NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
644220 | 6qbk | 34345 | cing | 1-original | 4 | XPLOR/CNS | distance | NOE | ambi |
# Restraints file 4: ambig.tbl assign (segid " A" and resid 42 and name HN) (segid " A" and resid 42 and name HA) 2.412 0.727 0.727 weight 1.000 ! spec=Noesy, no=18, id=17, vol=5.464347e+06 or (segid " A" and resid 39 and name HN) (segid " A" and resid 39 and name HA) assign (segid " A" and resid 9 and name HN) (segid " A" and resid 9 and name HA) 2.302 0.662 0.662 weight 1.000 ! spec=Noesy, no=36, id=35, vol=6.615754e+06 or (segid " A" and resid 6 and name HN) (segid " A" and resid 6 and name HA) assign (segid " A" and resid 13 and name HN) (segid " A" and resid 12 and name HA) 2.062 0.531 0.531 weight 1.000 ! spec=Noesy, no=47, id=46, vol=1.262986e+07 or (segid " A" and resid 13 and name HN) (segid " A" and resid 13 and name HA) assign (segid " A" and resid 17 and name HN) (segid " A" and resid 16 and name HA) 1.936 0.469 0.469 weight 1.000 ! spec=Noesy, no=48, id=47, vol=2.051341e+07 or (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HA) assign (segid " A" and resid 18 and name HN) (segid " A" and resid 16 and name HA) 2.592 0.840 0.840 weight 1.000 ! spec=Noesy, no=50, id=49, vol=3.674604e+06 or (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HA) assign (segid " A" and resid 48 and name HN) (segid " A" and resid 48 and name HA2) 1.834 0.420 0.420 weight 1.000 ! spec=Noesy, no=60, id=59, vol=2.605940e+07 or (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HA) assign (segid " A" and resid 27 and name HN) (segid " A" and resid 27 and name HB2) 2.181 0.595 0.595 weight 1.000 ! spec=Noesy, no=71, id=70, vol=8.988694e+06 or (segid " A" and resid 27 and name HN) (segid " A" and resid 27 and name HB1) assign (segid " A" and resid 24 and name HN) (segid " A" and resid 23 and name HA) 2.624 0.861 0.861 weight 1.000 ! spec=Noesy, no=73, id=72, vol=3.340267e+06 or (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HB) assign (segid " A" and resid 34 and name HN) (segid " A" and resid 34 and name HB1) 2.058 0.530 0.530 weight 1.000 ! spec=Noesy, no=92, id=91, vol=1.330958e+07 or (segid " A" and resid 34 and name HN) (segid " A" and resid 34 and name HB2) assign (segid " A" and resid 34 and name HD1) (segid " A" and resid 34 and name HB1) 2.305 0.664 0.664 weight 1.000 ! spec=Noesy, no=93, id=92, vol=6.861070e+06 or (segid " A" and resid 34 and name HD2) (segid " A" and resid 34 and name HB1) or (segid " A" and resid 34 and name HD1) (segid " A" and resid 34 and name HB2) or (segid " A" and resid 34 and name HD2) (segid " A" and resid 34 and name HB2) assign (segid " A" and resid 2 and name HD1) (segid " A" and resid 2 and name HB2) 2.608 0.850 0.850 weight 1.000 ! spec=Noesy, no=99, id=98, vol=3.499808e+06 or (segid " A" and resid 2 and name HD2) (segid " A" and resid 2 and name HB2) or (segid " A" and resid 2 and name HD1) (segid " A" and resid 2 and name HB1) or (segid " A" and resid 2 and name HD2) (segid " A" and resid 2 and name HB1) assign (segid " A" and resid 43 and name HE) (segid " A" and resid 43 and name HD1) 2.425 0.735 0.735 weight 1.000 ! spec=Noesy, no=103, id=102, vol=4.958396e+06 or (segid " A" and resid 43 and name HE) (segid " A" and resid 43 and name HD2) assign (segid " A" and resid 33 and name HN) (segid " A" and resid 33 and name HB2) 2.099 0.551 0.551 weight 1.000 ! spec=Noesy, no=105, id=104, vol=1.223904e+07 or (segid " A" and resid 36 and name HN) (segid " A" and resid 36 and name HB1) assign (segid " A" and resid 42 and name HN) (segid " A" and resid 39 and name HB2) 2.342 0.685 0.685 weight 1.000 ! spec=Noesy, no=117, id=116, vol=6.640310e+06 or (segid " A" and resid 39 and name HN) (segid " A" and resid 39 and name HB2) assign (segid " A" and resid 22 and name HE) (segid " A" and resid 22 and name HD2) 2.271 0.645 0.645 weight 1.000 ! spec=Noesy, no=122, id=121, vol=8.064344e+06 or (segid " A" and resid 22 and name HE) (segid " A" and resid 22 and name HD1) assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 22 and name HG2) 2.336 0.682 0.682 weight 1.000 ! spec=Noesy, no=136, id=135, vol=5.659634e+06 or (segid " A" and resid 20 and name HD1) (segid " A" and resid 22 and name HG1) assign (segid " A" and resid 16 and name HA) (segid " A" and resid 17 and name HB2) 3.027 1.145 1.145 weight 1.000 ! spec=Noesy, no=192, id=191, vol=2.238108e+06 or (segid " A" and resid 16 and name HA) (segid " A" and resid 18 and name HD1) assign (segid " A" and resid 12 and name HA) (segid " A" and resid 12 and name HB2) 2.052 0.527 0.527 weight 1.000 ! spec=Noesy, no=193, id=192, vol=1.523385e+07 or (segid " A" and resid 16 and name HA) (segid " A" and resid 16 and name HB2) assign (segid " A" and resid 27 and name HA) (segid " A" and resid 27 and name HB1) 1.952 0.476 0.476 weight 1.000 ! spec=Noesy, no=210, id=209, vol=1.825306e+07 or (segid " A" and resid 27 and name HA) (segid " A" and resid 27 and name HB2) assign (segid " A" and resid 49 and name HD1) (segid " A" and resid 47 and name HB2) 2.411 0.727 0.727 weight 1.000 ! spec=Noesy, no=217, id=216, vol=8.220375e+06 or (segid " A" and resid 49 and name HD2) (segid " A" and resid 47 and name HB2) assign (segid " A" and resid 18 and name HD1) (segid " A" and resid 47 and name HG2) 2.505 2.505 3.495 weight 1.000 ! spec=Noesy, no=218, id=217, vol=9.428874e+06 or (segid " A" and resid 17 and name HB2) (segid " A" and resid 47 and name HG2) assign (segid " A" and resid 49 and name HD1) (segid " A" and resid 47 and name HG2) 2.667 2.667 3.333 weight 1.000 ! spec=Noesy, no=219, id=218, vol=4.628216e+06 or (segid " A" and resid 49 and name HD2) (segid " A" and resid 47 and name HG2) assign (segid " A" and resid 44 and name HB2) (segid " A" and resid 20 and name HB1) 3.586 1.607 1.607 weight 1.000 ! spec=Noesy, no=224, id=223, vol=5.791272e+05 or (segid " A" and resid 36 and name HB2) (segid " A" and resid 37 and name HB2) assign (segid " A" and resid 46 and name HD2) (segid " A" and resid 15 and name HB3) 2.528 2.528 3.472 weight 1.000 ! spec=Noesy, no=225, id=224, vol=4.442637e+06 or (segid " A" and resid 46 and name HD2) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 46 and name HD2) (segid " A" and resid 15 and name HB1) or (segid " A" and resid 34 and name HB1) (segid " A" and resid 15 and name HB3) or (segid " A" and resid 34 and name HB1) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 34 and name HB1) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 22 and name HG2) (segid " A" and resid 22 and name HB1) 2.383 0.710 0.710 weight 1.000 ! spec=Noesy, no=227, id=226, vol=6.311482e+06 or (segid " A" and resid 22 and name HG1) (segid " A" and resid 22 and name HB1) assign (segid " A" and resid 6 and name HD1) (segid " A" and resid 6 and name HG1) 2.572 0.827 0.827 weight 1.000 ! spec=Noesy, no=232, id=231, vol=3.815562e+06 or (segid " A" and resid 6 and name HD2) (segid " A" and resid 6 and name HG1) assign (segid " A" and resid 49 and name HD1) (segid " A" and resid 49 and name HG1) 2.331 0.679 0.679 weight 1.000 ! spec=Noesy, no=233, id=232, vol=6.977398e+06 or (segid " A" and resid 49 and name HD2) (segid " A" and resid 49 and name HG2) or (segid " A" and resid 49 and name HD2) (segid " A" and resid 49 and name HG1) or (segid " A" and resid 49 and name HD1) (segid " A" and resid 49 and name HG2) assign (segid " A" and resid 43 and name HD1) (segid " A" and resid 43 and name HB1) 2.302 0.663 0.663 weight 1.000 ! spec=Noesy, no=236, id=235, vol=7.759914e+06 or (segid " A" and resid 43 and name HD1) (segid " A" and resid 43 and name HB2) or (segid " A" and resid 43 and name HD2) (segid " A" and resid 43 and name HG2) assign (segid " A" and resid 3 and name HG1) (segid " A" and resid 3 and name HB2) 2.310 0.667 0.667 weight 1.000 ! spec=Noesy, no=242, id=241, vol=5.590104e+06 or (segid " A" and resid 3 and name HG2) (segid " A" and resid 3 and name HB2) assign (segid " A" and resid 26 and name HN) (segid " A" and resid 22 and name HD1) 2.806 2.806 3.194 weight 1.000 ! spec=Noesy, no=260, id=259, vol=2.332299e+06 or (segid " A" and resid 26 and name HN) (segid " A" and resid 22 and name HD2) assign (segid " A" and resid 26 and name HE1) (segid " A" and resid 22 and name HD2) 2.987 1.115 1.115 weight 1.000 ! spec=Noesy, no=261, id=260, vol=1.572371e+06 or (segid " A" and resid 26 and name HE2) (segid " A" and resid 22 and name HD2) or (segid " A" and resid 26 and name HE1) (segid " A" and resid 22 and name HD1) or (segid " A" and resid 26 and name HE2) (segid " A" and resid 22 and name HD1) assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 22 and name HD2) 2.981 1.111 1.111 weight 1.000 ! spec=Noesy, no=265, id=264, vol=1.308655e+06 or (segid " A" and resid 20 and name HD1) (segid " A" and resid 22 and name HD1) assign (segid " A" and resid 49 and name HN) (segid " A" and resid 49 and name HG2) 2.801 0.981 0.981 weight 1.000 ! spec=Noesy, no=291, id=290, vol=2.160923e+06 or (segid " A" and resid 49 and name HN) (segid " A" and resid 49 and name HG1) assign (segid " A" and resid 22 and name HN) (segid " A" and resid 43 and name HG2) 2.897 1.049 1.049 weight 1.000 ! spec=Noesy, no=300, id=299, vol=1.812026e+06 or (segid " A" and resid 22 and name HN) (segid " A" and resid 22 and name HB2) assign (segid " A" and resid 36 and name HD21) (segid " A" and resid 43 and name HB1) 3.126 1.222 1.222 weight 1.000 ! spec=Noesy, no=331, id=330, vol=1.132334e+06 or (segid " A" and resid 36 and name HD21) (segid " A" and resid 43 and name HB2) assign (segid " A" and resid 28 and name HD2) (segid " A" and resid 26 and name HA) 2.825 0.998 0.998 weight 1.000 ! spec=Noesy, no=345, id=344, vol=2.036372e+06 or (segid " A" and resid 26 and name HE1) (segid " A" and resid 26 and name HA) or (segid " A" and resid 26 and name HE2) (segid " A" and resid 26 and name HA) assign (segid " A" and resid 42 and name HN) (segid " A" and resid 40 and name HA1) 3.053 3.053 2.947 weight 1.000 ! spec=Noesy, no=396, id=395, vol=1.346258e+06 or (segid " A" and resid 39 and name HN) (segid " A" and resid 40 and name HA1) assign (segid " A" and resid 28 and name HN) (segid " A" and resid 28 and name HB1) 2.985 1.114 1.114 weight 1.000 ! spec=Noesy, no=402, id=401, vol=1.655850e+06 or (segid " A" and resid 28 and name HN) (segid " A" and resid 28 and name HB2) assign (segid " A" and resid 28 and name HD2) (segid " A" and resid 28 and name HB1) 2.723 0.927 0.927 weight 1.000 ! spec=Noesy, no=403, id=402, vol=2.363364e+06 or (segid " A" and resid 28 and name HD2) (segid " A" and resid 28 and name HB2) assign (segid " A" and resid 4 and name HE) (segid " A" and resid 6 and name HD2) 2.821 0.995 0.995 weight 1.000 ! spec=Noesy, no=408, id=407, vol=1.803675e+06 or (segid " A" and resid 4 and name HE) (segid " A" and resid 6 and name HD1) assign (segid " A" and resid 36 and name HN) (segid " A" and resid 34 and name HB1) 3.065 1.175 1.175 weight 1.000 ! spec=Noesy, no=416, id=415, vol=1.250206e+06 or (segid " A" and resid 33 and name HN) (segid " A" and resid 34 and name HB1) or (segid " A" and resid 33 and name HN) (segid " A" and resid 34 and name HB2) assign (segid " A" and resid 34 and name HE2) (segid " A" and resid 34 and name HB2) 2.881 1.037 1.037 weight 1.000 ! spec=Noesy, no=418, id=417, vol=1.836266e+06 or (segid " A" and resid 34 and name HE1) (segid " A" and resid 34 and name HB2) or (segid " A" and resid 34 and name HE2) (segid " A" and resid 34 and name HB1) or (segid " A" and resid 34 and name HE1) (segid " A" and resid 34 and name HB1) assign (segid " A" and