0.742 0.742 weight 1.000 ! spec=CNOE, no=794, id=379, vol=1.176150e+08
assign (segid " " and resid 49 and name HA) (segid " " and resid 49 and name HG2) 2.176 0.592 0.592 weight 1.000 ! spec=CNOE, no=798, id=383, vol=2.311288e+08
assign (segid " " and resid 64 and name HA) (segid " " and resid 64 and name HN) 2.573 0.827 0.827 weight 1.000 ! spec=CNOE, no=807, id=390, vol=8.472800e+07
assign (segid " " and resid 63 and name HA) (segid " " and resid 64 and name HN) 2.357 0.695 0.695 weight 1.000 ! spec=CNOE, no=808, id=391, vol=1.432063e+08
assign (segid " " and resid 63 and name HA) (segid " " and resid 63 and name HN) 2.791 0.974 0.974 weight 1.000 ! spec=CNOE, no=809, id=392, vol=5.192281e+07
assign (segid " " and resid 59 and name HA) (segid " " and resid 59 and name HN) 2.378 0.707 0.707 weight 1.000 ! spec=CNOE, no=812, id=394, vol=1.358516e+08
assign (segid " " and resid 59 and name HB1) (segid " " and resid 59 and name HA) 2.501 0.782 0.782 weight 1.000 ! spec=CNOE, no=820, id=396, vol=1.002618e+08
assign (segid " " and resid 56 and name HD12) (segid " " and resid 56 and name HA) 2.173 0.590 0.590 weight 1.000 ! spec=CNOE, no=822, id=397, vol=2.330336e+08
or (segid " " and resid 56 and name HD11) (segid " " and resid 56 and name HA)
or (segid " " and resid 56 and name HD13) (segid " " and resid 56 and name HA)
assign (segid " " and resid 56 and name HB1) (segid " " and resid 56 and name HA) 2.433 0.740 0.740 weight 1.000 ! spec=CNOE, no=823, id=398, vol=1.183858e+08
assign (segid " " and resid 3 and name HA) (segid " " and resid 4 and name HN) 2.312 0.668 0.668 weight 1.000 ! spec=CNOE, no=829, id=400, vol=1.609500e+08
assign (segid " " and resid 70 and name HA) (segid " " and resid 71 and name HN) 2.381 0.708 0.708 weight 1.000 ! spec=CNOE, no=832, id=402, vol=1.349227e+08
assign (segid " " and resid 13 and name HA) (segid " " and resid 14 and name HN) 2.491 0.776 0.776 weight 1.000 ! spec=CNOE, no=836, id=403, vol=1.027566e+08
assign (segid " " and resid 13 and name HA) (segid " " and resid 13 and name HN) 3.087 1.192 1.192 weight 1.000 ! spec=CNOE, no=839, id=406, vol=2.835902e+07
assign (segid " " and resid 55 and name HA) (segid " " and resid 56 and name HN) 2.604 0.848 0.848 weight 1.000 ! spec=CNOE, no=840, id=407, vol=7.878223e+07
assign (segid " " and resid 55 and name HA) (segid " " and resid 23 and name HN) 2.954 1.091 1.091 weight 1.000 ! spec=CNOE, no=841, id=408, vol=3.695781e+07
assign (segid " " and resid 24 and name HA) (segid " " and resid 27 and name HN) 3.283 0.968 0.968 weight 1.000 ! spec=CNOE, no=844, id=410, vol=5.291681e+07
assign (segid " " and resid 13 and name HA) (segid " " and resid 13 and name HB) 2.452 0.751 0.751 weight 1.000 ! spec=CNOE, no=854, id=417, vol=1.130989e+08
assign (segid " " and resid 17 and name HA) (segid " " and resid 17 and name HB) 2.206 0.608 0.608 weight 1.000 ! spec=CNOE, no=857, id=419, vol=2.129718e+08
assign (segid " " and resid 17 and name HG2*) (segid " " and resid 17 and name HA) 2.214 0.613 0.613 weight 1.000 ! spec=CNOE, no=860, id=421, vol=2.082775e+08
assign (segid " " and resid 3 and name HD1*) (segid " " and resid 3 and name HA) 3.387 0.712 0.712 weight 1.000 ! +1A spec=CNOE, no=865, id=424, vol=1.326652e+08
assign (segid " " and resid 70 and name HA) (segid " " and resid 71 and name HD2*) 2.382 0.710 0.710 weight 1.000 ! spec=CNOE, no=866, id=425, vol=1.343220e+08
assign (segid " " and resid 66 and name HA) (segid " " and resid 67 and name HN) 2.397 0.718 0.718 weight 1.000 ! spec=CNOE, no=873, id=429, vol=1.295639e+08
assign (segid " " and resid 66 and name HA) (segid " " and resid 4 and name HN) 2.843 1.010 1.010 weight 1.000 ! spec=CNOE, no=875, id=430, vol=4.649624e+07
assign (segid " " and resid 70 and name HA) (segid " " and resid 70 and name HN) 3.041 1.156 1.156 weight 1.000 ! spec=CNOE, no=877, id=431, vol=3.103143e+07
assign (segid " " and resid 24 and name HA) (segid " " and resid 24 and name HN) 2.856 1.019 1.019 weight 1.000 ! spec=CNOE, no=878, id=432, vol=4.529562e+07
assign (segid " " and resid 12 and name HA) (segid " " and resid 13 and name HN) 2.372 0.703 0.703 weight 1.000 ! spec=CNOE, no=879, id=433, vol=1.379908e+08
assign (segid " " and resid 12 and name HA) (segid " " and resid 5 and name HN) 2.946 1.085 1.085 weight 1.000 ! spec=CNOE, no=882, id=434, vol=3.755986e+07
assign (segid " " and resid 23 and name HA) (segid " " and resid 56 and name HD1*) 3.831 1.222 1.222 weight 1.000 ! spec=CNOE, no=889, id=438, vol=1.989273e+08
assign (segid " " and resid 61 and name HG11) (segid " " and resid 61 and name HA) 2.890 1.044 1.044 weight 1.000 ! spec=CNOE, no=890, id=439, vol=4.217602e+07
assign (segid " " and resid 61 and name HA) (segid " " and resid 61 and name HG12) 2.912 1.060 1.060 weight 1.000 ! spec=CNOE, no=891, id=440, vol=4.029799e+07
assign (segid " " and resid 61 and name HA) (segid " " and resid 61 and name HB) 3.056 1.167 1.167 weight 1.000 ! spec=CNOE, no=893, id=442, vol=3.017859e+07
assign (segid " " and resid 23 and name HA) (segid " " and resid 26 and name HB) 2.505 0.784 0.784 weight 1.000 ! spec=CNOE, no=894, id=443, vol=9.947956e+07
assign (segid " " and resid 23 and name HA) (segid " " and resid 23 and name HG12) 3.115 1.213 1.213 weight 1.000 ! spec=CNOE, no=896, id=444, vol=2.690191e+07
assign (segid " " and resid 61 and name HA) (segid " " and resid 62 and name HN) 2.363 0.698 0.698 weight 1.000 ! spec=CNOE, no=898, id=445, vol=1.409432e+08
assign (segid " " and resid 23 and name HA) (segid " " and resid 23 and name HN) 2.808 0.986 0.986 weight 1.000 ! spec=CNOE, no=900, id=446, vol=5.011353e+07
assign (segid " " and resid 30 and name HA) (segid " " and resid 30 and name HB) 2.721 0.926 0.926 weight 1.000 ! spec=CNOE, no=913, id=449, vol=6.046264e+07
assign (segid " " and resid 30 and name HA) (segid " " and resid 33 and name HB2) 3.519 1.672 1.672 weight 1.000 ! spec=CNOE, no=914, id=450, vol=1.578889e+08
assign (segid " " and resid 30 and name HA) (segid " " and resid 33 and name HB1) 3.575 1.533 1.533 weight 1.000 ! spec=CNOE, no=915, id=451, vol=4.353932e+07
assign (segid " " and resid 38 and name HG2) (segid " " and resid 38 and name HA) 2.882 0.651 0.651 weight 1.000 ! spec=CNOE, no=922, id=453, vol=1.739769e+08
assign (segid " " and resid 12 and name HB) (segid " " and resid 12 and name HA) 2.805 0.984 0.984 weight 1.000 ! spec=CNOE, no=949, id=461, vol=5.040493e+07
assign (segid " " and resid 55 and name HB) (segid " " and resid 56 and name HN) 2.554 0.816 0.816 weight 1.000 ! spec=CNOE, no=958, id=466, vol=8.843278e+07
assign (segid " " and resid 55 and name HA) (segid " " and resid 55 and name HB) 2.627 0.862 0.862 weight 1.000 ! spec=CNOE, no=962, id=468, vol=7.478896e+07
assign (segid " " and resid 15 and name HB2) (segid " " and resid 15 and name HA) 2.804 0.983 0.983 weight 1.000 ! spec=CNOE, no=1000, id=477, vol=5.048755e+07
assign (segid " " and resid 15 and name HB1) (segid " " and resid 15 and name HA) 2.739 0.938 0.938 weight 1.000 ! spec=CNOE, no=1001, id=478, vol=5.811825e+07
assign (segid " " and resid 15 and name HB2) (segid " " and resid 15 and name HD12) 2.210 0.611 0.611 weight 1.000 ! spec=CNOE, no=1007, id=482, vol=2.107582e+08
or (segid " " and resid 15 and name HB2) (segid " " and resid 15 and name HD11)
or (segid " " and resid 15 and name HB2) (segid " " and resid 15 and name HD13)
assign (segid " " and resid 43 and name HB1) (segid " " and resid 43 and name HD2*) 2.817 0.615 0.615 weight 1.000 ! spec=CNOE, no=1008, id=483, vol=2.066004e+08
assign (segid " " and resid 15 and name HB1) (segid " " and resid 15 and name HD12) 2.851 0.691 0.691 weight 1.000 ! spec=CNOE, no=1009, id=484, vol=1.453172e+08
or (segid " " and resid 15 and name HB1) (segid " " and resid 15 and name HD11)
or (segid " " and resid 15 and name HB1) (segid " " and resid 15 and name HD13)
assign (segid " " and resid 69 and name HB2) (segid " " and resid 69 and name HB1) 2.006 0.503 0.503 weight 1.000 ! spec=CNOE, no=1011, id=485, vol=3.769621e+08
assign (segid " " and resid 43 and name HB1) (segid " " and resid 43 and name HB2) 1.965 0.482 0.482 weight 1.000 ! spec=CNOE, no=1014, id=487, vol=4.270904e+08
assign (segid " " and resid 43 and name HB2) (segid " " and resid 43 and name HN) 2.804 0.983 0.983 weight 1.000 ! spec=CNOE, no=1030, id=492, vol=5.051407e+07
assign (segid " " and resid 31 and name HA) (segid " " and resid 36 and name HN) 3.222 0.674 0.674 weight 1.000 ! spec=CNOE, no=1035, id=493, vol=1.568019e+08
assign (segid " " and resid 23 and name HA) (segid " " and resid 26 and name HG12) 3.818 0.856 0.856 weight 1.000 ! spec=CNOE, no=1037, id=494, vol=7.636451e+07
or (segid " " and resid 23 and name HA) (segid " " and resid 26 and name HG11)
or (segid " " and resid 23 and name HA) (segid " " and resid 26 and name HG13)
assign (segid " " and resid 59 and name HE1) (segid " " and resid 58 and name HB1) 3.584 0.969 0.969 weight 1.000 ! spec=CNOE, no=1038, id=495, vol=5.275729e+07
assign (segid " " and resid 59 and name HE1) (segid " " and resid 51 and name HB2) 3.891 1.118 1.118 weight 1.000 ! spec=CNOE, no=1039, id=496, vol=3.428772e+07
assign (segid " " and resid 6 and name HA) (segid " " and resid 6 and name HB1) 2.634 0.867 0.867 weight 1.000 ! spec=CNOE, no=1047, id=497, vol=7.359883e+07
assign (segid " " and resid 71 and name HA) (segid " " and resid 72 and name HN) 2.443 0.746 0.746 weight 1.000 ! spec=CNOE, no=1054, id=501, vol=1.155816e+08
assign (segid " " and resid 43 and name HA) (segid " " and resid 43 and name HN) 3.034 1.151 1.151 weight 1.000 ! spec=CNOE, no=1055, id=502, vol=3.149094e+07
assign (segid " " and resid 56 and name HA) (segid " " and resid 59 and name HN) 2.745 0.942 0.942 weight 1.000 ! spec=CNOE, no=1064, id=507, vol=5.741136e+07
assign (segid " " and resid 3 and name HA) (segid " " and resid 64 and name HN) 2.955 1.091 1.091 weight 1.000 ! spec=CNOE, no=1067, id=508, vol=3.690765e+07
assign (segid " " and resid 56 and name HA) (segid " " and resid 56 and name HN) 2.887 1.042 1.042 weight 1.000 ! spec=CNOE, no=1069, id=510, vol=4.244814e+07
assign (segid " " and resid 36 and name HB) (segid " " and resid 36 and name HA) 2.423 0.734 0.734 weight 1.000 ! spec=CNOE, no=1070, id=511, vol=1.213800e+08
assign (segid " " and resid 70 and name HA) (segid " " and resid 70 and name HB) 2.609 0.851 0.851 weight 1.000 ! spec=CNOE, no=1072, id=513, vol=7.790012e+07
assign (segid " " and resid 49 and name HB2) (segid " " and resid 49 and name HA) 2.160 0.583 0.583 weight 1.000 ! spec=CNOE, no=1083, id=523, vol=2.420768e+08
assign (segid " " and resid 28 and name HA) (segid " " and resid 28 and name HN) 2.418 0.731 0.731 weight 1.000 ! spec=CNOE, no=1085, id=525, vol=1.228360e+08
assign (segid " " and resid 63 and name HA) (segid " " and resid 3 and name HD12) 3.519 1.293 1.293 weight 1.000 ! spec=CNOE, no=1092, id=529, vol=4.896070e+07
or (segid " " and resid 63 and name HA) (segid " " and resid 3 and name HD11)
or (segid " " and resid 63 and name HA) (segid " " and resid 3 and name HD13)
assign (segid " " and resid 4 and name HD1) (segid " " and resid 4 and name HB1) 3.686 1.698 1.698 weight 1.000 ! spec=CNOE, no=1103, id=530, vol=9.797408e+06
assign (segid " " and resid 55 and name HA) (segid " " and resid 56 and name HD12) 3.327 1.383 1.383 weight 1.000 ! spec=CNOE, no=1109, id=531, vol=1.811774e+07
or (segid " " and resid 55 and name HA) (segid " " and resid 56 and name HD11)
or (segid " " and resid 55 and name HA) (segid " " and resid 56 and name HD13)
assign (segid " " and resid 55 and name HA) (segid " " and resid 56 and name HB2) 3.501 1.532 1.532 weight 1.000 ! spec=CNOE, no=1113, id=532, vol=1.334613e+07
assign (segid " " and resid 36 and name HA) (segid " " and resid 36 and name HG22) 2.263 0.640 0.640 weight 1.000 ! spec=CNOE, no=1121, id=533, vol=1.828285e+08
or (segid " " and resid 36 and name HA) (segid " " and resid 36 and name HG21)
or (segid " " and resid 36 and name HA) (segid " " and resid 36 and name HG23)
assign (segid " " and resid 59 and name HE1) (segid " " and resid 59 and name HD1) 2.492 0.776 0.776 weight 1.000 ! spec=CNOE, no=1136, id=538, vol=1.025305e+08
assign (segid " " and resid 43 and name HA) (segid " " and resid 43 and name HD2*) 2.334 0.681 0.681 weight 1.000 ! spec=CNOE, no=1139, id=540, vol=1.519274e+08
assign (segid " " and resid 43 and name HD2*) (segid " " and resid 44 and name HN) 3.612 1.253 1.253 weight 1.000 ! spec=CNOE, no=1141, id=541, vol=7.735629e+07
assign (segid " " and resid 50 and name HD1*) (segid " " and resid 50 and name HN) 3.032 1.149 1.149 weight 1.000 ! spec=CNOE, no=1145, id=542, vol=3.159396e+07
assign (segid " " and resid 50 and name HB2) (segid " " and resid 50 and name HN) 3.017 1.138 1.138 weight 1.000 ! spec=CNOE, no=1147, id=544, vol=3.253811e+07
assign (segid " " and resid 69 and name HB1) (segid " " and resid 69 and name HN) 3.130 1.225 1.225 weight 1.000 ! spec=CNOE, no=1161, id=549, vol=2.612230e+07
assign (segid " " and resid 67 and name HD12) (segid " " and resid 67 and name HA) 2.848 0.749 0.749 weight 1.000 ! spec=CNOE, no=1164, id=550, vol=1.141999e+08
or (segid " " and resid 67 and name HD11) (segid " " and resid 67 and name HA)
or (segid " " and resid 67 and name HD13) (segid " " and resid 67 and name HA)
assign (segid " " and resid 71 and name HB1) (segid " " and resid 71 and name HA) 2.835 1.004 1.004 weight 1.000 ! spec=CNOE, no=1171, id=553, vol=4.735152e+07
assign (segid " " and resid 61 and name HD1*) (segid " " and resid 56 and name HD2*) 2.965 1.099 1.099 weight 1.000 ! spec=CNOE, no=1176, id=554, vol=3.616224e+07
assign (segid " " and resid 36 and name HB) (segid " " and resid 36 and name HG2*) 1.980 0.490 0.490 weight 1.000 ! spec=CNOE, no=1177, id=555, vol=4.079835e+08
assign (segid " " and resid 13 and name HG2*) (segid " " and resid 14 and name HN) 2.678 0.897 0.897 weight 1.000 ! spec=CNOE, no=1178, id=556, vol=6.655510e+07
assign (segid " " and resid 1 and name HE*) (segid " " and resid 62 and name HA) 2.419 0.731 0.731 weight 1.000 ! spec=CNOE, no=1184, id=558, vol=1.226429e+08
assign (segid " " and resid 1 and name HE*) (segid " " and resid 61 and name HN) 3.800 2.200 2.200 weight 1.000 ! spec=CNOE, no=1186, id=559, vol=3.055796e+07
assign (segid " " and resid 69 and name HD2*) (segid " " and resid 69 and name HN) 3.045 1.159 1.159 weight 1.000 ! spec=CNOE, no=1187, id=560, vol=3.082030e+07
assign (segid " " and resid 23 and name HA) (segid " " and resid 23 and name HD1*) 2.327 0.677 0.677 weight 1.000 ! spec=CNOE, no=1190, id=561, vol=1.547837e+08