resid 22 and name HN) (segid " A" and resid 21 and name HB2) 2.946 1.085 1.085 weight 1.000 ! spec=Noesy, no=443, id=442, vol=1.804882e+06 or (segid " A" and resid 22 and name HN) (segid " A" and resid 45 and name HB2) assign (segid " A" and resid 4 and name HD1) (segid " A" and resid 6 and name HB1) 3.008 1.131 1.131 weight 1.000 ! spec=Noesy, no=466, id=465, vol=1.438511e+06 or (segid " A" and resid 4 and name HD2) (segid " A" and resid 6 and name HB1) assign (segid " A" and resid 4 and name HD1) (segid " A" and resid 4 and name HB2) 2.700 0.911 0.911 weight 1.000 ! spec=Noesy, no=468, id=467, vol=2.591301e+06 or (segid " A" and resid 4 and name HA) (segid " A" and resid 4 and name HB2) or (segid " A" and resid 4 and name HD2) (segid " A" and resid 4 and name HB2) assign (segid " A" and resid 4 and name HD2) (segid " A" and resid 4 and name HG1) 3.108 1.208 1.208 weight 1.000 ! spec=Noesy, no=472, id=471, vol=1.198866e+06 or (segid " A" and resid 4 and name HD1) (segid " A" and resid 4 and name HG1) assign (segid " A" and resid 22 and name HD2) (segid " A" and resid 22 and name HG2) 2.901 1.052 1.052 weight 1.000 ! spec=Noesy, no=484, id=483, vol=1.986484e+06 or (segid " A" and resid 22 and name HD2) (segid " A" and resid 22 and name HG1) or (segid " A" and resid 22 and name HD1) (segid " A" and resid 22 and name HG2) assign (segid " A" and resid 43 and name HD1) (segid " A" and resid 43 and name HG1) 2.699 0.910 0.910 weight 1.000 ! spec=Noesy, no=488, id=487, vol=2.966752e+06 or (segid " A" and resid 43 and name HD2) (segid " A" and resid 43 and name HG1) assign (segid " A" and resid 3 and name HG2) (segid " A" and resid 3 and name HB1) 2.153 0.579 0.579 weight 1.000 ! spec=Noesy, no=504, id=503, vol=9.058789e+06 or (segid " A" and resid 3 and name HG1) (segid " A" and resid 3 and name HB1) assign (segid " A" and resid 34 and name HN) (segid " A" and resid 34 and name HD1) 2.952 1.089 1.089 weight 1.000 ! spec=Noesy, no=509, id=508, vol=1.624312e+06 or (segid " A" and resid 34 and name HN) (segid " A" and resid 34 and name HD2) or (segid " A" and resid 12 and name HE1) (segid " A" and resid 12 and name HD2) assign (segid " A" and resid 6 and name HE) (segid " A" and resid 12 and name HA) 3.209 1.287 1.287 weight 1.000 ! spec=Noesy, no=537, id=536, vol=7.290492e+05 or (segid " A" and resid 12 and name HD2) (segid " A" and resid 12 and name HA) assign (segid " A" and resid 28 and name HN) (segid " A" and resid 27 and name HB1) 3.302 1.363 1.363 weight 1.000 ! spec=Noesy, no=546, id=545, vol=8.462268e+05 or (segid " A" and resid 28 and name HN) (segid " A" and resid 27 and name HB2) assign (segid " A" and resid 28 and name HD2) (segid " A" and resid 27 and name HB1) 3.162 1.250 1.250 weight 1.000 ! spec=Noesy, no=547, id=546, vol=8.996938e+05 or (segid " A" and resid 28 and name HD2) (segid " A" and resid 27 and name HB2) assign (segid " A" and resid 3 and name HN) (segid " A" and resid 2 and name HB1) 3.190 1.272 1.272 weight 1.000 ! spec=Noesy, no=559, id=558, vol=1.024598e+06 or (segid " A" and resid 3 and name HN) (segid " A" and resid 2 and name HB2) assign (segid " A" and resid 26 and name HZ) (segid " A" and resid 22 and name HD2) 3.160 1.248 1.248 weight 1.000 ! spec=Noesy, no=570, id=569, vol=1.100007e+06 or (segid " A" and resid 26 and name HZ) (segid " A" and resid 22 and name HD1) assign (segid " A" and resid 26 and name HD2) (segid " A" and resid 22 and name HD1) 3.258 1.327 1.327 weight 1.000 ! spec=Noesy, no=571, id=570, vol=9.292982e+05 or (segid " A" and resid 26 and name HD1) (segid " A" and resid 22 and name HD1) or (segid " A" and resid 26 and name HD2) (segid " A" and resid 22 and name HD2) or (segid " A" and resid 26 and name HD1) (segid " A" and resid 22 and name HD2) assign (segid " A" and resid 22 and name HN) (segid " A" and resid 22 and name HG2) 3.363 1.414 1.414 weight 1.000 ! spec=Noesy, no=587, id=586, vol=8.159515e+05 or (segid " A" and resid 22 and name HN) (segid " A" and resid 22 and name HG1) assign (segid " A" and resid 22 and name HE) (segid " A" and resid 22 and name HG2) 3.256 1.326 1.326 weight 1.000 ! spec=Noesy, no=588, id=587, vol=9.001465e+05 or (segid " A" and resid 22 and name HE) (segid " A" and resid 22 and name HG1) assign (segid " A" and resid 25 and name HN) (segid " A" and resid 22 and name HB2) 3.327 1.384 1.384 weight 1.000 ! spec=Noesy, no=598, id=597, vol=7.594280e+05 or (segid " A" and resid 25 and name HN) (segid " A" and resid 43 and name HG2) assign (segid " A" and resid 36 and name HD22) (segid " A" and resid 43 and name HB1) 3.383 1.431 1.431 weight 1.000 ! spec=Noesy, no=600, id=599, vol=6.372340e+05 or (segid " A" and resid 36 and name HD22) (segid " A" and resid 43 and name HB2) assign (segid " A" and resid 1 and name HA) (segid " A" and resid 1 and name HB1) 1.857 0.431 0.431 weight 1.000 ! spec=Noesy, no=612, id=611, vol=1.926381e+07 or (segid " A" and resid 1 and name HA) (segid " A" and resid 1 and name HB2) assign (segid " A" and resid 24 and name HB) (segid " A" and resid 23 and name HG1) 3.360 1.412 1.412 weight 1.000 ! spec=Noesy, no=626, id=625, vol=7.764960e+05 or (segid " A" and resid 23 and name HA) (segid " A" and resid 23 and name HG1) assign (segid " A" and resid 4 and name HD1) (segid " A" and resid 4 and name HG2) 3.324 1.382 1.382 weight 1.000 ! spec=Noesy, no=631, id=630, vol=7.810898e+05 or (segid " A" and resid 4 and name HD2) (segid " A" and resid 4 and name HG2) assign (segid " A" and resid 1 and name HB1) (segid " A" and resid 4 and name HG2) 3.222 3.222 2.778 weight 1.000 ! spec=Noesy, no=632, id=631, vol=8.793425e+05 or (segid " A" and resid 1 and name HB2) (segid " A" and resid 4 and name HG2) assign (segid " A" and resid 24 and name HA) (segid " A" and resid 22 and name HB2) 3.200 1.280 1.280 weight 1.000 ! spec=Noesy, no=636, id=635, vol=1.021847e+06 or (segid " A" and resid 24 and name HA) (segid " A" and resid 43 and name HG2) assign (segid " A" and resid 23 and name HA) (segid " A" and resid 43 and name HG2) 3.358 1.409 1.409 weight 1.000 ! spec=Noesy, no=637, id=636, vol=7.970858e+05 or (segid " A" and resid 23 and name HA) (segid " A" and resid 22 and name HB2) assign (segid " A" and resid 33 and name HN) (segid " A" and resid 36 and name HD21) 3.550 3.550 2.450 weight 1.000 ! spec=Noesy, no=662, id=661, vol=5.039695e+05 or (segid " A" and resid 36 and name HN) (segid " A" and resid 36 and name HD21) assign (segid " A" and resid 29 and name HN) (segid " A" and resid 25 and name HA) 3.628 1.645 1.645 weight 1.000 ! spec=Noesy, no=670, id=669, vol=4.573228e+05 or (segid " A" and resid 29 and name HN) (segid " A" and resid 47 and name HA) assign (segid " A" and resid 26 and name HE1) (segid " A" and resid 25 and name HA) 3.532 1.560 1.560 weight 1.000 ! spec=Noesy, no=671, id=670, vol=5.003475e+05 or (segid " A" and resid 26 and name HE2) (segid " A" and resid 25 and name HA) or (segid " A" and resid 28 and name HD2) (segid " A" and resid 47 and name HA) assign (segid " A" and resid 48 and name HN) (segid " A" and resid 28 and name HB1) 3.435 1.475 1.475 weight 1.000 ! spec=Noesy, no=693, id=692, vol=6.662558e+05 or (segid " A" and resid 48 and name HN) (segid " A" and resid 28 and name HB2) assign (segid " A" and resid 3 and name HN) (segid " A" and resid 3 and name HG1) 3.564 1.588 1.588 weight 1.000 ! spec=Noesy, no=727, id=726, vol=4.749075e+05 or (segid " A" and resid 3 and name HN) (segid " A" and resid 3 and name HG2) assign (segid " A" and resid 19 and name HN) (segid " A" and resid 47 and name HG2) 3.528 1.556 1.556 weight 1.000 ! spec=Noesy, no=728, id=727, vol=5.383218e+05 or (segid " A" and resid 34 and name HN) (segid " A" and resid 35 and name HB1) assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 22 and name HG1) 3.591 1.612 1.612 weight 1.000 ! spec=Noesy, no=739, id=738, vol=4.535575e+05 or (segid " A" and resid 20 and name HE1) (segid " A" and resid 22 and name HG2) assign (segid " A" and resid 1 and name HB1) (segid " A" and resid 4 and name HB2) 3.557 1.581 1.581 weight 1.000 ! spec=Noesy, no=760, id=759, vol=4.848290e+05 or (segid " A" and resid 1 and name HB2) (segid " A" and resid 4 and name HB2) assign (segid " A" and resid 42 and name HB2) (segid " A" and resid 22 and name HG1) 3.667 1.681 1.681 weight 1.000 ! spec=Noesy, no=762, id=761, vol=4.409220e+05 or (segid " A" and resid 20 and name HB2) (segid " A" and resid 22 and name HG2) or (segid " A" and resid 20 and name HB2) (segid " A" and resid 22 and name HG1) assign (segid " A" and resid 45 and name HB2) (segid " A" and resid 22 and name HG2) 3.520 1.549 1.549 weight 1.000 ! 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spec=Noesy, no=845, id=844, vol=1.038901e+06 or (segid " A" and resid 36 and name HB2) (segid " A" and resid 43 and name HA) assign (segid " A" and resid 43 and name HD2) (segid " A" and resid 43 and name HA) 3.043 3.043 2.957 weight 1.000 ! spec=Noesy, no=846, id=845, vol=1.423728e+06 or (segid " A" and resid 43 and name HA) (segid " A" and resid 43 and name HD1) assign (segid " A" and resid 43 and name HB2) (segid " A" and resid 43 and name HA) 2.365 0.699 0.699 weight 1.000 ! spec=Noesy, no=851, id=850, vol=6.190562e+06 or (segid " A" and resid 43 and name HB1) (segid " A" and resid 43 and name HA) assign (segid " A" and resid 41 and name HB1) (segid " A" and resid 41 and name HA) 2.305 0.664 0.664 weight 1.000 ! spec=Noesy, no=854, id=853, vol=6.405405e+06 or (segid " A" and resid 41 and name HB2) (segid " A" and resid 41 and name HA) assign (segid " A" and resid 34 and name HB1) (segid " A" and resid 34 and name HA) 2.365 0.699 0.699 weight 1.000 ! spec=Noesy, no=857, id=856, vol=6.373926e+06 or (segid " A" and resid 34 and name HB2) (segid " A" and resid 34 and name HA) assign (segid " A" and resid 6 and name HD1) (segid " A" and resid 6 and name HA) 3.543 1.569 1.569 weight 1.000 ! spec=Noesy, no=861, id=859, vol=5.839500e+05 or (segid " A" and resid 6 and name HD2) (segid " A" and resid 6 and name HA) assign (segid " A" and resid 49 and name HG1) (segid " A" and resid 49 and name HA) 2.663 0.887 0.887 weight 1.000 ! spec=Noesy, no=865, id=863, vol=3.136320e+06 or (segid " A" and resid 49 and name HG2) (segid " A" and resid 49 and name HA) assign (segid " A" and resid 3 and name HG1) (segid " A" and resid 3 and name HA) 2.832 1.002 1.002 weight 1.000 ! spec=Noesy, no=872, id=870, vol=1.378783e+06 or (segid " A" and resid 3 and name HG2) (segid " A" and resid 3 and name HA) assign (segid " A" and resid 6 and name HD1) (segid " A" and resid 12 and name HA) 2.735 0.935 0.935 weight 1.000 ! spec=Noesy, no=874, id=872, vol=2.264660e+06 or (segid " A" and resid 6 and name HD2) (segid " A" and resid 12 and name HA) assign (segid " A" and resid 18 and name HD1) (segid " A" and resid 17 and name HA) 2.567 2.567 3.433 weight 1.000 ! spec=Noesy, no=875, id=873, vol=3.515910e+06 or (segid " A" and resid 16 and name HA) (segid " A" and resid 18 and name HD1) assign (segid " A" and resid 15 and name HB3) (segid " A" and resid 17 and name HA) 3.401 1.446 1.446 weight 1.000 ! spec=Noesy, no=877, id=875, vol=6.825618e+05 or (segid " A" and resid 15 and name HB2) (segid " A" and resid 17 and name HA) or (segid " A" and resid 15 and name HB1) (segid " A" and resid 17 and name HA) or (segid " A" and resid 15 and name HB3) (segid " A" and resid 16 and name HA) or (segid " A" and resid 15 and name HB2) (segid " A" and resid 16 and name HA) or (segid " A" and resid 15 and name HB1) (segid " A" and resid 16 and name HA) assign (segid " A" and resid 46 and name HN) (segid " A" and resid 25 and name HA) 3.894 1.896 1.896 weight 1.000 ! spec=Noesy, no=949, id=946, vol=3.167685e+05 or (segid " A" and resid 46 and name HN) (segid " A" and resid 47 and name HA) assign (segid " A" and resid 18 and name HE) (segid " A" and resid 17 and name HA) 4.166 2.169 2.169 weight 1.000 ! spec=Noesy, no=968, id=965, vol=1.640675e+05 or (segid " A" and resid 18 and name HE) (segid " A" and resid 16 and name HA) assign (segid " A" and resid 17 and name HD21) (segid " A" and resid 13 and name HB1) 4.640 2.692 2.692 weight 1.000 ! 