assign (segid " " and resid 23 and name HA) (segid " " and resid 23 and name HG11) 3.127 1.222 1.222 weight 1.000 ! spec=CNOE, no=1194, id=562, vol=2.627908e+07
assign (segid " " and resid 18 and name HA) (segid " " and resid 19 and name HD2) 2.399 0.719 0.719 weight 1.000 ! spec=CNOE, no=1197, id=563, vol=1.289571e+08
assign (segid " " and resid 43 and name HA) (segid " " and resid 69 and name HA) 2.827 0.877 0.877 weight 1.000 ! spec=CNOE, no=1198, id=561, vol=1.547837e+08
assign (segid " " and resid 61 and name HG2*) (segid " " and resid 61 and name HN) 3.899 1.019 1.019 weight 1.000 ! spec=CNOE, no=1199, id=563, vol=1.289571e+08
assign (segid " " and resid 67 and name HA) (segid " " and resid 68 and name HN) 3.299 0.819 0.819 weight 1.000 ! spec=CNOE, no=1200, id=563, vol=1.289571e+08
assign (segid " " and resid 68 and name HA) (segid " " and resid 69 and name HN) 3.299 0.819 0.819 weight 1.000 ! spec=CNOE, no=1201, id=563, vol=1.289571e+08
assign (segid " " and resid 7 and name HG2*) (segid " " and resid 11 and name HB*) 3.299 0.819 0.819 weight 1.000 ! spec=CNOE, no=1204, id=563, vol=1.289571e+08
assign (segid " " and resid 7 and name HG2*) (segid " " and resid 5 and name HG1*) 3.299 0.819 0.819 weight 1.000 ! spec=CNOE, no=1207, id=563, vol=1.289571e+08
assign (segid " " and resid 69 and name HB2) (segid " " and resid 7 and name HG2*) 3.299 0.819 0.819 weight 1.000 ! spec=CNOE, no=1208, id=563, vol=1.289571e+08
assign (segid " " and resid 61 and name HD1*) (segid " " and resid 45 and name HE*) 3.899 1.219 1.219 weight 1.000 ! spec=CNOE, no=1209, id=563, vol=1.289571e+08
assign (segid " " and resid 30 and name HD1*) (segid " " and resid 15 and name HD2*) 3.299 0.819 0.819 weight 1.000 ! spec=CNOE, no=1210, id=563, vol=1.289571e+08
assign (segid " " and resid 61 and name HD1*) (segid " " and resid 45 and name HD2*) 3.299 0.819 0.819 weight 1.000 ! spec=CNOE, no=1211, id=563, vol=1.289571e+08
assign (segid " " and resid 61 and name HD1*) (segid " " and resid 61 and name HN) 3.299 0.819 0.819 weight 1.000 ! spec=CNOE, no=1213, id=563, vol=1.289571e+08
assign (segid " " and resid 43 and name HD1*) (segid " " and resid 43 and name HB2) 2.559 0.818 0.818 weight 1.000 ! spec=CNOE, no=1217, id=700, vol=1.230679e+08
assign (segid " " and resid 67 and name HD1*) (segid " " and resid 43 and name HB1) 3.859 0.818 0.818 weight 1.000 ! spec=CNOE, no=1223, id=700, vol=1.230679e+08
assign (segid " " and resid 41 and name HA) (segid " " and resid 71 and name HA) 3.574 1.106 1.106 weight 1.000 ! spec=CNOE, no=1225, id=788, vol=4.989233e+07
assign (segid " " and resid 71 and name HA) (segid " " and resid 41 and name HA) 3.574 1.106 1.106 weight 1.000 ! spec=CNOE, no=1226, id=788, vol=4.989233e+07
assign (segid " " and resid 66 and name HA) (segid " " and resid 5 and name HA) 4.574 1.106 1.106 weight 1.000 ! +1A, spec=CNOE, no=1230, id=788, vol=4.989233e+07
assign (segid " " and resid 2 and name HN) (segid " " and resid 2 and name HB1) 2.658 0.883 0.883 weight 1.000 ! spec=NNOE, no=10, id=567, vol=9.786807e+07
assign (segid " " and resid 2 and name HN) (segid " " and resid 2 and name HB2) 2.949 1.087 1.087 weight 1.000 ! spec=NNOE, no=11, id=568, vol=5.254919e+07
assign (segid " " and resid 3 and name HN) (segid " " and resid 3 and name HA) 3.171 1.257 1.257 weight 1.000 ! spec=NNOE, no=19, id=574, vol=3.400830e+07
assign (segid " " and resid 3 and name HN) (segid " " and resid 2 and name HB2) 2.921 1.066 1.066 weight 1.000 ! spec=NNOE, no=21, id=576, vol=5.567050e+07
assign (segid " " and resid 3 and name HN) (segid " " and resid 14 and name HG2*) 2.815 0.991 0.991 weight 1.000 ! spec=NNOE, no=22, id=577, vol=6.942180e+07
assign (segid " " and resid 3 and name HN) (segid " " and resid 3 and name HG22) 2.670 0.891 0.891 weight 1.000 ! spec=NNOE, no=23, id=578, vol=9.538537e+07
or (segid " " and resid 3 and name HN) (segid " " and resid 3 and name HG21)
or (segid " " and resid 3 and name HN) (segid " " and resid 3 and name HG23)
assign (segid " " and resid 4 and name HA) (segid " " and resid 4 and name HN) 3.084 1.189 1.189 weight 1.000 ! spec=NNOE, no=27, id=582, vol=4.014142e+07
assign (segid " " and resid 4 and name HN) (segid " " and resid 4 and name HB2) 2.903 1.053 1.053 weight 1.000 ! spec=NNOE, no=29, id=584, vol=5.770622e+07
assign (segid " " and resid 3 and name HB) (segid " " and resid 4 and name HN) 2.579 0.831 0.831 weight 1.000 ! spec=NNOE, no=30, id=585, vol=1.175076e+08
assign (segid " " and resid 4 and name HN) (segid " " and resid 14 and name HG2*) 3.135 1.229 1.229 weight 1.000 ! spec=NNOE, no=31, id=586, vol=3.638177e+07
assign (segid " " and resid 4 and name HN) (segid " " and resid 3 and name HD12) 4.859 1.022 1.022 weight 1.000 ! +1A spec=NNOE, no=32, id=587, vol=6.319926e+07
assign (segid " " and resid 4 and name HN) (segid " " and resid 4 and name HB1) 3.091 1.194 1.194 weight 1.000 ! spec=NNOE, no=33, id=588, vol=3.964320e+07
assign (segid " " and resid 5 and name HN) (segid " " and resid 5 and name HA) 3.115 1.213 1.213 weight 1.000 ! spec=NNOE, no=37, id=592, vol=3.782420e+07
assign (segid " " and resid 5 and name HN) (segid " " and resid 4 and name HB1) 3.188 1.270 1.270 weight 1.000 ! spec=NNOE, no=38, id=593, vol=3.291504e+07
assign (segid " " and resid 5 and name HB) (segid " " and resid 5 and name HN) 2.741 0.939 0.939 weight 1.000 ! spec=NNOE, no=39, id=594, vol=8.139716e+07
assign (segid " " and resid 5 and name HN) (segid " " and resid 12 and name HG21) 3.040 1.155 1.155 weight 1.000 ! spec=NNOE, no=40, id=595, vol=4.373766e+07
or (segid " " and resid 5 and name HN) (segid " " and resid 12 and name HG22)
or (segid " " and resid 5 and name HN) (segid " " and resid 12 and name HG23)
assign (segid " " and resid 6 and name HN) (segid " " and resid 5 and name HN) 3.314 1.373 1.373 weight 1.000 ! spec=NNOE, no=42, id=597, vol=2.607844e+07
assign (segid " " and resid 6 and name HN) (segid " " and resid 69 and name HN) 3.683 1.695 1.695 weight 1.000 ! spec=NNOE, no=43, id=598, vol=1.384657e+07
assign (segid " " and resid 6 and name HN) (segid " " and resid 5 and name HA) 2.487 0.773 0.773 weight 1.000 ! spec=NNOE, no=46, id=601, vol=1.459716e+08
assign (segid " " and resid 6 and name HN) (segid " " and resid 5 and name HB) 3.297 1.359 1.359 weight 1.000 ! spec=NNOE, no=51, id=606, vol=2.688898e+07
assign (segid " " and resid 6 and name HA) (segid " " and resid 7 and name HN) 2.278 0.649 0.649 weight 1.000 ! spec=NNOE, no=52, id=607, vol=2.470527e+08
assign (segid " " and resid 25 and name HB1) (segid " " and resid 22 and name HN) 2.917 1.064 1.064 weight 1.000 ! spec=NNOE, no=56, id=611, vol=5.603734e+07
assign (segid " " and resid 22 and name HN) (segid " " and resid 21 and name HB2) 3.008 1.131 1.131 weight 1.000 ! spec=NNOE, no=57, id=612, vol=4.662679e+07
assign (segid " " and resid 22 and name HN) (segid " " and resid 21 and name HB1) 2.994 1.121 1.121 weight 1.000 ! spec=NNOE, no=58, id=613, vol=4.793316e+07
assign (segid " " and resid 22 and name HN) (segid " " and resid 21 and name HA) 2.369 0.701 0.701 weight 1.000 ! spec=NNOE, no=59, id=614, vol=1.956350e+08
assign (segid " " and resid 5 and name HN) (segid " " and resid 13 and name HN) 2.838 1.007 1.007 weight 1.000 ! spec=NNOE, no=60, id=615, vol=6.605726e+07
assign (segid " " and resid 13 and name HB) (segid " " and resid 13 and name HN) 2.847 1.013 1.013 weight 1.000 ! spec=NNOE, no=63, id=618, vol=6.493376e+07
assign (segid " " and resid 12 and name HG21) (segid " " and resid 13 and name HN) 2.693 0.907 0.907 weight 1.000 ! spec=NNOE, no=65, id=620, vol=9.052243e+07
or (segid " " and resid 12 and name HG22) (segid " " and resid 13 and name HN)
or (segid " " and resid 12 and name HG23) (segid " " and resid 13 and name HN)
assign (segid " " and resid 14 and name HN) (segid " " and resid 13 and name HB) 3.024 1.143 1.143 weight 1.000 ! spec=NNOE, no=72, id=625, vol=4.517934e+07
assign (segid " " and resid 15 and name HN) (segid " " and resid 14 and name HA) 2.377 0.706 0.706 weight 1.000 ! spec=NNOE, no=75, id=628, vol=1.915164e+08
assign (segid " " and resid 14 and name HG2*) (segid " " and resid 15 and name HN) 2.646 0.875 0.875 weight 1.000 ! spec=NNOE, no=77, id=630, vol=1.006306e+08
assign (segid " " and resid 15 and name HB2) (segid " " and resid 15 and name HN) 2.428 0.737 0.737 weight 1.000 ! spec=NNOE, no=78, id=631, vol=1.685158e+08
assign (segid " " and resid 15 and name HN) (segid " " and resid 15 and name HD1*) 2.622 0.859 0.859 weight 1.000 ! spec=NNOE, no=79, id=632, vol=1.062983e+08
assign (segid " " and resid 16 and name HN) (segid " " and resid 15 and name HB1) 2.747 0.943 0.943 weight 1.000 ! spec=NNOE, no=82, id=635, vol=8.044322e+07
assign (segid " " and resid 16 and name HN) (segid " " and resid 15 and name HD1*) 2.812 0.988 0.988 weight 1.000 ! spec=NNOE, no=83, id=636, vol=6.985759e+07
assign (segid " " and resid 17 and name HN) (segid " " and resid 16 and name HA) 2.390 0.714 0.714 weight 1.000 ! spec=NNOE, no=85, id=638, vol=1.852037e+08
assign (segid " " and resid 17 and name HG2*) (segid " " and resid 17 and name HN) 2.983 1.113 1.113 weight 1.000 ! spec=NNOE, no=86, id=639, vol=4.898638e+07
assign (segid " " and resid 17 and name HN) (segid " " and resid 16 and name HG*) 3.805 1.284 1.284 weight 1.000 ! spec=NNOE, no=88, id=641, vol=3.188306e+07
assign (segid " " and resid 17 and name HN) (segid " " and resid 16 and name HB*) 3.042 1.157 1.157 weight 1.000 ! spec=NNOE, no=89, id=642, vol=4.357185e+07
assign (segid " " and resid 17 and name HN) (segid " " and resid 2 and name HA) 3.355 1.407 1.407 weight 1.000 ! spec=NNOE, no=90, id=643, vol=2.420472e+07
assign (segid " " and resid 20 and name HN) (segid " " and resid 18 and name HB1) 3.043 1.157 1.157 weight 1.000 ! spec=NNOE, no=99, id=647, vol=4.353693e+07
assign (segid " " and resid 21 and name HN) (segid " " and resid 20 and name HN) 2.831 1.002 1.002 weight 1.000 ! spec=NNOE, no=106, id=651, vol=6.709534e+07
assign (segid " " and resid 21 and name HN) (segid " " and resid 21 and name HA) 2.814 0.990 0.990 weight 1.000 ! spec=NNOE, no=108, id=652, vol=6.955030e+07
assign (segid " " and resid 21 and name HN) (segid " " and resid 20 and name HA) 3.115 1.213 1.213 weight 1.000 ! spec=NNOE, no=109, id=653, vol=3.783703e+07
assign (segid " " and resid 21 and name HN) (segid " " and resid 21 and name HB2) 2.457 0.754 0.754 weight 1.000 ! spec=NNOE, no=111, id=655, vol=1.571631e+08
assign (segid " " and resid 21 and name HN) (segid " " and resid 17 and name HG2*) 3.073 1.181 1.181 weight 1.000 ! spec=NNOE, no=115, id=659, vol=4.100990e+07
assign (segid " " and resid 21 and name HN) (segid " " and resid 55 and name HG2*) 3.305 1.365 1.365 weight 1.000 ! spec=NNOE, no=116, id=660, vol=2.650505e+07
assign (segid " " and resid 23 and name HN) (segid " " and resid 22 and name HB) 2.444 0.747 0.747 weight 1.000 ! spec=NNOE, no=118, id=662, vol=1.621365e+08
assign (segid " " and resid 23 and name HN) (segid " " and resid 23 and name HD1*) 2.971 1.103 1.103 weight 1.000 ! spec=NNOE, no=124, id=668, vol=5.024464e+07
assign (segid " " and resid 24 and name HN) (segid " " and resid 23 and name HB) 3.540 1.566 1.566 weight 1.000 ! spec=NNOE, no=127, id=670, vol=1.756686e+07
assign (segid " " and resid 24 and name HN) (segid " " and resid 22 and name HB) 3.857 1.860 1.860 weight 1.000 ! spec=NNOE, no=128, id=671, vol=1.048448e+07
assign (segid " " and resid 25 and name HA) (segid " " and resid 25 and name HN) 2.650 0.878 0.878 weight 1.000 ! spec=NNOE, no=132, id=674, vol=9.966054e+07
assign (segid " " and resid 24 and name HA) (segid " " and resid 25 and name HN) 3.137 1.230 1.230 weight 1.000 ! spec=NNOE, no=133, id=675, vol=3.622473e+07
assign (segid " " and resid 25 and name HB1) (segid " " and resid 25 and name HN) 2.489 0.774 0.774 weight 1.000 ! spec=NNOE, no=134, id=676, vol=1.453730e+08
assign (segid " " and resid 25 and name HA) (segid " " and resid 26 and name HN) 2.791 0.973 0.973 weight 1.000 ! spec=NNOE, no=140, id=682, vol=7.316059e+07
assign (segid " " and resid 23 and name HA) (segid " " and resid 26 and name HN) 3.024 1.143 1.143 weight 1.000 ! spec=NNOE, no=141, id=683, vol=4.518266e+07
assign (segid " " and resid 26 and name HN) (segid " " and resid 26 and name HA) 2.762 0.954 0.954 weight 1.000 ! spec=NNOE, no=142, id=684, vol=7.774041e+07
assign (segid " " and resid 26 and name HN) (segid " " and resid 25 and name HB2) 3.053 1.165 1.165 weight 1.000 ! spec=NNOE, no=143, id=685, vol=4.268228e+07
assign (segid " " and resid 26 and name HN) (segid " " and resid 26 and name HB) 2.365 0.699 0.699 weight 1.000 ! spec=NNOE, no=144, id=686, vol=1.972235e+08
assign (segid " " and resid 26 and name HN) (segid " " and resid 26 and name HG1*) 3.000 0.800 0.800 weight 1.000 ! spec=NNOE, no=146, id=688, vol=1.654693e+08
assign (segid " " and resid 27 and name HN) (segid " " and resid 27 and name HA) 2.657 0.882 0.882 weight 1.000 ! spec=NNOE, no=152, id=694, vol=9.827783e+07
assign (segid " " and resid 27 and name HN) (segid " " and resid 43 and name HD1*) 3.859 0.818 0.818 weight 1.000 ! spec=NNOE, no=158, id=700, vol=1.230679e+08
assign (segid " " and resid 28 and name HB2) (segid " " and resid 28 and name HN) 2.287 0.654 0.654 weight 1.000 ! spec=NNOE, no=161, id=703, vol=2.412846e+08
or (segid " " and resid 28 and name HB1) (segid " " and resid 28 and name HN)
or (segid " " and resid 28 and name HB3) (segid " " and resid 28 and name HN)
assign (segid " " and resid 29 and name HN) (segid " " and resid 26 and name HA) 2.967 1.100 1.100 weight 1.000 ! spec=NNOE, no=164, id=706, vol=5.063367e+07
assign (segid " " and resid 29 and name HB2) (segid " " and resid 29 and name HN) 2.496 0.779 0.779 weight 1.000 ! spec=NNOE, no=165, id=707, vol=1.429922e+08
assign (segid " " and resid 30 and name HN) (segid " " and resid 29 and name HN) 2.839 1.007 1.007 weight 1.000 ! spec=NNOE, no=171, id=711, vol=6.599490e+07
assign (segid " " and resid 30 and name HN) (segid " " and resid 27 and name HA) 3.167 1.254 1.254 weight 1.000 ! spec=NNOE, no=172, id=712, vol=3.423298e+07
assign (segid " " and resid 30 and name HN) (segid " " and resid 30 and name HA) 3.029 1.147 1.147 weight 1.000 ! spec=NNOE, no=173, id=713, vol=4.474633e+07
assign (segid " " and resid 30 and name HN) (segid " " and resid 30 and name HB) 2.565 0.822 0.822 weight 1.000 ! spec=NNOE, no=174, id=714, vol=1.213988e+08
assign (segid " " and resid 31 and name HA) (segid " " and resid 31 and name HN) 2.875 1.033 1.033 weight 1.000 ! spec=NNOE, no=179, id=718, vol=6.121098e+07