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spec=Noesy, no=1001, id=998, vol=6.834025e+04 or (segid " A" and resid 9 and name HD2) (segid " A" and resid 41 and name HB2) assign (segid " A" and resid 18 and name HN) (segid " A" and resid 47 and name HD1) 3.985 1.985 1.985 weight 1.000 ! spec=Noesy, no=1003, id=1000, vol=2.724558e+05 or (segid " A" and resid 18 and name HN) (segid " A" and resid 15 and name HA) assign (segid " A" and resid 14 and name HN) (segid " A" and resid 15 and name HA) 4.299 2.310 2.310 weight 1.000 ! spec=Noesy, no=1007, id=1004, vol=1.587675e+05 or (segid " A" and resid 14 and name HN) (segid " A" and resid 47 and name HD1) assign (segid " A" and resid 29 and name HN) (segid " A" and resid 27 and name HB1) 3.878 1.880 1.880 weight 1.000 ! spec=Noesy, no=1011, id=1008, vol=3.031462e+05 or (segid " A" and resid 29 and name HN) (segid " A" and resid 27 and name HB2) assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 28 and name HB2) 4.421 2.443 2.443 weight 1.000 ! spec=Noesy, no=1022, id=1019, vol=1.055882e+05 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 28 and name HB2) or (segid " A" and resid 30 and name HD2) (segid " A" and resid 28 and name HB1) or (segid " A" and resid 30 and name HD1) (segid " A" and resid 28 and name HB1) assign (segid " A" and resid 4 and name HN) (segid " A" and resid 6 and name HD1) 4.251 2.259 2.259 weight 1.000 ! spec=Noesy, no=1039, id=1036, vol=1.675230e+05 or (segid " A" and resid 4 and name HN) (segid " A" and resid 6 and name HD2) assign (segid " A" and resid 49 and name HN) (segid " A" and resid 49 and name HD1) 3.743 1.751 1.751 weight 1.000 ! spec=Noesy, no=1041, id=1038, vol=3.573088e+05 or (segid " A" and resid 49 and name HN) (segid " A" and resid 49 and name HD2) assign (segid " A" and resid 33 and name HD1) (segid " A" and resid 34 and name HB1) 4.304 2.315 2.315 weight 1.000 ! spec=Noesy, no=1042, id=1039, vol=8.482575e+04 or (segid " A" and resid 33 and name HD1) (segid " A" and resid 34 and name HB2) assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 25 and name HB1) 3.744 1.752 1.752 weight 1.000 ! spec=Noesy, no=1043, id=1040, vol=2.786468e+05 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 25 and name HB1) or (segid " A" and resid 30 and name HD2) (segid " A" and resid 50 and name HD2) or (segid " A" and resid 30 and name HD1) (segid " A" and resid 50 and name HD2) assign (segid " A" and resid 33 and name HE3) (segid " A" and resid 34 and name HB2) 4.552 2.590 2.590 weight 1.000 ! 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spec=Noesy, no=1059, id=1055, vol=7.774125e+04 or (segid " A" and resid 2 and name HE2) (segid " A" and resid 2 and name HB1) or (segid " A" and resid 2 and name HE1) (segid " A" and resid 2 and name HB2) or (segid " A" and resid 2 and name HE2) (segid " A" and resid 2 and name HB2) assign (segid " A" and resid 40 and name HN) (segid " A" and resid 36 and name HB2) 4.272 2.282 2.282 weight 1.000 ! spec=Noesy, no=1063, id=1059, vol=1.625332e+05 or (segid " A" and resid 40 and name HN) (segid " A" and resid 42 and name HB2) assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 22 and name HD2) 4.446 2.471 2.471 weight 1.000 ! spec=Noesy, no=1106, id=1102, vol=1.301088e+05 or (segid " A" and resid 20 and name HE1) (segid " A" and resid 22 and name HD1) assign (segid " A" and resid 43 and name HN) (segid " A" and resid 22 and name HD1) 3.773 3.773 2.227 weight 1.000 ! spec=Noesy, no=1109, id=1104, vol=4.126502e+05 or (segid " A" and resid 43 and name HN) (segid " A" and resid 10 and name HB1) assign (segid " A" and resid 21 and name HN) (segid " A" and resid 22 and name HD2) 4.426 2.448 2.448 weight 1.000 ! spec=Noesy, no=1110, id=1105, vol=1.327215e+05 or (segid " A" and resid 21 and name HN) (segid " A" and resid 22 and name HD1) assign (segid " A" and resid 40 and name HN) (segid " A" and resid 10 and name HB1) 4.002 2.002 2.002 weight 1.000 ! spec=Noesy, no=1111, id=1106, vol=2.456548e+05 or (segid " A" and resid 40 and name HN) (segid " A" and resid 38 and name HB) assign (segid " A" and resid 4 and name HN) (segid " A" and resid 3 and name HG2) 4.032 2.032 2.032 weight 1.000 ! spec=Noesy, no=1117, id=1112, vol=2.412632e+05 or (segid " A" and resid 4 and name HN) (segid " A" and resid 3 and name HG1) assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 18 and name HB1) 4.438 2.461 2.461 weight 1.000 ! spec=Noesy, no=1123, id=1118, vol=1.757768e+05 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 18 and name HB1) or (segid " A" and resid 30 and name HE2) (segid " A" and resid 47 and name HB1) or (segid " A" and resid 30 and name HE1) (segid " A" and resid 47 and name HB1) assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 18 and name HB1) 4.810 2.892 2.892 weight 1.000 ! spec=Noesy, no=1124, id=1119, vol=8.324775e+04 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 18 and name HB1) or (segid " A" and resid 30 and name HD2) (segid " A" and resid 47 and name HB1) or (segid " A" and resid 30 and name HD1) (segid " A" and resid 47 and name HB1) assign (segid " A" and resid 45 and name HN) (segid " A" and resid 22 and name HG1) 3.957 1.957 1.957 weight 1.000 ! spec=Noesy, no=1145, id=1140, vol=2.780098e+05 or (segid " A" and resid 45 and name HN) (segid " A" and resid 22 and name HG2) assign (segid " A" and resid 21 and name HN) (segid " A" and resid 22 and name HG2) 4.624 2.673 2.673 weight 1.000 ! spec=Noesy, no=1146, id=1141, vol=1.085235e+05 or (segid " A" and resid 21 and name HN) (segid " A" and resid 22 and name HG1) assign (segid " A" and resid 26 and name HE1) (segid " A" and resid 22 and name HG2) 4.227 2.233 2.233 weight 1.000 ! spec=Noesy, no=1147, id=1142, vol=1.876405e+05 or (segid " A" and resid 26 and name HE2) (segid " A" and resid 22 and name HG2) or (segid " A" and resid 26 and name HE1) (segid " A" and resid 22 and name HG1) or (segid " A" and resid 26 and name HE2) (segid " A" and resid 22 and name HG1) assign (segid " A" and resid 26 and name HD2) (segid " A" and resid 22 and name HG2) 4.259 2.267 2.267 weight 1.000 ! spec=Noesy, no=1148, id=1143, vol=1.386102e+05 or (segid " A" and resid 26 and name HD1) (segid " A" and resid 22 and name HG2) or (segid " A" and resid 26 and name HD2) (segid " A" and resid 22 and name HG1) or (segid " A" and resid 26 and name HD1) (segid " A" and resid 22 and name HG1) assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 22 and name HG1) 4.633 2.683 2.683 weight 1.000 ! spec=Noesy, no=1149, id=1144, vol=9.755650e+04 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 22 and name HG1) or (segid " A" and resid 42 and name HE2) (segid " A" and resid 22 and name HG2) or (segid " A" and resid 42 and name HE1) (segid " A" and resid 22 and name HG2) assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 22 and name HG1) 4.547 2.585 2.585 weight 1.000 ! spec=Noesy, no=1150, id=1145, vol=1.310705e+05 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 22 and name HG1) or (segid " A" and resid 42 and name HD1) (segid " A" and resid 22 and name HG2) or (segid " A" and resid 42 and name HD2) (segid " A" and resid 22 and name HG2) assign (segid " A" and resid 24 and name HN) (segid " A" and resid 22 and name HG2) 3.984 1.984 1.984 weight 1.000 ! spec=Noesy, no=1151, id=1146, vol=2.799795e+05 or (segid " A" and resid 24 and name HN) (segid " A" and resid 22 and name HG1) assign (segid " A" and resid 49 and name HE) (segid " A" and resid 49 and name HG1) 3.817 1.821 1.821 weight 1.000 ! spec=Noesy, no=1155, id=1150, vol=3.122495e+05 or (segid " A" and resid 49 and name HE) (segid " A" and resid 49 and name HG2) assign (segid " A" and resid 28 and name HD2) (segid " A" and resid 29 and name HB2) 4.442 2.467 2.467 weight 1.000 ! spec=Noesy, no=1156, id=1151, vol=1.218785e+05 or (segid " A" and resid 26 and name HE1) (segid " A" and resid 29 and name HB2) or (segid " A" and resid 26 and name HE2) (segid " A" and resid 29 and name HB2) assign (segid " A" and resid 32 and name HN) (segid " A" and resid 29 and name HB2) 4.551 2.589 2.589 weight 1.000 ! spec=Noesy, no=1157, id=1152, vol=1.215645e+05 or (segid " A" and resid 20 and name HN) (segid " A" and resid 29 and name HB2) assign (segid " A" and resid 33 and name HE1) (segid " A" and resid 43 and name HB2) 4.461 2.488 2.488 weight 1.000 ! spec=Noesy, no=1166, id=1161, vol=1.206582e+05 or (segid " A" and resid 33 and name HE1) (segid " A" and resid 43 and name HB1) assign (segid " A" and resid 31 and name HN) (segid " A" and resid 43 and name HB2) 4.230 2.237 2.237 weight 1.000 ! spec=Noesy, no=1170, id=1165, vol=1.788608e+05 or (segid " A" and resid 31 and name HN) (segid " A" and resid 46 and name HG1) assign (segid " A" and resid 33 and name HE3) (segid " A" and resid 43 and name HB1) 4.036 2.037 2.037 weight 1.000 ! spec=Noesy, no=1171, id=1166, vol=2.335398e+05 or (segid " A" and resid 33 and name HE3) (segid " A" and resid 43 and name HB2) assign (segid " A" and resid 33 and name HN) (segid " A" and resid 43 and name HB2) 4.353 2.368 2.368 weight 1.000 ! spec=Noesy, no=1172, id=1167, vol=1.474212e+05 or (segid " A" and resid 33 and name HN) (segid " A" and resid 46 and name HG1) or (segid " A" and resid 36 and name HN) (segid " A" and resid 43 and name HB2) or (segid " A" and resid 36 and name HN) (segid " A" and resid 46 and name HG1) assign (segid " A" and resid 33 and name HH2) (segid " A" and resid 43 and name HB2) 3.951 1.951 1.951 weight 1.000 ! spec=Noesy, no=1173, id=1168, vol=2.836212e+05 or (segid " A" and resid 33 and name HH2) (segid " A" and resid 43 and name HB1) assign (segid " A" and resid 33 and name HZ3) (segid " A" and resid 43 and name HB1) 3.807 1.811 1.811 weight 1.000 ! spec=Noesy, no=1174, id=1169, vol=3.596650e+05 or (segid " A" and resid 33 and name HZ3) (segid " A" and resid 43 and name HB2) assign (segid " A" and resid 21 and name HA) (segid " A" and resid 22 and name HD1) 4.711 2.774 2.774 weight 1.000 ! spec=Noesy, no=1219, id=1214, vol=1.230598e+05 or (segid " A" and resid 21 and name HA) (segid " A" and resid 22 and name HD2) assign (segid " A" and resid 21 and name HA) (segid " A" and resid 22 and name HG1) 4.574 2.615 2.615 weight 1.000 ! spec=Noesy, no=1220, id=1215, vol=1.181990e+05 or (segid " A" and resid 21 and name HA) (segid " A" and resid 22 and name HG2) assign (segid " A" and resid 20 and name HN) (segid " A" and resid 20 and name HE3) 4.780 2.857 2.857 weight 1.000 ! spec=Noesy, no=1231, id=1226, vol=7.850825e+04 or (segid " A" and resid 32 and name HN) (segid " A" and resid 33 and name HD1) assign (segid " A" and resid 25 and name HN) (segid " A" and resid 26 and name HE1) 4.077 2.078 2.078 weight 1.000 ! spec=Noesy, no=1246, id=1241, vol=2.291078e+05 or (segid " A" and resid 25 and name HN) (segid " A" and resid 26 and name HE2) or (segid " A" and resid 48 and name HN) (segid " A" and resid 28 and name HD2) assign (segid " A" and resid 9 and name HE1) (segid " A" and resid 42 and name HE2) 4.840 2.928 2.928 weight 1.000 ! spec=Noesy, no=1266, id=1261, vol=8.034900e+04 or (segid " A" and resid 9 and name HE1) (segid " A" and resid 42 and name HE1) or (segid " A" and resid 45 and name HN) (segid " A" and resid 42 and name HE2) or (segid " A" and resid 45 and name HN) (segid " A" and resid 42 and name HE1) assign (segid " A" and resid 32 and name HN) (segid " A" and resid 36 and name HD21) 3.961 1.961 1.961 weight 1.000 ! spec=Noesy, no=1288, id=1283, vol=2.780288e+05 or (segid " A" and resid 20 and name HN) (segid " A" and resid 21 and name HA) assign (segid " A" and resid 29 and name HA) (segid " A" and resid 28 and name HB1) 4.211 2.216 2.216 weight 1.000 ! spec=Noesy, no=1290, id=1285, vol=1.993465e+05 or (segid " A" and resid 29 and name HA) (segid " A" and resid 28 and name HB2) assign (segid " A" and resid 19 and name HN) (segid " A" and resid 35 and name HD22) 3.900 1.901 1.901 weight 1.000 ! spec=Noesy, no=1308, id=1303, vol=2.997858e+05 or (segid " A" and resid 34 and name HN) (segid " A" and resid 35 and name HD22) assign (segid " A" and resid 42 and name HN) (segid " A" and resid 21 and name HA) 4.005 2.005 2.005 weight 1.000 ! spec=Noesy, no=1319, id=1314, vol=2.694322e+05 or (segid " A" and resid 39 and name HN) (segid " A" and resid 21 and name HA) assign (segid " A" and resid 20 and name HN) (segid " A" and resid 46 and name HB2) 3.937 1.938 1.938 weight 1.000 ! spec=Noesy, no=1322, id=1317, vol=2.948920e+05 or (segid " A" and resid 32 and name HN) (segid " A" and resid 46 and name HB2) assign (segid " A" and resid 26 and name HN) (segid " A" and resid 22 and name HG1) 4.438 2.462 2.462 weight 1.000 ! spec=Noesy, no=1332, id=1327, vol=1.375545e+05 or (segid " A" and resid 26 and name HN) (segid " A" and resid 22 and name HG2) assign (segid " A" and resid 28 and name HE1) (segid " A" and resid 49 and name HD1) 4.214 2.220 2.220 weight 1.000 ! spec=Noesy, no=1338, id=1333, vol=1.848860e+05 or (segid " A" and resid 28 and name HE1) (segid " A" and resid 49 and name HD2) assign (segid " A" and resid 49 and name HN) (segid " A" and resid 28 and name HB1) 3.945 1.945 1.945 weight 1.000 ! spec=Noesy, no=1339, id=1334, vol=3.865692e+05 or (segid " A" and resid 49 and name HN) (segid " A" and resid 28 and name HB2) assign (segid " A" and resid 42 and name HN) (segid " A" and resid 41 and name HB1) 3.191 1.273 1.273 weight 1.000 ! spec=Noesy, no=1350, id=1345, vol=1.226752e+06 or (segid " A" and resid 42 and name HN) (segid " A" and resid 41 and name HB2) assign (segid " A" and resid 45 and name HA) (segid " A" and resid 46 and name HG1) 4.663 2.718 2.718 weight 1.000 ! spec=Noesy, no=1364, id=1359, vol=1.076652e+05 or (segid " A" and resid 45 and name HA) (segid " A" and resid 43 and name HG2) assign (segid " A" and resid 35 and name HA) (segid " A" and resid 44 and name HB2) 4.404 2.424 2.424 weight 1.000 ! spec=Noesy, no=1371, id=1366, vol=1.475752e+05 or (segid " A" and resid 35 and name HA) (segid " A" and resid 36 and name HB2) assign (segid " A" and resid 45 and name HA) (segid " A" and resid 25 and name HB2) 4.619 2.667 2.667 weight 1.000 ! spec=Noesy, no=1374, id=1369, vol=1.252522e+05 or (segid " A" and resid 45 and name HA) (segid " A" and resid 32 and name HB2) assign (segid " A" and resid 41 and name HA) (segid " A" and resid 42 and name HA) 4.055 2.055 2.055 weight 1.000 ! spec=Noesy, no=1381, id=1376, vol=2.659885e+05 or (segid " A" and resid 11 and name HA) (segid " A" and resid 39 and name HA) assign (segid " A" and resid 16 and name HA) (segid " A" and resid 14 and name HA) 3.109 1.208 1.208 weight 1.000 ! spec=Noesy, no=1382, id=1377, vol=1.123343e+06 or (segid " A" and resid 13 and name HA) (segid " A" and resid 14 and name HA) assign (segid " A" and resid 48 and name HA2) (segid " A" and resid 47 and name HA) 3.480 1.513 1.513 weight 1.000 ! spec=Noesy, no=1389, id=1384, vol=7.601462e+05 or (segid " A" and resid 24 and name HA) (segid " A" and resid 25 and name HA) assign (segid " A" and resid 41 and name HB1) (segid " A" and resid 42 and name HA) 4.252 2.260 2.260 weight 1.000 ! spec=Noesy, no=1394, id=1389, vol=2.244590e+05 or (segid " A" and resid 41 and name HB2) (segid " A" and resid 42 and name HA) assign (segid " A" and resid 21 and name HB1) (segid " A" and resid 44 and name HA) 4.266 2.275 2.275 weight 1.000 ! spec=Noesy, no=1406, id=1401, vol=1.594672e+05 or (segid " A" and resid 21 and name HB1) (segid " A" and resid 22 and name HA) assign (segid " A" and resid 18 and name HB1) (segid " A" and resid 46 and name HA) 4.101 2.102 2.102 weight 1.000 ! spec=Noesy, no=1412, id=1407, vol=2.321445e+05 or (segid " A" and resid 47 and name HB1) (segid " A" and resid 46 and name HA) assign (segid " A" and resid 11 and name HB1) (segid " A" and resid 5 and name HG23) 4.161 2.164 2.164 weight 1.000 ! spec=Noesy, no=1426, id=1421, vol=2.194855e+05 or (segid " A" and resid 11 and name HB1) (segid " A" and resid 5 and name HG21) or (segid " A" and resid 11 and name HB1) (segid " A" and resid 5 and name HG22) or (segid " A" and resid 5 and name HG23) (segid " A" and resid 6 and name HA) or (segid " A" and resid 5 and name HG21) (segid " A" and resid 6 and name HA) or (segid " A" and resid 5 and name HG22) (segid " A" and resid 6 and name HA) assign (segid " A" and resid 12 and name HA) (segid " A" and resid 38 and name HG23) 4.186 2.190 2.190 weight 1.000 ! spec=Noesy, no=1429, id=1424, vol=2.205912e+05 or (segid " A" and resid 12 and name HA) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 12 and name HA) (segid " A" and resid 38 and name HG21) or (segid " A" and resid 13 and name HA) (segid " A" and resid 38 and name HG23) or (segid " A" and resid 13 and name HA) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 13 and name HA) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 36 and name HA) (segid " A" and resid 43 and name HB1) 3.976 1.976 1.976 weight 1.000 ! spec=Noesy, no=1434, id=1429, vol=2.688330e+05 or (segid " A" and resid 36 and name HA) (segid " A" and resid 43 and name HB2) assign (segid " A" and resid 5 and name HA) (segid " A" and resid 4 and name HG2) 4.142 2.144 2.144 weight 1.000 ! spec=Noesy, no=1442, id=1437, vol=2.192408e+05 or (segid " A" and resid 5 and name HA) (segid " A" and resid 6 and name HG2) assign (segid " A" and resid 48 and name HA2) (segid " A" and resid 49 and name HG2) 5.367 3.600 3.600 weight 1.000 ! spec=Noesy, no=1443, id=1438, vol=9.773325e+04 or (segid " A" and resid 48 and name HA2) (segid " A" and resid 49 and name HG1) assign (segid " A" and resid 48 and name HA1) (segid " A" and resid 47 and name HB1) 3.879 1.880 1.880 weight 1.000 ! spec=Noesy, no=1450, id=1445, vol=3.066432e+05 or (segid " A" and resid 17 and name HA) (segid " A" and resid 18 and name HB1) assign (segid " A" and resid 15 and name HA) (segid " A" and resid 46 and name HD1) 4.170 2.174 2.174 weight 1.000 ! spec=Noesy, no=1457, id=1452, vol=2.130462e+05 or (segid " A" and resid 47 and name HD1) (segid " A" and resid 46 and name HD1) assign (segid " A" and resid 31 and name HB) (segid " A" and resid 43 and name HD1) 3.811 1.816 1.816 weight 1.000 ! spec=Noesy, no=1460, id=1455, vol=4.152140e+05 or (segid " A" and resid 31 and name HB) (segid " A" and resid 43 and name HD2) assign (segid " A" and resid 33 and name HA) (segid " A" and resid 34 and name HB2) 3.816 1.820 1.820 weight 1.000 ! spec=Noesy, no=1462, id=1457, vol=3.702035e+05 or (segid " A" and resid 33 and name HA) (segid " A" and resid 34 and name HB1) assign (segid " A" and resid 48 and name HA2) (segid " A" and resid 49 and name HD1) 3.785 1.791 1.791 weight 1.000 ! spec=Noesy, no=1464, id=1459, vol=3.868288e+05 or (segid " A" and resid 48 and name HA2) (segid " A" and resid 49 and name HD2) assign (segid " A" and resid 50 and name HA) (segid " A" and resid 50 and name HD1) 4.117 2.119 2.119 weight 1.000 ! spec=Noesy, no=1465, id=1460, vol=2.690228e+05 or (segid " A" and resid 50 and name HA) (segid " A" and resid 50 and name HD2) assign (segid " A" and resid 27 and name HB2) (segid " A" and resid 28 and name HB2) 3.577 1.599 1.599 weight 1.000 ! spec=Noesy, no=1468, id=1463, vol=5.551412e+05 or (segid " A" and resid 27 and name HB1) (segid " A" and resid 28 and name HB1) or (segid " A" and resid 27 and name HB1) (segid " A" and resid 28 and name HB2) or (segid " A" and resid 27 and name HB2) (segid " A" and resid 28 and name HB1) assign (segid " A" and resid 41 and name HB1) (segid " A" and resid 40 and name HA1) 3.286 1.349 1.349 weight 1.000 ! spec=Noesy, no=1471, id=1466, vol=1.041091e+06 or (segid " A" and resid 41 and name HB2) (segid " A" and resid 40 and name HA1) assign (segid " A" and resid 23 and name HD1) (segid " A" and resid 22 and name HG1) 3.593 1.613 1.613 weight 1.000 ! spec=Noesy, no=1493, id=1488, vol=5.720220e+05 or (segid " A" and resid 23 and name HD1) (segid " A" and resid 22 and name HG2) assign (segid " A" and resid 50 and name HD1) (segid " A" and resid 50 and name HB2) 3.070 1.178 1.178 weight 1.000 ! spec=Noesy, no=1499, id=1494, vol=1.358630e+06 or (segid " A" and resid 50 and name HD2) (segid " A" and resid 50 and name HB2) assign (segid " A" and resid 6 and name HD1) (segid " A" and resid 6 and name HG2) 2.545 0.810 0.810 weight 1.000 ! spec=Noesy, no=1500, id=1495, vol=4.086860e+06 or (segid " A" and resid 6 and name HD2) (segid " A" and resid 6 and name HG2) assign (segid " A" and resid 44 and name HB2) (segid " A" and resid 46 and name HG1) 2.920 1.066 1.066 weight 1.000 ! spec=Noesy, no=1501, id=1496, vol=2.153273e+06 or (segid " A" and resid 42 and name HB2) (segid " A" and resid 43 and name HG2) assign (segid " A" and resid 36 and name HB2) (segid " A" and resid 38 and name HG13) 4.388 2.407 2.407 weight 1.000 ! spec=Noesy, no=1508, id=1503, vol=2.163952e+05 or (segid " A" and resid 36 and name HB2) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 36 and name HB2) (segid " A" and resid 38 and name HG11) or (segid " A" and resid 44 and name HB2) (segid " A" and resid 38 and name HG13) or (segid " A" and resid 44 and name HB2) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 44 and name HB2) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 39 and name HB2) (segid " A" and resid 43 and name HG2) 3.950 1.950 1.950 weight 1.000 ! spec=Noesy, no=1524, id=1519, vol=2.707905e+05 or (segid " A" and resid 39 and name HB2) (segid " A" and resid 43 and name HB2) or (segid " A" and resid 39 and name HB2) (segid " A" and resid 43 and name HB1) assign (segid " A" and resid 49 and name HB2) (segid " A" and resid 49 and name HG1) 1.862 0.433 0.433 weight 1.000 ! spec=Noesy, no=1526, id=1521, vol=2.725811e+07 or (segid " A" and resid 49 and name HB2) (segid " A" and resid 49 and name HG2) assign (segid " A" and resid 44 and name HN) (segid " A" and resid 39 and name HN) 4.120 2.121 2.121 weight 1.000 ! spec=Noesy, no=1540, id=1535, vol=2.478270e+05 or (segid " A" and resid 44 and name HN) (segid " A" and resid 42 and name HN) assign (segid " A" and resid 33 and name HN) (segid " A" and resid 32 and name HB2) 3.408 1.452 1.452 weight 1.000 ! spec=Noesy, no=1579, id=1555, vol=6.465088e+05 or (segid " A" and resid 36 and name HN) (segid " A" and resid 32 and name HB2) assign (segid " A" and resid 26 and name HZ) (segid " A" and resid 22 and name HG1) 3.983 1.983 1.983 weight 1.000 ! spec=Noesy, no=1584, id=1558, vol=3.341685e+05 or (segid " A" and resid 26 and name HZ) (segid " A" and resid 22 and name HG2) assign (segid " A" and resid 3 and name HB1) (segid " A" and resid 12 and name HA) 3.174 1.259 1.259 weight 1.000 ! spec=Noesy, no=1598, id=1570, vol=9.161058e+05 