assign (segid " " and resid 32 and name HN) (segid " " and resid 31 and name HN) 2.812 0.988 0.988 weight 1.000 ! spec=NNOE, no=183, id=722, vol=6.991266e+07
assign (segid " " and resid 32 and name HN) (segid " " and resid 33 and name HN) 2.714 0.921 0.921 weight 1.000 ! spec=NNOE, no=192, id=731, vol=8.644247e+07
assign (segid " " and resid 33 and name HN) (segid " " and resid 33 and name HG2) 2.603 0.847 0.847 weight 1.000 ! spec=NNOE, no=198, id=735, vol=1.111139e+08
assign (segid " " and resid 33 and name HN) (segid " " and resid 34 and name HN) 2.526 0.797 0.797 weight 1.000 ! spec=NNOE, no=201, id=736, vol=1.330879e+08
assign (segid " " and resid 34 and name HN) (segid " " and resid 34 and name HA) 2.828 1.000 1.000 weight 1.000 ! spec=NNOE, no=202, id=737, vol=6.752140e+07
assign (segid " " and resid 34 and name HN) (segid " " and resid 31 and name HA) 3.161 1.249 1.249 weight 1.000 ! spec=NNOE, no=204, id=739, vol=3.460282e+07
assign (segid " " and resid 34 and name HN) (segid " " and resid 30 and name HG2*) 2.949 1.087 1.087 weight 1.000 ! spec=NNOE, no=207, id=741, vol=5.250872e+07
assign (segid " " and resid 35 and name HN) (segid " " and resid 34 and name HA) 2.986 1.115 1.115 weight 1.000 ! spec=NNOE, no=211, id=744, vol=4.871230e+07
assign (segid " " and resid 35 and name HA1) (segid " " and resid 35 and name HN) 2.390 0.714 0.714 weight 1.000 ! spec=NNOE, no=212, id=745, vol=1.854060e+08
assign (segid " " and resid 35 and name HA2) (segid " " and resid 35 and name HN) 2.210 0.610 0.610 weight 1.000 ! spec=NNOE, no=213, id=746, vol=2.966178e+08
assign (segid " " and resid 36 and name HA) (segid " " and resid 36 and name HN) 2.632 0.866 0.866 weight 1.000 ! spec=NNOE, no=217, id=750, vol=1.040080e+08
assign (segid " " and resid 35 and name HA1) (segid " " and resid 36 and name HN) 2.724 0.927 0.927 weight 1.000 ! spec=NNOE, no=218, id=751, vol=8.463694e+07
assign (segid " " and resid 36 and name HB) (segid " " and resid 36 and name HN) 2.150 0.578 0.578 weight 1.000 ! spec=NNOE, no=223, id=756, vol=3.494639e+08
assign (segid " " and resid 35 and name HN) (segid " " and resid 36 and name HN) 2.559 0.819 0.819 weight 1.000 ! spec=NNOE, no=226, id=757, vol=1.229919e+08
assign (segid " " and resid 36 and name HN) (segid " " and resid 36 and name HG12) 2.572 0.827 0.827 weight 1.000 ! spec=NNOE, no=230, id=761, vol=1.192476e+08
assign (segid " " and resid 40 and name HN) (segid " " and resid 41 and name HN) 2.537 0.805 0.805 weight 1.000 ! spec=NNOE, no=235, id=765, vol=1.294801e+08
assign (segid " " and resid 40 and name HN) (segid " " and resid 36 and name HG2*) 3.819 1.216 1.216 weight 1.000 ! spec=NNOE, no=239, id=769, vol=3.754798e+07
assign (segid " " and resid 41 and name HN) (segid " " and resid 40 and name HA) 2.997 1.122 1.122 weight 1.000 ! spec=NNOE, no=241, id=771, vol=4.770295e+07
assign (segid " " and resid 41 and name HA) (segid " " and resid 41 and name HN) 2.892 1.045 1.045 weight 1.000 ! spec=NNOE, no=242, id=772, vol=5.904149e+07
assign (segid " " and resid 41 and name HA) (segid " " and resid 42 and name HN) 2.389 0.713 0.713 weight 1.000 ! spec=NNOE, no=250, id=780, vol=1.858122e+08
assign (segid " " and resid 43 and name HN) (segid " " and resid 42 and name HA) 2.389 0.713 0.713 weight 1.000 ! spec=NNOE, no=254, id=780, vol=1.858122e+08
assign (segid " " and resid 43 and name HB1) (segid " " and resid 43 and name HN) 3.013 1.135 1.135 weight 1.000 ! spec=NNOE, no=257, id=787, vol=4.619396e+07
assign (segid " " and resid 43 and name HN) (segid " " and resid 43 and name HD2*) 2.974 1.106 1.106 weight 1.000 ! spec=NNOE, no=258, id=788, vol=4.989233e+07
assign (segid " " and resid 44 and name HN) (segid " " and resid 43 and name HA) 2.574 0.506 0.506 weight 1.000 ! spec=NNOE, no=259, id=788, vol=4.989233e+07
assign (segid " " and resid 44 and name HN) (segid " " and resid 68 and name HB1) 3.500 0.800 0.800 weight 1.000 ! spec=NNOE, no=449, id=932, vol=6.773641e+07
assign (segid " " and resid 44 and name HN) (segid " " and resid 43 and name HB1) 2.877 1.035 1.035 weight 1.000 ! spec=NNOE, no=263, id=793, vol=6.091053e+07
assign (segid " " and resid 44 and name HN) (segid " " and resid 44 and name HG2*) 3.583 0.968 0.968 weight 1.000 ! spec=NNOE, no=264, id=794, vol=7.429333e+07
assign (segid " " and resid 45 and name HB2) (segid " " and resid 45 and name HN) 2.926 1.070 1.070 weight 1.000 ! spec=NNOE, no=265, id=795, vol=5.502347e+07
assign (segid " " and resid 45 and name HN) (segid " " and resid 44 and name HG2*) 2.750 0.945 0.945 weight 1.000 ! spec=NNOE, no=267, id=797, vol=7.989496e+07
assign (segid " " and resid 45 and name HN) (segid " " and resid 50 and name HD2*) 3.349 1.402 1.402 weight 1.000 ! spec=NNOE, no=269, id=799, vol=2.448202e+07
assign (segid " " and resid 45 and name HN) (segid " " and resid 44 and name HA) 2.568 0.824 0.824 weight 1.000 ! spec=NNOE, no=270, id=800, vol=1.204632e+08
assign (segid " " and resid 45 and name HN) (segid " " and resid 48 and name HN) 3.244 1.315 1.315 weight 1.000 ! spec=NNOE, no=272, id=802, vol=2.965405e+07
assign (segid " " and resid 47 and name HN) (segid " " and resid 47 and name HA1) 3.017 1.138 1.138 weight 1.000 ! spec=NNOE, no=276, id=805, vol=4.580817e+07
assign (segid " " and resid 47 and name HN) (segid " " and resid 46 and name HA) 3.116 1.214 1.214 weight 1.000 ! spec=NNOE, no=277, id=806, vol=3.773296e+07
assign (segid " " and resid 47 and name HA2) (segid " " and resid 47 and name HN) 2.847 1.013 1.013 weight 1.000 ! spec=NNOE, no=278, id=807, vol=6.485274e+07
assign (segid " " and resid 47 and name HN) (segid " " and resid 46 and name HB*) 3.290 1.353 1.353 weight 1.000 ! spec=NNOE, no=281, id=808, vol=2.725581e+07
assign (segid " " and resid 47 and name HN) (segid " " and resid 44 and name HG2*) 3.123 1.219 1.219 weight 1.000 ! spec=NNOE, no=284, id=810, vol=3.720338e+07
assign (segid " " and resid 49 and name HN) (segid " " and resid 49 and name HB2) 2.641 0.872 0.872 weight 1.000 ! spec=NNOE, no=290, id=816, vol=1.017359e+08
assign (segid " " and resid 49 and name HA) (segid " " and resid 50 and name HN) 2.397 0.718 0.718 weight 1.000 ! spec=NNOE, no=292, id=818, vol=1.819797e+08
assign (segid " " and resid 50 and name HN) (segid " " and resid 50 and name HA) 3.059 1.170 1.170 weight 1.000 ! spec=NNOE, no=293, id=819, vol=4.217664e+07
assign (segid " " and resid 50 and name HN) (segid " " and resid 49 and name HG2) 3.015 1.136 1.136 weight 1.000 ! spec=NNOE, no=294, id=820, vol=4.597645e+07
assign (segid " " and resid 50 and name HN) (segid " " and resid 49 and name HB2) 3.037 1.153 1.153 weight 1.000 ! spec=NNOE, no=295, id=821, vol=4.401757e+07
assign (segid " " and resid 50 and name HB1) (segid " " and resid 50 and name HN) 2.800 0.800 0.800 weight 1.000 ! spec=NNOE, no=296, id=822, vol=1.982756e+08
assign (segid " " and resid 50 and name HN) (segid " " and resid 50 and name HD2*) 3.221 1.297 1.297 weight 1.000 ! spec=NNOE, no=300, id=825, vol=3.093202e+07
assign (segid " " and resid 52 and name HA) (segid " " and resid 52 and name HN) 2.042 0.521 0.521 weight 1.000 ! spec=NNOE, no=303, id=826, vol=4.763577e+08
assign (segid " " and resid 52 and name HN) (segid " " and resid 52 and name HB2) 2.214 0.613 0.613 weight 1.000 ! spec=NNOE, no=306, id=827, vol=2.930979e+08
assign (segid " " and resid 51 and name HG2) (segid " " and resid 52 and name HN) 2.821 0.673 0.673 weight 1.000 ! spec=NNOE, no=308, id=828, vol=2.212119e+08
assign (segid " " and resid 55 and name HN) (segid " " and resid 55 and name HA) 3.285 1.349 1.349 weight 1.000 ! spec=NNOE, no=309, id=829, vol=2.747965e+07
assign (segid " " and resid 55 and name HN) (segid " " and resid 55 and name HG2*) 2.850 1.015 1.015 weight 1.000 ! spec=NNOE, no=313, id=833, vol=6.444151e+07
assign (segid " " and resid 56 and name HB2) (segid " " and resid 56 and name HN) 2.727 0.929 0.929 weight 1.000 ! spec=NNOE, no=320, id=839, vol=8.406417e+07
assign (segid " " and resid 56 and name HD1*) (segid " " and resid 56 and name HN) 2.819 0.993 0.993 weight 1.000 ! spec=NNOE, no=323, id=842, vol=6.882764e+07
assign (segid " " and resid 57 and name HN) (segid " " and resid 56 and name HN) 2.785 0.970 0.970 weight 1.000 ! spec=NNOE, no=324, id=843, vol=7.398792e+07
assign (segid " " and resid 57 and name HN) (segid " " and resid 58 and name HN) 2.759 0.952 0.952 weight 1.000 ! spec=NNOE, no=325, id=844, vol=7.831116e+07
assign (segid " " and resid 55 and name HB) (segid " " and resid 57 and name HN) 2.795 0.977 0.977 weight 1.000 ! spec=NNOE, no=326, id=845, vol=7.239054e+07
assign (segid " " and resid 57 and name HN) (segid " " and resid 56 and name HB1) 2.940 1.081 1.081 weight 1.000 ! spec=NNOE, no=331, id=850, vol=5.347938e+07
assign (segid " " and resid 58 and name HN) (segid " " and resid 59 and name HN) 2.764 0.955 0.955 weight 1.000 ! spec=NNOE, no=336, id=855, vol=7.744740e+07
assign (segid " " and resid 58 and name HN) (segid " " and resid 55 and name HB) 3.048 1.162 1.162 weight 1.000 ! spec=NNOE, no=337, id=856, vol=4.304848e+07
assign (segid " " and resid 58 and name HN) (segid " " and resid 58 and name HA) 2.640 0.871 0.871 weight 1.000 ! spec=NNOE, no=338, id=857, vol=1.019374e+08
assign (segid " " and resid 58 and name HN) (segid " " and resid 58 and name HB2) 2.565 0.822 0.822 weight 1.000 ! spec=NNOE, no=340, id=859, vol=1.213999e+08
assign (segid " " and resid 58 and name HN) (segid " " and resid 58 and name HB1) 2.782 0.968 0.968 weight 1.000 ! spec=NNOE, no=341, id=860, vol=7.446434e+07
assign (segid " " and resid 59 and name HN) (segid " " and resid 58 and name HA) 3.076 1.183 1.183 weight 1.000 ! spec=NNOE, no=343, id=862, vol=4.079121e+07
assign (segid " " and resid 59 and name HN) (segid " " and resid 58 and name HB2) 3.132 1.226 1.226 weight 1.000 ! spec=NNOE, no=346, id=865, vol=3.659372e+07
assign (segid " " and resid 60 and name HA) (segid " " and resid 60 and name HN) 2.453 0.752 0.752 weight 1.000 ! spec=NNOE, no=350, id=868, vol=1.583654e+08
assign (segid " " and resid 60 and name HN) (segid " " and resid 59 and name HB1) 3.248 1.319 1.319 weight 1.000 ! spec=NNOE, no=352, id=869, vol=2.939728e+07
assign (segid " " and resid 60 and name HN) (segid " " and resid 59 and name HB2) 3.434 1.474 1.474 weight 1.000 ! spec=NNOE, no=353, id=870, vol=2.108390e+07
assign (segid " " and resid 60 and name HB2) (segid " " and resid 60 and name HN) 3.251 1.321 1.321 weight 1.000 ! spec=NNOE, no=354, id=871, vol=2.924526e+07
assign (segid " " and resid 61 and name HN) (segid " " and resid 60 and name HN) 2.989 1.117 1.117 weight 1.000 ! spec=NNOE, no=355, id=872, vol=4.845655e+07
assign (segid " " and resid 60 and name HA) (segid " " and resid 61 and name HN) 2.725 0.928 0.928 weight 1.000 ! spec=NNOE, no=357, id=874, vol=8.433189e+07
assign (segid " " and resid 61 and name HN) (segid " " and resid 61 and name HA) 3.036 1.152 1.152 weight 1.000 ! spec=NNOE, no=358, id=875, vol=4.413780e+07
assign (segid " " and resid 61 and name HB) (segid " " and resid 61 and name HN) 2.558 0.818 0.818 weight 1.000 ! spec=NNOE, no=360, id=876, vol=1.232972e+08
assign (segid " " and resid 61 and name HN) (segid " " and resid 61 and name HG12) 2.774 0.962 0.962 weight 1.000 ! spec=NNOE, no=361, id=877, vol=7.582494e+07
assign (segid " " and resid 61 and name HN) (segid " " and resid 61 and name HG2*) 3.028 1.146 1.146 weight 1.000 ! spec=NNOE, no=362, id=878, vol=4.483884e+07
assign (segid " " and resid 61 and name HN) (segid " " and resid 61 and name HG11) 3.344 1.398 1.398 weight 1.000 ! spec=NNOE, no=363, id=879, vol=2.469628e+07
assign (segid " " and resid 62 and name HA) (segid " " and resid 62 and name HN) 2.820 0.994 0.994 weight 1.000 ! spec=NNOE, no=364, id=880, vol=6.864180e+07
assign (segid " " and resid 62 and name HN) (segid " " and resid 62 and name HB2) 2.645 0.874 0.874 weight 1.000 ! spec=NNOE, no=366, id=882, vol=1.009130e+08
assign (segid " " and resid 62 and name HN) (segid " " and resid 62 and name HG2) 2.775 0.962 0.962 weight 1.000 ! spec=NNOE, no=368, id=884, vol=7.572110e+07
assign (segid " " and resid 64 and name HN) (segid " " and resid 3 and name HD1*) 3.174 1.259 1.259 weight 1.000 ! spec=NNOE, no=382, id=898, vol=3.378148e+07
assign (segid " " and resid 64 and name HN) (segid " " and resid 65 and name HN) 2.859 1.022 1.022 weight 1.000 ! spec=NNOE, no=383, id=899, vol=6.325464e+07
assign (segid " " and resid 65 and name HN) (segid " " and resid 65 and name HA) 2.418 0.731 0.731 weight 1.000 ! spec=NNOE, no=387, id=901, vol=1.729845e+08
assign (segid " " and resid 65 and name HN) (segid " " and resid 63 and name HA) 3.266 1.333 1.333 weight 1.000 ! spec=NNOE, no=388, id=902, vol=2.847906e+07
assign (segid " " and resid 64 and name HA) (segid " " and resid 65 and name HN) 3.036 1.152 1.152 weight 1.000 ! spec=NNOE, no=389, id=903, vol=4.413192e+07
assign (segid " " and resid 65 and name HN) (segid " " and resid 3 and name HB) 3.209 1.288 1.288 weight 1.000 ! spec=NNOE, no=391, id=904, vol=3.160636e+07
assign (segid " " and resid 65 and name HN) (segid " " and resid 3 and name HD1*) 2.899 1.050 1.050 weight 1.000 ! spec=NNOE, no=392, id=905, vol=5.822168e+07
assign (segid " " and resid 66 and name HN) (segid " " and resid 66 and name HA) 2.871 1.030 1.030 weight 1.000 ! spec=NNOE, no=395, id=907, vol=6.170953e+07
assign (segid " " and resid 66 and name HN) (segid " " and resid 65 and name HA) 2.648 0.877 0.877 weight 1.000 ! spec=NNOE, no=396, id=908, vol=1.001705e+08
assign (segid " " and resid 66 and name HB) (segid " " and resid 66 and name HN) 2.625 0.861 0.861 weight 1.000 ! spec=NNOE, no=397, id=909, vol=1.056324e+08
assign (segid " " and resid 68 and name HN) (segid " " and resid 67 and name HA) 2.878 0.768 0.768 weight 1.000 ! spec=NNOE, no=404, id=915, vol=1.491930e+08
assign (segid " " and resid 68 and name HB2) (segid " " and resid 68 and name HN) 2.735 0.935 0.935 weight 1.000 ! spec=NNOE, no=405, id=916, vol=8.245418e+07
assign (segid " " and resid 68 and name HN) (segid " " and resid 67 and name HD1*) 3.074 1.181 1.181 weight 1.000 ! spec=NNOE, no=407, id=918, vol=4.091453e+07
assign (segid " " and resid 69 and name HN) (segid " " and resid 68 and name HB1) 3.122 1.218 1.218 weight 1.000 ! spec=NNOE, no=410, id=921, vol=3.729432e+07
assign (segid " " and resid 69 and name HB2) (segid " " and resid 69 and name HN) 2.627 0.863 0.863 weight 1.000 ! spec=NNOE, no=411, id=922, vol=1.050575e+08