or (segid " A" and resid 3 and name HB1) (segid " A" and resid 13 and name HA) or (segid " A" and resid 3 and name HB1) (segid " A" and resid 16 and name HA) assign (segid " A" and resid 37 and name HB2) (segid " A" and resid 37 and name HA) 2.264 0.641 0.641 weight 1.000 ! spec=Noesy, no=1606, id=1577, vol=7.422393e+06 or (segid " A" and resid 37 and name HA) (segid " A" and resid 37 and name HB1) assign (segid " A" and resid 20 and name HB2) (segid " A" and resid 22 and name HD1) 3.344 1.398 1.398 weight 1.000 ! spec=Noesy, no=1622, id=1593, vol=7.590915e+05 or (segid " A" and resid 20 and name HB2) (segid " A" and resid 22 and name HD2) assign (segid " A" and resid 45 and name HB2) (segid " A" and resid 22 and name HD1) 3.229 1.303 1.303 weight 1.000 ! spec=Noesy, no=1623, id=1594, vol=1.044500e+06 or (segid " A" and resid 45 and name HB2) (segid " A" and resid 22 and name HD2) or (segid " A" and resid 20 and name HB1) (segid " A" and resid 22 and name HD2) assign (segid " A" and resid 45 and name HB1) (segid " A" and resid 22 and name HD1) 3.212 1.290 1.290 weight 1.000 ! spec=Noesy, no=1625, id=1596, vol=9.780670e+05 or (segid " A" and resid 20 and name HB1) (segid " A" and resid 22 and name HD1) or (segid " A" and resid 20 and name HB1) (segid " A" and resid 22 and name HD2) assign (segid " A" and resid 23 and name HB1) (segid " A" and resid 10 and name HB2) 4.270 2.279 2.279 weight 1.000 ! spec=Noesy, no=1634, id=1604, vol=1.847762e+05 or (segid " A" and resid 23 and name HB1) (segid " A" and resid 22 and name HB2) or (segid " A" and resid 23 and name HB1) (segid " A" and resid 43 and name HG2) # Restraints file 5: unambig.tbl assign (segid " A" and resid 22 and name HN) (segid " A" and resid 21 and name HA) 2.211 0.611 0.611 weight 1.000 ! spec=Noesy, no=1, id=0, vol=9.858241e+06 assign (segid " A" and resid 36 and name HD22) (segid " A" and resid 36 and name HD21) 1.678 0.352 0.352 weight 1.000 ! spec=Noesy, no=2, id=1, vol=4.196343e+07 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 29 and name HA) 2.316 0.671 0.671 weight 1.000 ! spec=Noesy, no=3, id=2, vol=7.358634e+06 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 29 and name HA) 2.446 0.748 0.748 weight 1.000 ! spec=Noesy, no=4, id=3, vol=4.971868e+06 assign (segid " A" and resid 36 and name HN) (segid " A" and resid 35 and name HA) 2.602 0.846 0.846 weight 1.000 ! spec=Noesy, no=5, id=4, vol=3.192359e+06 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 45 and name HA) 2.154 0.580 0.580 weight 1.000 ! spec=Noesy, no=6, id=5, vol=1.082255e+07 assign (segid " A" and resid 31 and name HN) (segid " A" and resid 30 and name HA) 2.198 0.604 0.604 weight 1.000 ! spec=Noesy, no=7, id=6, vol=9.507101e+06 assign (segid " A" and resid 27 and name HN) (segid " A" and resid 26 and name HA) 2.098 0.550 0.550 weight 1.000 ! spec=Noesy, no=8, id=7, vol=1.177394e+07 assign (segid " A" and resid 26 and name HD2) (segid " A" and resid 26 and name HA) 2.165 0.586 0.586 weight 1.000 ! spec=Noesy, no=9, id=8, vol=1.085072e+07 or (segid " A" and resid 26 and name HD1) (segid " A" and resid 26 and name HA) assign (segid " A" and resid 15 and name HN) (segid " A" and resid 14 and name HA) 2.272 0.645 0.645 weight 1.000 ! spec=Noesy, no=10, id=9, vol=7.716440e+06 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 14 and name HA) 2.574 0.828 0.828 weight 1.000 ! spec=Noesy, no=11, id=10, vol=3.525330e+06 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 19 and name HA1) 2.299 0.661 0.661 weight 1.000 ! spec=Noesy, no=12, id=11, vol=7.448350e+06 assign (segid " A" and resid 19 and name HN) (segid " A" and resid 19 and name HA1) 2.560 0.819 0.819 weight 1.000 ! spec=Noesy, no=13, id=12, vol=4.066689e+06 assign (segid " A" and resid 33 and name HN) (segid " A" and resid 32 and name HA) 2.091 0.546 0.546 weight 1.000 ! spec=Noesy, no=14, id=13, vol=1.188904e+07 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 32 and name HA) 2.553 0.815 0.815 weight 1.000 ! spec=Noesy, no=15, id=14, vol=4.265058e+06 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 32 and name HA) assign (segid " A" and resid 12 and name HE1) (segid " A" and resid 39 and name HA) 2.377 0.706 0.706 weight 1.000 ! spec=Noesy, no=16, id=15, vol=4.985479e+06 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 42 and name HA) 2.458 0.755 0.755 weight 1.000 ! spec=Noesy, no=17, id=16, vol=5.016771e+06 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 42 and name HA) 2.343 2.343 3.657 weight 1.000 ! spec=Noesy, no=19, id=18, vol=5.413946e+06 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 42 and name HA) assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 42 and name HA) 2.063 0.532 0.532 weight 1.000 ! spec=Noesy, no=20, id=19, vol=1.445540e+07 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 42 and name HA) assign (segid " A" and resid 9 and name HN) (segid " A" and resid 8 and name HA) 2.204 0.607 0.607 weight 1.000 ! spec=Noesy, no=21, id=20, vol=9.089447e+06 assign (segid " A" and resid 26 and name HN) (segid " A" and resid 25 and name HA) 2.216 0.614 0.614 weight 1.000 ! spec=Noesy, no=22, id=21, vol=8.884311e+06 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 47 and name HA) 1.997 0.499 0.499 weight 1.000 ! spec=Noesy, no=23, id=22, vol=1.647483e+07 assign (segid " A" and resid 45 and name HN) (segid " A" and resid 44 and name HA) 2.171 0.589 0.589 weight 1.000 ! spec=Noesy, no=24, id=23, vol=1.075676e+07 assign (segid " A" and resid 3 and name HN) (segid " A" and resid 2 and name HA) 2.332 2.332 3.668 weight 1.000 ! spec=Noesy, no=25, id=24, vol=6.819042e+06 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 20 and name HA) 2.213 0.612 0.612 weight 1.000 ! spec=Noesy, no=26, id=25, vol=8.909069e+06 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 43 and name HA) 2.102 0.552 0.552 weight 1.000 ! spec=Noesy, no=27, id=26, vol=1.219773e+07 assign (segid " A" and resid 12 and name HN) (segid " A" and resid 11 and name HA) 2.356 0.694 0.694 weight 1.000 ! spec=Noesy, no=28, id=27, vol=6.328193e+06 assign (segid " A" and resid 8 and name HN) (segid " A" and resid 7 and name HA) 2.131 2.131 3.869 weight 1.000 ! spec=Noesy, no=29, id=28, vol=1.086433e+07 assign (segid " A" and resid 7 and name HN) (segid " A" and resid 7 and name HA) 2.584 0.835 0.835 weight 1.000 ! spec=Noesy, no=30, id=29, vol=3.011066e+06 assign (segid " A" and resid 34 and name HN) (segid " A" and resid 34 and name HA) 2.422 0.733 0.733 weight 1.000 ! spec=Noesy, no=31, id=30, vol=4.915060e+06 assign (segid " A" and resid 10 and name HN) (segid " A" and resid 10 and name HA) 2.592 0.840 0.840 weight 1.000 ! spec=Noesy, no=32, id=31, vol=3.584164e+06 assign (segid " A" and resid 12 and name HD2) (segid " A" and resid 10 and name HA) 2.048 2.048 3.952 weight 1.000 ! spec=Noesy, no=33, id=32, vol=1.244132e+07 assign (segid " A" and resid 7 and name HN) (segid " A" and resid 6 and name HA) 2.105 2.105 3.895 weight 1.000 ! spec=Noesy, no=34, id=33, vol=1.181978e+07 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 11 and name HB1) 2.387 0.712 0.712 weight 1.000 ! spec=Noesy, no=35, id=34, vol=6.023172e+06 assign (segid " A" and resid 37 and name HN) (segid " A" and resid 37 and name HA) 2.225 0.619 0.619 weight 1.000 ! spec=Noesy, no=37, id=36, vol=7.634039e+06 assign (segid " A" and resid 50 and name HN) (segid " A" and resid 49 and name HA) 2.128 2.128 3.872 weight 1.000 ! spec=Noesy, no=38, id=37, vol=1.093086e+07 assign (segid " A" and resid 49 and name HN) (segid " A" and resid 49 and name HA) 2.418 0.731 0.731 weight 1.000 ! spec=Noesy, no=39, id=38, vol=4.707898e+06 assign (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HA) 2.326 0.676 0.676 weight 1.000 ! spec=Noesy, no=40, id=39, vol=6.622082e+06 assign (segid " A" and resid 36 and name HN) (segid " A" and resid 36 and name HA) 2.470 0.763 0.763 weight 1.000 ! spec=Noesy, no=41, id=40, vol=4.318129e+06 assign (segid " A" and resid 4 and name HN) (segid " A" and resid 3 and name HA) 2.129 0.566 0.566 weight 1.000 ! spec=Noesy, no=42, id=41, vol=1.039893e+07 assign (segid " A" and resid 5 and name HN) (segid " A" and resid 4 and name HA) 2.157 0.582 0.582 weight 1.000 ! spec=Noesy, no=43, id=42, vol=1.046279e+07 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 48 and name HA1) 2.479 0.768 0.768 weight 1.000 ! spec=Noesy, no=44, id=43, vol=5.119550e+06 assign (segid " A" and resid 49 and name HN) (segid " A" and resid 48 and name HA1) 2.349 2.349 3.651 weight 1.000 ! spec=Noesy, no=45, id=44, vol=6.313959e+06 assign (segid " A" and resid 16 and name HN) (segid " A" and resid 16 and name HA) 1.989 0.495 0.495 weight 1.000 ! spec=Noesy, no=46, id=45, vol=1.685589e+07 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 13 and name HA) 2.090 0.546 0.546 weight 1.000 ! spec=Noesy, no=49, id=48, vol=1.232583e+07 assign (segid " A" and resid 20 and name HZ2) (segid " A" and resid 12 and name HA) 2.439 0.744 0.744 weight 1.000 ! spec=Noesy, no=51, id=50, vol=5.336432e+06 assign (segid " A" and resid 20 and name HE3) (segid " A" and resid 13 and name HA) 2.490 0.775 0.775 weight 1.000 ! spec=Noesy, no=52, id=51, vol=3.944901e+06 assign (segid " A" and resid 32 and name HN) (segid " A" and resid 31 and name HA) 2.084 0.543 0.543 weight 1.000 ! spec=Noesy, no=53, id=52, vol=1.344719e+07 assign (segid " A" and resid 27 and name HN) (segid " A" and resid 27 and name HA) 2.394 0.717 0.717 weight 1.000 ! spec=Noesy, no=54, id=53, vol=5.108238e+06 assign (segid " A" and resid 6 and name HN) (segid " A" and resid 5 and name HA) 2.042 0.521 0.521 weight 1.000 ! spec=Noesy, no=55, id=54, vol=1.408275e+07 assign (segid " A" and resid 5 and name HN) (segid " A" and resid 5 and name HA) 2.569 0.825 0.825 weight 1.000 ! spec=Noesy, no=56, id=55, vol=3.197539e+06 assign (segid " A" and resid 33 and name HE3) (segid " A" and resid 33 and name HA) 2.432 0.739 0.739 weight 1.000 ! spec=Noesy, no=57, id=56, vol=5.624119e+06 assign (segid " A" and resid 33 and name HN) (segid " A" and resid 33 and name HA) 2.334 0.681 0.681 weight 1.000 ! spec=Noesy, no=58, id=57, vol=6.126245e+06 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 13 and name HB2) 2.390 0.714 0.714 weight 1.000 ! spec=Noesy, no=59, id=58, vol=5.715288e+06 assign (segid " A" and resid 49 and name HN) (segid " A" and resid 48 and name HA2) 2.413 2.413 3.587 weight 1.000 ! spec=Noesy, no=61, id=60, vol=5.358718e+06 assign (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HA) 2.479 0.768 0.768 weight 1.000 ! spec=Noesy, no=62, id=61, vol=4.266405e+06 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 13 and name HB1) 2.390 0.714 0.714 weight 1.000 ! spec=Noesy, no=63, id=62, vol=5.366916e+06 assign (segid " A" and resid 17 and name HD22) (segid " A" and resid 50 and name HA) 2.427 2.427 3.573 weight 1.000 ! spec=Noesy, no=64, id=63, vol=4.375434e+06 assign (segid " A" and resid 40 and name HN) (segid " A" and resid 40 and name HA2) 2.310 0.667 0.667 weight 1.000 ! spec=Noesy, no=65, id=64, vol=6.806592e+06 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 11 and name HB2) 2.500 0.781 0.781 weight 1.000 ! spec=Noesy, no=66, id=65, vol=4.366513e+06 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 11 and name HB2) 2.432 0.740 0.740 weight 1.000 ! spec=Noesy, no=67, id=66, vol=5.182060e+06 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 11 and name HB2) assign (segid " A" and resid 41 and name HN) (segid " A" and resid 40 and name HA2) 2.162 0.584 0.584 weight 1.000 ! spec=Noesy, no=68, id=67, vol=1.080923e+07 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 15 and name HA) 2.062 0.532 0.532 weight 1.000 ! spec=Noesy, no=69, id=68, vol=1.387486e+07 assign (segid " A" and resid 16 and name HN) (segid " A" and resid 15 and name HA) 2.333 0.681 0.681 weight 1.000 ! spec=Noesy, no=70, id=69, vol=6.542083e+06 assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 23 and name HA) 2.560 0.819 0.819 weight 1.000 ! spec=Noesy, no=72, id=71, vol=3.852976e+06 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 23 and name HA) assign (segid " A" and resid 41 and name HN) (segid " A" and resid 40 and name HA1) 2.506 2.506 3.494 weight 1.000 ! spec=Noesy, no=74, id=73, vol=4.449440e+06 assign (segid " A" and resid 40 and name HN) (segid " A" and resid 40 and name HA1) 2.117 0.560 0.560 weight 1.000 ! spec=Noesy, no=75, id=74, vol=1.191475e+07 assign (segid " A" and resid 31 and name HN) (segid " A" and resid 31 and name HB) 2.341 0.685 0.685 weight 1.000 ! spec=Noesy, no=76, id=75, vol=6.589414e+06 assign (segid " A" and resid 27 and name HN) (segid " A" and resid 26 and name HB2) 2.196 0.603 0.603 weight 1.000 ! spec=Noesy, no=77, id=76, vol=9.136477e+06 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 19 and name HA2) 2.394 0.716 0.716 weight 1.000 ! spec=Noesy, no=78, id=77, vol=5.792016e+06 assign (segid " A" and resid 19 and name HN) (segid " A" and resid 19 and name HA2) 2.582 0.834 0.834 weight 1.000 ! spec=Noesy, no=79, id=78, vol=3.745209e+06 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 12 and name HB1) 2.453 2.453 3.547 weight 1.000 ! spec=Noesy, no=80, id=79, vol=4.489015e+06 assign (segid " A" and resid 12 and name HD2) (segid " A" and resid 12 and name HB1) 2.376 0.706 0.706 weight 1.000 ! spec=Noesy, no=81, id=80, vol=4.926492e+06 assign (segid " A" and resid 33 and name HE3) (segid " A" and resid 33 and name HB1) 2.498 0.780 0.780 weight 1.000 ! spec=Noesy, no=82, id=81, vol=4.829896e+06 assign (segid " A" and resid 33 and name HN) (segid " A" and resid 33 and name HB1) 2.607 0.849 0.849 weight 1.000 ! spec=Noesy, no=83, id=82, vol=3.161226e+06 assign (segid " A" and resid 33 and name HD1) (segid " A" and resid 33 and name HB1) 2.517 2.517 3.483 weight 1.000 ! spec=Noesy, no=84, id=83, vol=3.408928e+06 assign (segid " A" and resid 9 and name HN) (segid " A" and resid 9 and name HB2) 2.403 0.722 0.722 weight 1.000 ! spec=Noesy, no=85, id=84, vol=5.428027e+06 assign (segid " A" and resid 42 and name HN) (segid " A" and resid 42 and name HB1) 2.434 0.741 0.741 weight 1.000 ! spec=Noesy, no=86, id=85, vol=5.450611e+06 assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 42 and name HB1) 2.576 0.829 0.829 weight 1.000 ! spec=Noesy, no=87, id=86, vol=3.922513e+06 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 42 and name HB1) assign (segid " A" and resid 18 and name HE) (segid " A" and resid 18 and name HD1) 2.542 0.808 0.808 weight 1.000 ! spec=Noesy, no=88, id=87, vol=3.403946e+06 assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 35 and name HB2) 2.527 0.798 0.798 weight 1.000 ! spec=Noesy, no=89, id=88, vol=3.920735e+06 assign (segid " A" and resid 26 and name HN) (segid " A" and resid 25 and name HB1) 2.494 0.778 0.778 weight 1.000 ! spec=Noesy, no=90, id=89, vol=4.418024e+06 assign (segid " A" and resid 9 and name HN) (segid " A" and resid 9 and name HB1) 2.538 0.805 0.805 weight 1.000 ! spec=Noesy, no=91, id=90, vol=3.893928e+06 assign (segid " A" and resid 31 and name HN) (segid " A" and resid 30 and name HB2) 2.434 0.741 0.741 weight 1.000 ! spec=Noesy, no=94, id=93, vol=5.227932e+06 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 30 and name HB2) 2.200 0.605 0.605 weight 1.000 ! spec=Noesy, no=95, id=94, vol=9.392619e+06 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 30 and name HB2) assign (segid " A" and resid 21 and name HN) (segid " A" and resid 21 and name HB1) 2.535 0.803 0.803 weight 1.000 ! spec=Noesy, no=96, id=95, vol=4.049494e+06 assign (segid " A" and resid 12 and name HN) (segid " A" and resid 21 and name HB1) 2.625 0.861 0.861 weight 1.000 ! spec=Noesy, no=97, id=96, vol=3.409624e+06 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 12 and name HB2) 2.194 0.602 0.602 weight 1.000 ! spec=Noesy, no=98, id=97, vol=8.803516e+06 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 42 and name HB2) 2.272 0.645 0.645 weight 1.000 ! spec=Noesy, no=100, id=99, vol=8.118475e+06 assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 42 and name HB2) 2.521 0.794 0.794 weight 1.000 ! spec=Noesy, no=101, id=100, vol=4.436106e+06 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 42 and name HB2) assign (segid " A" and resid 44 and name HN) (segid " A" and resid 44 and name HB2) 2.440 2.440 3.560 weight 1.000 ! spec=Noesy, no=102, id=101, vol=5.091092e+06 assign (segid " A" and resid 36 and name HD22) (segid " A" and resid 36 and name HB1) 2.568 0.824 0.824 weight 1.000 ! spec=Noesy, no=104, id=103, vol=3.553282e+06 assign (segid " A" and resid 33 and name HD1) (segid " A" and resid 33 and name HB2) 2.275 0.647 0.647 weight 1.000 ! spec=Noesy, no=106, id=105, vol=6.222590e+06 assign (segid " A" and resid 9 and name HN) (segid " A" and resid 8 and name HB1) 2.515 0.791 0.791 weight 1.000 ! spec=Noesy, no=107, id=106, vol=4.197039e+06 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 30 and name HB1) 2.191 0.600 0.600 weight 1.000 ! spec=Noesy, no=108, id=107, vol=9.579435e+06 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 30 and name HB1) assign (segid " A" and resid 39 and name HN) (segid " A" and resid 39 and name HB1) 2.507 0.785 0.785 weight 1.000 ! spec=Noesy, no=109, id=108, vol=4.403530e+06 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 44 and name HB1) 2.421 0.733 0.733 weight 1.000 ! spec=Noesy, no=110, id=109, vol=5.325030e+06 assign (segid " A" and resid 45 and name HN) (segid " A" and resid 45 and name HB2) 2.481 0.769 0.769 weight 1.000 ! spec=Noesy, no=111, id=110, vol=4.755400e+06 assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 21 and name HB2) 2.624 0.861 0.861 weight 1.000 ! spec=Noesy, no=112, id=111, vol=3.526528e+06 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 21 and name HB2) assign (segid " A" and resid 37 and name HN) (segid " A" and resid 37 and name HB1) 2.258 0.637 0.637 weight 1.000 ! spec=Noesy, no=113, id=112, vol=8.069062e+06 assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 20 and name HB1) 2.406 0.724 0.724 weight 1.000 ! spec=Noesy, no=114, id=113, vol=4.693087e+06 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 14 and name HB2) 2.419 0.732 0.732 weight 1.000 ! spec=Noesy, no=115, id=114, vol=5.411314e+06 assign (segid " A" and resid 8 and name HN) (segid " A" and resid 8 and name HB2) 2.517 0.792 0.792 weight 1.000 ! spec=Noesy, no=116, id=115, vol=4.257128e+06 assign (segid " A" and resid 26 and name HD2) (segid " A" and resid 26 and name HB1) 2.599 0.844 0.844 weight 1.000 ! spec=Noesy, no=118, id=117, vol=3.716262e+06 or (segid " A" and resid 26 and name HD1) (segid " A" and resid 26 and name HB1) assign (segid " A" and resid 26 and name HN) (segid " A" and resid 26 and name HB1) 2.381 0.708 0.708 weight 1.000 ! spec=Noesy, no=119, id=118, vol=6.495760e+06 assign (segid " A" and resid 32 and name HN) (segid " A" and resid 32 and name HB2) 2.550 0.813 0.813 weight 1.000 ! spec=Noesy, no=120, id=119, vol=4.112326e+06 assign (segid " A" and resid 25 and name HN) (segid " A" and resid 25 and name HB2) 2.212 0.612 0.612 weight 1.000 ! spec=Noesy, no=121, id=120, vol=8.839875e+06 assign (segid " A" and resid 12 and name HE1) (segid " A" and resid 38 and name HB) 2.378 0.707 0.707 weight 1.000 ! spec=Noesy, no=123, id=122, vol=4.807750e+06 assign (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HB) 2.606 2.606 3.394 weight 1.000 ! spec=Noesy, no=124, id=123, vol=3.375446e+06 assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 35 and name HB1) 2.345 0.687 0.687 weight 1.000 ! spec=Noesy, no=125, id=124, vol=6.096409e+06 assign (segid " A" and resid 35 and name HN) (segid " A" and resid 35 and name HB1) 2.553 0.815 0.815 weight 1.000 ! spec=Noesy, no=126, id=125, vol=4.163973e+06 assign (segid " A" and resid 35 and name HD22) (segid " A" and resid 35 and name HB1) 2.607 0.849 0.849 weight 1.000 ! spec=Noesy, no=127, id=126, vol=3.180069e+06 assign (segid " A" and resid 26 and name HN) (segid " A" and resid 29 and name HB1) 2.591 0.839 0.839 weight 1.000 ! spec=Noesy, no=128, id=127, vol=3.592336e+06 assign (segid " A" and resid 29 and name HN) (segid " A" and resid 29 and name HB1) 2.640 0.871 0.871 weight 1.000 ! spec=Noesy, no=129, id=128, vol=3.780903e+06 assign (segid " A" and resid 32 and name HN) (segid " A" and resid 32 and name HB1) 2.623 0.860 0.860 weight 1.000 ! spec=Noesy, no=130, id=129, vol=3.434260e+06 assign (segid " A" and resid 24 and name HN) (segid " A" and resid 23 and name HG1) 2.621 0.859 0.859 weight 1.000 ! spec=Noesy, no=131, id=130, vol=3.441145e+06 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 18 and name HB2) 2.462 0.758 0.758 weight 1.000 ! spec=Noesy, no=132, id=131, vol=5.107222e+06 assign (segid " A" and resid 5 and name HN) (segid " A" and resid 5 and name HB) 2.505 0.784 0.784 weight 1.000 ! spec=Noesy, no=133, id=132, vol=4.384242e+06 assign (segid " A" and resid 6 and name HN) (segid " A" and resid 6 and name HB1) 2.565 0.822 0.822 weight 1.000 ! spec=Noesy, no=134, id=133, vol=3.725573e+06 assign (segid " A" and resid 46 and name HE) (segid " A" and resid 46 and name HB2) 2.541 0.807 0.807 weight 1.000 ! spec=Noesy, no=135, id=134, vol=3.963127e+06 assign (segid " A" and resid 49 and name HN) (segid " A" and resid 49 and name HB1) 2.534 2.534 3.466 weight 1.000 ! spec=Noesy, no=137, id=136, vol=3.974789e+06 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 29 and name HB2) 2.507 0.786 0.786 weight 1.000 ! spec=Noesy, no=138, id=137, vol=4.654041e+06 assign (segid " A" and resid 50 and name HN) (segid " A" and resid 50 and name HB1) 2.579 0.831 0.831 weight 1.000 ! spec=Noesy, no=139, id=138, vol=3.699120e+06 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 43 and name HB2) 2.452 0.752 0.752 weight 1.000 ! spec=Noesy, no=140, id=139, vol=4.944826e+06 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 43 and name HG2) 2.324 0.675 0.675 weight 1.000 ! spec=Noesy, no=141, id=140, vol=7.047957e+06 assign (segid " A" and resid 10 and name HN) (segid " A" and resid 10 and name HB2) 2.432 0.739 0.739 weight 1.000 ! spec=Noesy, no=142, id=141, vol=5.325635e+06 assign (segid " A" and resid 43 and name HE) (segid " A" and resid 43 and name HG2) 2.624 0.861 0.861 weight 1.000 ! spec=Noesy, no=143, id=142, vol=3.211978e+06 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 15 and name HB3) 2.520 0.794 0.794 weight 1.000 ! spec=Noesy, no=144, id=143, vol=4.153477e+06 or (segid " A" and resid 15 and name HN) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 15 and name HN) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 15 and name HB3) 2.605 0.848 0.848 weight 1.000 ! spec=Noesy, no=145, id=144, vol=3.176544e+06 or (segid " A" and resid 35 and name HD21) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 35 and name HD21) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 19 and name HN) (segid " A" and resid 15 and name HB3) 2.613 0.853 0.853 weight 1.000 ! spec=Noesy, no=146, id=145, vol=3.422608e+06 or (segid " A" and resid 19 and name HN) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 19 and name