assign (segid " " and resid 69 and name HN) (segid " " and resid 69 and name HD1*) 3.757 0.950 0.950 weight 1.000 ! +1A spec=NNOE, no=413, id=924, vol=7.862624e+07
assign (segid " " and resid 72 and name HN) (segid " " and resid 71 and name HB2) 2.537 0.805 0.805 weight 1.000 ! spec=NNOE, no=437, id=931, vol=1.294211e+08
assign (segid " " and resid 72 and name HN) (segid " " and resid 71 and name HD1*) 2.827 0.999 0.999 weight 1.000 ! spec=NNOE, no=440, id=932, vol=6.773641e+07
assign (segid " " and resid 69 and name HN) (segid " " and resid 7 and name HA) 3.500 0.999 0.999 weight 1.000 ! spec=NNOE, no=442, id=932, vol=6.773641e+07
assign (segid " " and resid 69 and name HN) (segid " " and resid 6 and name HN) 3.500 0.999 0.999 weight 1.000 ! spec=NNOE, no=444, id=932, vol=6.773641e+07
assign (segid " " and resid 67 and name HN) (segid " " and resid 66 and name HG2*) 3.500 0.999 0.999 weight 1.000 ! spec=NNOE, no=446, id=932, vol=6.773641e+07
assign (segid " " and resid 67 and name HN) (segid " " and resid 67 and name HD1*) 3.500 0.999 0.999 weight 1.000 ! spec=NNOE, no=447, id=932, vol=6.773641e+07
assign (segid " " and resid 42 and name HN) (segid " " and resid 71 and name HA) 3.500 0.800 0.800 weight 1.000 ! spec=NNOE, no=449, id=932, vol=6.773641e+07
assign (segid " " and resid 42 and name HN) (segid " " and resid 69 and name HA) 3.800 0.800 0.800 weight 1.000 ! spec=NNOE, no=449, id=932, vol=6.773641e+07
assign (segid " " and resid 70 and name HN) (segid " " and resid 43 and name HA) 3.800 0.800 0.800 weight 1.000 ! spec=NNOE, no=455, id=932, vol=6.773641e+07
assign (segid " " and resid 44 and name HN) (segid " " and resid 69 and name HA) 3.800 0.800 0.800 weight 1.000 ! spec=NNOE, no=455, id=932, vol=6.773641e+07
assign (segid " " and resid 4 and name HN) (segid " " and resid 3 and name HG2*) 3.800 0.800 0.800 weight 1.000 ! spec=NNOE, no=458, id=932, vol=6.773641e+07
assign (segid " " and resid 61 and name HD1*) (segid " " and resid 59 and name HB2) 3.505 0.984 0.984 weight 1.000 ! spec=CNOE, no=63, id=24, vol=5.041152e+07
assign (segid " " and resid 3 and name HD12) (segid " " and resid 56 and name HD2*) 2.884 0.543 0.543 weight 1.000 ! spec=CNOE, no=75, id=34, vol=3.001224e+08
assign (segid " " and resid 61 and name HG2*) (segid " " and resid 1 and name HE*) 2.452 0.751 0.751 weight 1.000 ! spec=CNOE, no=113, id=46, vol=1.131431e+08
assign (segid " " and resid 44 and name HG22) (segid " " and resid 44 and name HB) 2.886 0.445 0.445 weight 1.000 ! spec=CNOE, no=119, id=52, vol=5.457867e+08
assign (segid " " and resid 28 and name HB*) (segid " " and resid 28 and name HN) 1.993 0.497 0.497 weight 1.000 ! spec=CNOE, no=139, id=64, vol=3.915689e+08
assign (segid " " and resid 28 and name HB*) (segid " " and resid 27 and name HN) 2.771 0.960 0.960 weight 1.000 ! spec=CNOE, no=150, id=71, vol=5.425122e+07
assign (segid " " and resid 12 and name HG2*) (segid " " and resid 4 and name HB1) 2.532 0.802 0.802 weight 1.000 ! spec=CNOE, no=177, id=90, vol=9.311758e+07
assign (segid " " and resid 14 and name HG2*) (segid " " and resid 14 and name HB) 2.881 0.595 0.595 weight 1.000 ! spec=CNOE, no=199, id=102, vol=2.281843e+08
or (segid " " and resid 12 and name HG2*) (segid " " and resid 12 and name HB)
assign (segid " " and resid 66 and name HG2*) (segid " " and resid 67 and name HN) 2.590 0.839 0.839 weight 1.000 ! spec=CNOE, no=211, id=108, vol=8.129526e+07
assign (segid " " and resid 14 and name HG2*) (segid " " and resid 14 and name HN) 3.255 0.753 0.753 weight 1.000 ! spec=CNOE, no=218, id=113, vol=1.122135e+08
assign (segid " " and resid 38 and name HG2) (segid " " and resid 38 and name HA) 2.851 0.691 0.691 weight 1.000 ! spec=CNOE, no=284, id=148, vol=1.452841e+08
or (segid " " and resid 56 and name HD2*) (segid " " and resid 56 and name HA)
assign (segid " " and resid 40 and name HB*) (segid " " and resid 40 and name HN) 2.609 0.851 0.851 weight 1.000 ! spec=CNOE, no=365, id=176, vol=7.794230e+07
assign (segid " " and resid 1 and name HG*) (segid " " and resid 17 and name HG1*) 3.571 1.031 1.031 weight 1.000 ! spec=CNOE, no=373, id=182, vol=4.382588e+07
assign (segid " " and resid 27 and name HB2) (segid " " and resid 28 and name HN) 2.561 0.820 0.820 weight 1.000 ! spec=CNOE, no=435, id=206, vol=8.696949e+07
or (segid " " and resid 27 and name HB1) (segid " " and resid 28 and name HN)
assign (segid " " and resid 29 and name HB2) (segid " " and resid 29 and name HA) 2.470 0.763 0.763 weight 1.000 ! spec=CNOE, no=451, id=211, vol=1.082044e+08
or (segid " " and resid 1 and name HB*) (segid " " and resid 1 and name HA)
assign (segid " " and resid 5 and name HB) (segid " " and resid 5 and name HG2*) 2.882 0.542 0.542 weight 1.000 ! spec=CNOE, no=456, id=214, vol=3.017598e+08
assign (segid " " and resid 29 and name HB2) (segid " " and resid 15 and name HD2*) 3.215 0.855 0.855 weight 1.000 ! spec=CNOE, no=484, id=217, vol=7.681224e+07
assign (segid " " and resid 68 and name HB2) (segid " " and resid 67 and name HD1*) 3.316 1.374 1.374 weight 1.000 ! spec=CNOE, no=487, id=218, vol=1.848720e+07
assign (segid " " and resid 17 and name HG2*) (segid " " and resid 17 and name HB) 2.520 0.510 0.510 weight 1.000 ! spec=CNOE, no=499, id=223, vol=3.619829e+08
assign (segid " " and resid 17 and name HB) (segid " " and resid 18 and name HN) 3.200 0.800 0.800 weight 1.000 ! spec=CNOE, no=510, id=230, vol=1.774120e+08
assign (segid " " and resid 25 and name HB1) (segid " " and resid 22 and name HN) 2.860 0.819 0.819 weight 1.000 ! spec=CNOE, no=517, id=234, vol=8.727592e+07
assign (segid " " and resid 21 and name HB1) (segid " " and resid 26 and name HG2*) 2.766 0.956 0.956 weight 1.000 ! spec=CNOE, no=566, id=253, vol=5.485874e+07
assign (segid " " and resid 56 and name HB1) (segid " " and resid 56 and name HD1*) 2.497 0.780 0.780 weight 1.000 ! spec=CNOE, no=604, id=270, vol=1.012671e+08
assign (segid " " and resid 44 and name HG2*) (segid " " and resid 44 and name HB) 2.203 0.607 0.607 weight 1.000 ! spec=CNOE, no=607, id=272, vol=2.146779e+08
assign (segid " " and resid 1 and name HB2) (segid " " and resid 1 and name HA) 2.082 0.542 0.542 weight 1.000 ! spec=CNOE, no=711, id=313, vol=3.016509e+08
or (segid " " and resid 1 and name HB1) (segid " " and resid 1 and name HA)
assign (segid " " and resid 60 and name HA) (segid " " and resid 60 and name HN) 2.424 0.735 0.735 weight 1.000 ! spec=CNOE, no=730, id=330, vol=1.209834e+08
or (segid " " and resid 62 and name HA) (segid " " and resid 62 and name HN)
assign (segid " " and resid 49 and name HA) (segid " " and resid 44 and name HD1*) 2.881 0.770 0.770 weight 1.000 ! spec=CNOE, no=760, id=353, vol=1.052154e+08
assign (segid " " and resid 4 and name HA) (segid " " and resid 5 and name HG2*) 3.224 1.300 1.300 weight 1.000 ! spec=CNOE, no=764, id=357, vol=2.185902e+07
assign (segid " " and resid 4 and name HA) (segid " " and resid 12 and name HG2*) 3.269 1.335 1.335 weight 1.000 ! spec=CNOE, no=765, id=358, vol=2.014502e+07
assign (segid " " and resid 49 and name HA) (segid " " and resid 49 and name HN) 2.105 0.554 0.554 weight 1.000 ! spec=CNOE, no=780, id=369, vol=2.821254e+08
assign (segid " " and resid 25 and name HA) (segid " " and resid 28 and name HN) 3.272 0.645 0.645 weight 1.000 ! spec=CNOE, no=781, id=370, vol=1.783892e+08
assign (segid " " and resid 42 and name HA) (segid " " and resid 42 and name HD2) 2.649 0.877 0.877 weight 1.000 ! spec=CNOE, no=795, id=380, vol=7.105052e+07
assign (segid " " and resid 3 and name HA) (segid " " and resid 65 and name HN) 2.465 0.760 0.760 weight 1.000 ! spec=CNOE, no=831, id=401, vol=1.094279e+08
assign (segid " " and resid 31 and name HA) (segid " " and resid 35 and name HN) 3.082 0.710 0.710 weight 1.000 ! spec=CNOE, no=843, id=409, vol=1.343120e+08
assign (segid " " and resid 24 and name HA) (segid " " and resid 25 and name HN) 2.811 0.988 0.988 weight 1.000 ! spec=CNOE, no=845, id=411, vol=4.976452e+07
or (segid " " and resid 57 and name HA) (segid " " and resid 58 and name HN)
assign (segid " " and resid 24 and name HA) (segid " " and resid 27 and name HB*) 2.860 0.831 0.831 weight 1.000 ! spec=CNOE, no=848, id=413, vol=3.210567e+08
assign (segid " " and resid 24 and name HA) (segid " " and resid 28 and name HB*) 4.391 0.714 1.614 weight 1.000 ! spec=CNOE, no=851, id=416, vol=1.316199e+08
assign (segid " " and resid 12 and name HA) (segid " " and resid 6 and name HG2) 2.805 0.983 0.983 weight 1.000 ! spec=CNOE, no=887, id=437, vol=5.043575e+07
or (segid " " and resid 12 and name HA) (segid " " and resid 6 and name HG1)
assign (segid " " and resid 23 and name HA) (segid " " and resid 26 and name HN) 2.982 1.112 1.112 weight 1.000 ! spec=CNOE, no=901, id=447, vol=3.492297e+07
assign (segid " " and resid 30 and name HG2*) (segid " " and resid 30 and name HA) 2.010 0.505 0.505 weight 1.000 ! spec=CNOE, no=919, id=452, vol=3.720702e+08
assign (segid " " and resid 5 and name HG1*) (segid " " and resid 69 and name HB2) 2.072 0.537 0.537 weight 1.000 ! spec=CNOE, no=1006, id=481, vol=3.102186e+08
assign (segid " " and resid 6 and name HA) (segid " " and resid 6 and name HG1) 2.553 0.815 0.815 weight 1.000 ! spec=CNOE, no=1048, id=498, vol=8.874993e+07
or (segid " " and resid 6 and name HA) (segid " " and resid 6 and name HG2)
assign (segid " " and resid 52 and name HA) (segid " " and resid 52 and name HN) 2.150 0.578 0.578 weight 1.000 ! spec=CNOE, no=1060, id=503, vol=2.487870e+08
assign (segid " " and resid 33 and name HA) (segid " " and resid 34 and name HN) 2.900 1.052 1.052 weight 1.000 ! spec=CNOE, no=1089, id=527, vol=4.125474e+07
assign (segid " " and resid 56 and name HD1*) (segid " " and resid 56 and name HB2) 2.712 0.919 0.919 weight 1.000 ! spec=CNOE, no=1159, id=548, vol=6.171855e+07
assign (segid " " and resid 67 and name HD2*) (segid " " and resid 67 and name HA) 3.204 1.283 1.283 weight 1.000 ! spec=CNOE, no=1168, id=551, vol=2.271337e+07
assign (segid " " and resid 1 and name HB*) (segid " " and resid 2 and name HN) 2.631 0.866 0.866 weight 1.000 ! spec=NNOE, no=13, id=570, vol=1.040315e+08
assign (segid " " and resid 4 and name HN) (segid " " and resid 64 and name HN) 4.398 1.443 1.443 weight 1.000 ! +1A, spec=NNOE, no=24, id=579, vol=2.245969e+07
assign (segid " " and resid 5 and name HN) (segid " " and resid 5 and name HG2*) 2.757 0.950 0.950 weight 1.000 ! spec=NNOE, no=41, id=596, vol=7.859117e+07
assign (segid " " and resid 6 and name HN) (segid " " and resid 6 and name HG*) 2.832 1.002 1.002 weight 1.000 ! spec=NNOE, no=49, id=604, vol=6.698883e+07
assign (segid " " and resid 5 and name HG2*) (segid " " and resid 6 and name HN) 2.714 0.921 0.921 weight 1.000 ! spec=NNOE, no=50, id=605, vol=8.635558e+07
assign (segid " " and resid 13 and name HN) (segid " " and resid 5 and name HG1*) 3.063 1.173 1.173 weight 1.000 ! spec=NNOE, no=66, id=621, vol=4.179739e+07
assign (segid " " and resid 14 and name HG2*) (segid " " and resid 14 and name HN) 3.586 1.190 1.190 weight 1.000 ! spec=NNOE, no=74, id=627, vol=3.999014e+07
assign (segid " " and resid 20 and name HN) (segid " " and resid 19 and name HA) 2.816 0.991 0.991 weight 1.000 ! spec=NNOE, no=102, id=649, vol=6.923906e+07
assign (segid " " and resid 23 and name HN) (segid " " and resid 23 and name HG12) 2.887 1.042 1.042 weight 1.000 ! spec=NNOE, no=122, id=666, vol=5.961674e+07
assign (segid " " and resid 24 and name HN) (segid " " and resid 27 and name HB*) 3.433 1.473 1.473 weight 1.000 ! spec=NNOE, no=126, id=669, vol=2.109011e+07
assign (segid " " and resid 26 and name HN) (segid " " and resid 26 and name HG2*) 2.808 0.985 0.985 weight 1.000 ! spec=NNOE, no=147, id=689, vol=7.049325e+07
assign (segid " " and resid 17 and name HB) (segid " " and resid 18 and name HN) 2.360 0.696 0.696 weight 1.000 ! spec=NNOE, no=155, id=697, vol=1.999459e+08
assign (segid " " and resid 27 and name HB*) (segid " " and resid 27 and name HN) 2.465 0.759 0.759 weight 1.000 ! spec=NNOE, no=156, id=698, vol=1.540025e+08
assign (segid " " and resid 25 and name HA) (segid " " and resid 28 and name HN) 2.819 0.993 0.993 weight 1.000 ! spec=NNOE, no=159, id=701, vol=6.885331e+07
assign (segid " " and resid 29 and name HA) (segid " " and resid 29 and name HN) 2.749 0.944 0.944 weight 1.000 ! spec=NNOE, no=163, id=705, vol=8.009719e+07
assign (segid " " and resid 28 and name HB*) (segid " " and resid 29 and name HN) 2.421 0.732 0.732 weight 1.000 ! spec=NNOE, no=168, id=708, vol=1.717391e+08
assign (segid " " and resid 29 and name HN) (segid " " and resid 26 and name HG2*) 4.215 1.213 1.213 weight 1.000 ! spec=NNOE, no=170, id=710, vol=3.780035e+07
assign (segid " " and resid 30 and name HN) (segid " " and resid 30 and name HG2*) 2.521 0.794 0.794 weight 1.000 ! spec=NNOE, no=176, id=716, vol=1.346903e+08
assign (segid " " and resid 32 and name HN) (segid " " and resid 28 and name HB*) 3.985 1.268 1.268 weight 1.000 ! spec=NNOE, no=190, id=729, vol=3.308728e+07
assign (segid " " and resid 33 and name HN) (segid " " and resid 32 and name HA) 2.845 0.875 0.875 weight 1.000 ! spec=NNOE, no=193, id=732, vol=1.007850e+08
assign (segid " " and resid 39 and name HA) (segid " " and resid 40 and name HN) 2.557 0.817 0.817 weight 1.000 ! spec=NNOE, no=236, id=766, vol=1.235158e+08
assign (segid " " and resid 41 and name HN) (segid " " and resid 36 and name HG2*) 3.173 1.259 1.259 weight 1.000 ! spec=NNOE, no=246, id=776, vol=3.382682e+07
assign (segid " " and resid 45 and name HN) (segid " " and resid 49 and name HA) 3.197 1.277 1.277 weight 1.000 ! spec=NNOE, no=271, id=801, vol=3.237849e+07
assign (segid " " and resid 49 and name HN) (segid " " and resid 48 and name HA) 2.604 0.848 0.848 weight 1.000 ! spec=NNOE, no=289, id=815, vol=1.107457e+08
assign (segid " " and resid 50 and name HB2) (segid " " and resid 50 and name HN) 2.978 1.109 1.109 weight 1.000 ! spec=NNOE, no=297, id=823, vol=4.951306e+07
assign (segid " " and resid 3 and name HA) (segid " " and resid 64 and name HN) 3.245 1.316 1.316 weight 1.000 ! spec=NNOE, no=376, id=892, vol=2.961018e+07
assign (segid " " and resid 69 and name HN) (segid " " and resid 70 and name HN) 2.750 0.945 0.945 weight 1.000 ! spec=NNOE, no=408, id=919, vol=7.992670e+07
assign (segid " " and resid 69 and name HN) (segid " " and resid 68 and name HA) 2.319 0.672 0.672 weight 1.000 ! spec=NNOE, no=409, id=920, vol=2.218399e+08
assign (segid " " and resid 69 and name HD2*) (segid " " and resid 69 and name HN) 2.800 0.980 0.980 weight 1.000 ! spec=NNOE, no=412, id=923, vol=7.162271e+07
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