HN) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 22 and name HB1) 2.524 2.524 3.476 weight 1.000 ! spec=Noesy, no=147, id=146, vol=3.552876e+06 assign (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HG23) 2.528 2.528 3.472 weight 1.000 ! spec=Noesy, no=148, id=147, vol=3.806362e+06 or (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HG21) or (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HG22) assign (segid " A" and resid 12 and name HE1) (segid " A" and resid 38 and name HG23) 2.178 0.593 0.593 weight 1.000 ! spec=Noesy, no=149, id=148, vol=8.127652e+06 or (segid " A" and resid 12 and name HE1) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 12 and name HE1) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HG23) 2.246 0.631 0.631 weight 1.000 ! spec=Noesy, no=150, id=149, vol=8.675470e+06 or (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HG13) 2.304 0.663 0.663 weight 1.000 ! spec=Noesy, no=151, id=150, vol=7.477092e+06 or (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 38 and name HN) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 9 and name HN) (segid " A" and resid 10 and name HN) 2.578 0.831 0.831 weight 1.000 ! spec=Noesy, no=152, id=151, vol=3.377116e+06 assign (segid " A" and resid 41 and name HN) (segid " A" and resid 42 and name HN) 2.335 0.682 0.682 weight 1.000 ! spec=Noesy, no=153, id=152, vol=6.674504e+06 assign (segid " A" and resid 33 and name HE1) (segid " A" and resid 33 and name HZ2) 2.284 0.652 0.652 weight 1.000 ! spec=Noesy, no=154, id=153, vol=6.172555e+06 assign (segid " A" and resid 37 and name HN) (segid " A" and resid 36 and name HN) 2.339 0.684 0.684 weight 1.000 ! spec=Noesy, no=155, id=154, vol=5.692396e+06 assign (segid " A" and resid 33 and name HE1) (segid " A" and resid 33 and name HD1) 2.027 0.514 0.514 weight 1.000 ! spec=Noesy, no=156, id=155, vol=1.245553e+07 assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 20 and name HE3) 2.418 2.418 3.582 weight 1.000 ! spec=Noesy, no=157, id=156, vol=4.660200e+06 assign (segid " A" and resid 37 and name HN) (segid " A" and resid 38 and name HN) 2.406 0.724 0.724 weight 1.000 ! spec=Noesy, no=158, id=157, vol=4.907054e+06 assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 35 and name HD22) 1.782 0.397 0.397 weight 1.000 ! spec=Noesy, no=159, id=158, vol=3.069177e+07 assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 20 and name HD1) 2.108 0.556 0.556 weight 1.000 ! spec=Noesy, no=160, id=159, vol=1.050754e+07 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 30 and name HD2) 2.476 0.766 0.766 weight 1.000 ! spec=Noesy, no=161, id=160, vol=4.828966e+06 or (segid " A" and resid 30 and name HN) (segid " A" and resid 30 and name HD1) assign (segid " A" and resid 16 and name HN) (segid " A" and resid 17 and name HN) 2.536 0.804 0.804 weight 1.000 ! spec=Noesy, no=162, id=161, vol=3.943781e+06 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 16 and name HN) 2.615 0.855 0.855 weight 1.000 ! spec=Noesy, no=163, id=162, vol=3.319724e+06 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 43 and name HN) 2.561 0.820 0.820 weight 1.000 ! spec=Noesy, no=164, id=163, vol=3.747504e+06 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 18 and name HN) 2.526 0.798 0.798 weight 1.000 ! spec=Noesy, no=165, id=164, vol=4.149735e+06 assign (segid " A" and resid 19 and name HN) (segid " A" and resid 18 and name HN) 2.233 0.623 0.623 weight 1.000 ! spec=Noesy, no=166, id=165, vol=8.793609e+06 assign (segid " A" and resid 34 and name HN) (segid " A" and resid 35 and name HN) 2.279 0.649 0.649 weight 1.000 ! spec=Noesy, no=167, id=166, vol=6.997332e+06 assign (segid " A" and resid 34 and name HN) (segid " A" and resid 33 and name HN) 2.427 0.736 0.736 weight 1.000 ! spec=Noesy, no=168, id=167, vol=4.773806e+06 assign (segid " A" and resid 10 and name HN) (segid " A" and resid 11 and name HN) 2.452 0.751 0.751 weight 1.000 ! spec=Noesy, no=169, id=168, vol=4.918425e+06 assign (segid " A" and resid 39 and name HN) (segid " A" and resid 38 and name HN) 2.365 0.699 0.699 weight 1.000 ! spec=Noesy, no=170, id=169, vol=6.164945e+06 assign (segid " A" and resid 33 and name HE3) (segid " A" and resid 33 and name HH2) 2.401 2.401 3.599 weight 1.000 ! spec=Noesy, no=171, id=170, vol=4.144556e+06 assign (segid " A" and resid 33 and name HZ2) (segid " A" and resid 33 and name HH2) 2.165 0.586 0.586 weight 1.000 ! spec=Noesy, no=172, id=171, vol=8.675758e+06 assign (segid " A" and resid 20 and name HZ2) (segid " A" and resid 20 and name HH2) 2.257 0.637 0.637 weight 1.000 ! spec=Noesy, no=173, id=172, vol=8.015412e+06 assign (segid " A" and resid 33 and name HE3) (segid " A" and resid 33 and name HZ3) 2.284 0.652 0.652 weight 1.000 ! spec=Noesy, no=174, id=173, vol=5.856082e+06 assign (segid " A" and resid 17 and name HD22) (segid " A" and resid 17 and name HD21) 1.593 0.317 0.317 weight 1.000 ! spec=Noesy, no=175, id=174, vol=5.790255e+07 assign (segid " A" and resid 16 and name HD22) (segid " A" and resid 16 and name HD21) 1.549 0.300 0.300 weight 1.000 ! spec=Noesy, no=176, id=175, vol=6.673233e+07 assign (segid " A" and resid 3 and name HE22) (segid " A" and resid 3 and name HE21) 1.588 0.315 0.315 weight 1.000 ! spec=Noesy, no=177, id=176, vol=5.777241e+07 assign (segid " A" and resid 35 and name HN) (segid " A" and resid 36 and name HN) 2.383 0.710 0.710 weight 1.000 ! spec=Noesy, no=178, id=177, vol=6.086892e+06 assign (segid " A" and resid 36 and name HD22) (segid " A" and resid 33 and name HE3) 2.575 0.829 0.829 weight 1.000 ! spec=Noesy, no=179, id=178, vol=3.159654e+06 assign (segid " A" and resid 2 and name HD1) (segid " A" and resid 2 and name HE1) 1.924 0.463 0.463 weight 1.000 ! spec=Noesy, no=180, id=179, vol=1.702863e+07 or (segid " A" and resid 2 and name HD1) (segid " A" and resid 2 and name HE2) or (segid " A" and resid 2 and name HD2) (segid " A" and resid 2 and name HE1) or (segid " A" and resid 2 and name HD2) (segid " A" and resid 2 and name HE2) assign (segid " A" and resid 33 and name HH2) (segid " A" and resid 33 and name HZ3) 2.140 0.572 0.572 weight 1.000 ! spec=Noesy, no=181, id=180, vol=9.529536e+06 assign (segid " A" and resid 26 and name HE1) (segid " A" and resid 26 and name HD2) 1.654 1.654 4.346 weight 1.000 ! spec=Noesy, no=182, id=181, vol=5.008176e+07 or (segid " A" and resid 26 and name HE1) (segid " A" and resid 26 and name HD1) or (segid " A" and resid 26 and name HE2) (segid " A" and resid 26 and name HD2) or (segid " A" and resid 26 and name HE2) (segid " A" and resid 26 and name HD1) assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 42 and name HD1) 1.634 1.634 4.366 weight 1.000 ! spec=Noesy, no=183, id=182, vol=4.586507e+07 or (segid " A" and resid 42 and name HE2) (segid " A" and resid 42 and name HD2) or (segid " A" and resid 42 and name HE1) (segid " A" and resid 42 and name HD1) or (segid " A" and resid 42 and name HE1) (segid " A" and resid 42 and name HD2) assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 30 and name HE2) 1.737 0.377 0.377 weight 1.000 ! spec=Noesy, no=184, id=183, vol=3.244299e+07 or (segid " A" and resid 30 and name HD2) (segid " A" and resid 30 and name HE1) or (segid " A" and resid 30 and name HD1) (segid " A" and resid 30 and name HE2) or (segid " A" and resid 30 and name HD1) (segid " A" and resid 30 and name HE1) assign (segid " A" and resid 20 and name HZ3) (segid " A" and resid 20 and name HH2) 2.102 0.552 0.552 weight 1.000 ! spec=Noesy, no=185, id=184, vol=1.166995e+07 assign (segid " A" and resid 20 and name HE3) (segid " A" and resid 20 and name HZ3) 1.827 1.827 4.173 weight 1.000 ! spec=Noesy, no=186, id=185, vol=2.135796e+07 assign (segid " A" and resid 34 and name HE2) (segid " A" and resid 34 and name HD1) 1.492 1.492 4.508 weight 1.000 ! spec=Noesy, no=187, id=186, vol=8.599955e+07 or (segid " A" and resid 34 and name HE2) (segid " A" and resid 34 and name HD2) or (segid " A" and resid 34 and name HE1) (segid " A" and resid 34 and name HD1) or (segid " A" and resid 34 and name HE1) (segid " A" and resid 34 and name HD2) assign (segid " A" and resid 40 and name HA2) (segid " A" and resid 40 and name HA1) 2.268 0.643 0.643 weight 1.000 ! spec=Noesy, no=188, id=187, vol=1.174247e+07 assign (segid " A" and resid 12 and name HA) (segid " A" and resid 12 and name HB1) 2.245 0.630 0.630 weight 1.000 ! spec=Noesy, no=189, id=188, vol=8.438208e+06 assign (segid " A" and resid 33 and name HA) (segid " A" and resid 33 and name HB1) 2.737 0.936 0.936 weight 1.000 ! spec=Noesy, no=190, id=189, vol=3.859603e+06 assign (segid " A" and resid 9 and name HA) (segid " A" and resid 9 and name HB2) 2.495 0.778 0.778 weight 1.000 ! spec=Noesy, no=191, id=190, vol=4.357938e+06 assign (segid " A" and resid 36 and name HA) (segid " A" and resid 36 and name HB2) 2.260 0.638 0.638 weight 1.000 ! spec=Noesy, no=194, id=193, vol=8.404429e+06 assign (segid " A" and resid 24 and name HA) (segid " A" and resid 43 and name HD2) 2.560 0.819 0.819 weight 1.000 ! spec=Noesy, no=195, id=194, vol=3.847425e+06 assign (segid " A" and resid 33 and name HA) (segid " A" and resid 33 and name HB2) 2.345 0.688 0.688 weight 1.000 ! spec=Noesy, no=196, id=195, vol=6.549656e+06 assign (segid " A" and resid 37 and name HA) (segid " A" and resid 37 and name HB1) 2.127 0.565 0.565 weight 1.000 ! spec=Noesy, no=197, id=196, vol=1.088171e+07 assign (segid " A" and resid 16 and name HA) (segid " A" and resid 16 and name HB1) 2.297 0.660 0.660 weight 1.000 ! spec=Noesy, no=198, id=197, vol=7.095283e+06 assign (segid " A" and resid 38 and name HA) (segid " A" and resid 38 and name HB) 2.143 0.574 0.574 weight 1.000 ! spec=Noesy, no=199, id=198, vol=1.068163e+07 assign (segid " A" and resid 23 and name HA) (segid " A" and resid 23 and name HB1) 2.283 0.651 0.651 weight 1.000 ! spec=Noesy, no=200, id=199, vol=7.241664e+06 assign (segid " A" and resid 4 and name HA) (segid " A" and resid 3 and name HB1) 2.181 2.181 3.819 weight 1.000 ! spec=Noesy, no=201, id=200, vol=8.054234e+06 assign (segid " A" and resid 6 and name HA) (segid " A" and resid 6 and name HB2) 2.475 0.766 0.766 weight 1.000 ! spec=Noesy, no=202, id=201, vol=4.037571e+06 assign (segid " A" and resid 3 and name HA) (segid " A" and resid 3 and name HB2) 2.106 0.554 0.554 weight 1.000 ! spec=Noesy, no=203, id=202, vol=1.045909e+07 assign (segid " A" and resid 15 and name HA) (segid " A" and resid 15 and name HB3) 2.431 0.739 0.739 weight 1.000 ! spec=Noesy, no=205, id=204, vol=5.736078e+06 or (segid " A" and resid 15 and name HA) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 15 and name HA) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 24 and name HA) (segid " A" and resid 24 and name HG23) 2.414 0.728 0.728 weight 1.000 ! spec=Noesy, no=206, id=205, vol=5.351040e+06 or (segid " A" and resid 24 and name HA) (segid " A" and resid 24 and name HG21) or (segid " A" and resid 24 and name HA) (segid " A" and resid 24 and name HG22) assign (segid " A" and resid 24 and name HB) (segid " A" and resid 24 and name HG23) 2.446 0.748 0.748 weight 1.000 ! spec=Noesy, no=207, id=206, vol=5.051618e+06 or (segid " A" and resid 24 and name HB) (segid " A" and resid 24 and name HG21) or (segid " A" and resid 24 and name HB) (segid " A" and resid 24 and name HG22) assign (segid " A" and resid 41 and name HA) (segid " A" and resid 40 and name HA2) 2.448 2.448 3.552 weight 1.000 ! spec=Noesy, no=208, id=207, vol=5.260466e+06 assign (segid " A" and resid 47 and name HD2) (segid " A" and resid 47 and name HD1) 2.008 0.504 0.504 weight 1.000 ! spec=Noesy, no=209, id=208, vol=1.720715e+07 assign (segid " A" and resid 24 and name HA) (segid " A" and resid 24 and name HB) 2.289 0.655 0.655 weight 1.000 ! spec=Noesy, no=211, id=210, vol=6.961075e+06 assign (segid " A" and resid 18 and name HD2) (segid " A" and resid 18 and name HD1) 1.824 0.416 0.416 weight 1.000 ! spec=Noesy, no=212, id=211, vol=2.865756e+07 assign (segid " A" and resid 9 and name HB2) (segid " A" and resid 9 and name HB1) 1.789 0.400 0.400 weight 1.000 ! spec=Noesy, no=213, id=212, vol=3.183382e+07 assign (segid " A" and resid 33 and name HB1) (segid " A" and resid 33 and name HB2) 1.927 0.464 0.464 weight 1.000 ! spec=Noesy, no=214, id=213, vol=1.874366e+07 assign (segid " A" and resid 23 and name HD1) (segid " A" and resid 23 and name HD2) 2.071 0.536 0.536 weight 1.000 ! spec=Noesy, no=215, id=214, vol=1.431666e+07 assign (segid " A" and resid 16 and name HB2) (segid " A" and resid 16 and name HB1) 2.025 0.512 0.512 weight 1.000 ! spec=Noesy, no=216, id=215, vol=1.628112e+07 assign (segid " A" and resid 46 and name HD2) (segid " A" and resid 46 and name HD1) 2.232 0.622 0.622 weight 1.000 ! spec=Noesy, no=220, id=219, vol=9.137284e+06 assign (segid " A" and resid 30 and name HB2) (segid " A" and resid 30 and name HB1) 2.085 0.543 0.543 weight 1.000 ! spec=Noesy, no=221, id=220, vol=1.578286e+07 assign (segid " A" and resid 17 and name HB2) (segid " A" and resid 17 and name HB1) 1.773 0.393 0.393 weight 1.000 ! spec=Noesy, no=222, id=221, vol=3.189731e+07 assign (segid " A" and resid 20 and name HB2) (segid " A" and resid 20 and name HB1) 2.024 0.512 0.512 weight 1.000 ! spec=Noesy, no=223, id=222, vol=1.828049e+07 assign (segid " A" and resid 22 and name HD1) (segid " A" and resid 22 and name HB1) 2.577 0.830 0.830 weight 1.000 ! spec=Noesy, no=226, id=225, vol=4.030791e+06 assign (segid " A" and resid 37 and name HB2) (segid " A" and resid 38 and name HG23) 3.298 1.359 1.359 weight 1.000 ! spec=Noesy, no=228, id=227, vol=1.857015e+06 or (segid " A" and resid 37 and name HB2) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 37 and name HB2) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 38 and name HB) (segid " A" and resid 38 and name HG13) 2.327 0.677 0.677 weight 1.000 ! spec=Noesy, no=229, id=228, vol=7.543113e+06 or (segid " A" and resid 38 and name HB) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 38 and name HB) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 46 and name HB2) (segid " A" and resid 46 and name HB1) 2.304 0.664 0.664 weight 1.000 ! spec=Noesy, no=230, id=229, vol=7.660636e+06 assign (segid " A" and resid 18 and name HD1) (segid " A" and resid 18 and name HG1) 2.625 0.861 0.861 weight 1.000 ! spec=Noesy, no=231, id=230, vol=3.568400e+06 assign (segid " A" and resid 29 and name HB1) (segid " A" and resid 29 and name HB2) 2.518 0.793 0.793 weight 1.000 ! spec=Noesy, no=234, id=233, vol=4.882945e+06 assign (segid " A" and resid 23 and name HD1) (segid " A" and resid 22 and name HB2) 2.542 0.807 0.807 weight 1.000 ! spec=Noesy, no=235, id=234, vol=4.140512e+06 assign (segid " A" and resid 47 and name HB2) (segid " A" and resid 47 and name HB1) 2.094 0.548 0.548 weight 1.000 ! spec=Noesy, no=237, id=236, vol=1.357472e+07 assign (segid " A" and resid 32 and name HB2) (segid " A" and resid 32 and name HB1) 2.209 0.610 0.610 weight 1.000 ! spec=Noesy, no=238, id=237, vol=8.884816e+06 assign (segid " A" and resid 18 and name HB2) (segid " A" and resid 18 and name HG1) 2.618 0.857 0.857 weight 1.000 ! spec=Noesy, no=239, id=238, vol=3.137590e+06 assign (segid " A" and resid 23 and name HG1) (segid " A" and resid 23 and name HG2) 2.305 0.664 0.664 weight 1.000 ! spec=Noesy, no=240, id=239, vol=7.635676e+06 assign (segid " A" and resid 18 and name HB1) (segid " A" and resid 18 and name HB2) 2.114 0.559 0.559 weight 1.000 ! spec=Noesy, no=241, id=240, vol=1.286794e+07 assign (segid " A" and resid 33 and name HE1) (segid " A" and resid 31 and name HG22) 2.745 0.942 0.942 weight 1.000 ! spec=Noesy, no=243, id=242, vol=2.064022e+06 or (segid " A" and resid 33 and name HE1) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 33 and name HE1) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 32 and name HN) (segid " A" and resid 31 and name HG22) 2.541 0.807 0.807 weight 1.000 ! spec=Noesy, no=244, id=243, vol=4.055706e+06 or (segid " A" and resid 32 and name HN) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 32 and name HN) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 44 and name HN) (segid " A" and resid 31 and name HG22) 2.752 0.947 0.947 weight 1.000 ! spec=Noesy, no=245, id=244, vol=2.393189e+06 or (segid " A" and resid 44 and name HN) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 44 and name HN) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 31 and name HN) (segid " A" and resid 31 and name HG22) 2.931 1.074 1.074 weight 1.000 ! spec=Noesy, no=246, id=245, vol=1.680906e+06 or (segid " A" and resid 31 and name HN) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 31 and name HN) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 36 and name HD22) (segid " A" and resid 31 and name HG22) 2.885 1.041 1.041 weight 1.000 ! spec=Noesy, no=247, id=246, vol=1.598584e+06 or (segid " A" and resid 36 and name HD22) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 36 and name HD22) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 33 and name HZ2) (segid " A" and resid 31 and name HG22) 2.817 0.992 0.992 weight 1.000 ! spec=Noesy, no=248, id=247, vol=1.988824e+06 or (segid " A" and resid 33 and name HZ2) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 33 and name HZ2) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 33 and name HN) (segid " A" and resid 31 and name HG22) 2.660 2.660 3.340 weight 1.000 ! spec=Noesy, no=249, id=248, vol=2.752846e+06 or (segid " A" and resid 33 and name HN) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 33 and name HN) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 33 and name HD1) (segid " A" and resid 31 and name HG22) 2.723 0.927 0.927 weight 1.000 ! spec=Noesy, no=250, id=249, vol=2.038303e+06 or (segid " A" and resid 33 and name HD1) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 33 and name HD1) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 36 and name HD21) (segid " A" and resid 31 and name HG22) 2.696 0.909 0.909 weight 1.000 ! spec=Noesy, no=251, id=250, vol=2.554038e+06 or (segid " A" and resid 36 and name HD21) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 36 and name HD21) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 31 and name HA) (segid " A" and resid 31 and name HG22) 2.307 0.665 0.665 weight 1.000 ! spec=Noesy, no=252, id=251, vol=7.180799e+06 or (segid " A" and resid 31 and name HA) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 31 and name HA) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 33 and name HA) (segid " A" and resid 31 and name HG22) 2.882 1.038 1.038 weight 1.000 ! spec=Noesy, no=253, id=252, vol=2.272706e+06 or (segid " A" and resid 33 and name HA) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 33 and name HA) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 31 and name HB) (segid " A" and resid 31 and name HG22) 2.237 0.626 0.626 weight 1.000 ! spec=Noesy, no=254, id=253, vol=9.006444e+06 or (segid " A" and resid 31 and name HB) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 31 and name HB) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 43 and name HD1) (segid " A" and resid 31 and name HG22) 2.596 0.842 0.842 weight 1.000 ! spec=Noesy, no=255, id=254, vol=3.578538e+06 or (segid " A" and resid 43 and name HD1) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 43 and name HD1) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 43 and name HG1) (segid " A" and resid 31 and name HG22) 3.011 1.133 1.133 weight 1.000 ! spec=Noesy, no=256, id=255, vol=1.502744e+06 or (segid " A" and resid 43 and name HG1) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 43 and name HG1) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 43 and name HB2) (segid " A" and resid 31 and name HG22) 2.356 0.694 0.694 weight 1.000 ! spec=Noesy, no=257, id=256, vol=6.272910e+06 or (segid " A" and resid 43 and name HB2) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 43 and name HB2) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 32 and name HB2) 3.113 1.212 1.212 weight 1.000 ! spec=Noesy, no=258, id=257, vol=1.291984e+06 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 32 and name HB2) assign (segid " A" and resid 24 and name HN) (segid " A" and resid 23 and name HD2) 2.962 1.097 1.097 weight 1.000 ! spec=Noesy, no=259, id=258, vol=1.688587e+06 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 23 and name HD2) 2.634 0.867 0.867 weight 1.000 ! spec=Noesy, no=262, id=261, vol=3.163564e+06 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 23 and name HD2) assign (segid " A" and resid 10 and name HN) (segid " A" and resid 10 and name HB1) 2.700 0.911 0.911 weight 1.000 ! spec=Noesy, no=263, id=262, vol=2.809192e+06 assign (segid " A" and resid 39 and name HN) (segid " A" and resid 38 and name HB) 2.902 1.053 1.053 weight 1.000 ! spec=Noesy, no=264, id=263, vol=1.885129e+06 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 29 and name HB1) 2.932 1.074 1.074 weight 1.000 ! spec=Noesy, no=266, id=265, vol=1.833428e+06 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 18 and name HB1) 2.745 0.942 0.942 weight 1.000 ! spec=Noesy, no=267, id=266, vol=2.638486e+06 assign (segid " A" and resid 46 and name HE) (segid " A" and resid 18 and name HB1) 3.254 1.324 1.324 weight 1.000 ! spec=Noesy, no=268, id=267, vol=1.229518e+06 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 47 and name HB1) 3.022 1.142 1.142 weight 1.000 ! spec=Noesy, no=269, id=268, vol=1.428284e+06 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 23 and name HB1) 2.753 0.947 0.947 weight 1.000 ! spec=Noesy, no=270, id=269, vol=2.426222e+06 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 23 and name HB1) assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 23 and name HB1) 2.982 1.112 1.112 weight 1.000 ! spec=Noesy, no=271, id=270, vol=1.484988e+06 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 23 and name HB1) assign (segid " A" and resid 29 and name HN) (segid " A" and resid 29 and name HG2) 2.937 1.078 1.078 weight 1.000 ! spec=Noesy, no=272, id=271, vol=1.696875e+06 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 32 and name HB1) 2.746 0.943 0.943 weight 1.000 ! spec=Noesy, no=273, id=272, vol=2.748028e+06 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 32 and name HB1) assign (segid " A" and resid 19 and name HN) (segid " A" and resid 18 and name HB2) 3.036 1.152 1.152 weight 1.000 ! spec=Noesy, no=274, id=273, vol=1.421098e+06 assign (segid " A" and resid 18 and name HE) (segid " A" and resid 18 and name HB2) 2.768 0.958 0.958 weight 1.000 ! spec=Noesy, no=275, id=274, vol=2.276822e+06 assign (segid " A" and resid 7 and name HN) (segid " A" and resid 6 and name HB2) 3.044 1.158 1.158 weight 1.000 ! spec=Noesy, no=276, id=275, vol=1.300458e+06 assign (segid " A" and resid 6 and name HN) (segid " A" and resid 6 and name HB2) 2.733 0.933 0.933 weight 1.000 ! spec=Noesy, no=277, id=276, vol=2.620455e+06 assign (segid " A" and resid 3 and name HN) (segid " A" and resid 3 and name HB2) 2.921 1.067 1.067 weight 1.000 ! spec=Noesy, no=278, id=277, vol=1.787994e+06 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 18 and name HG2) 2.662 0.886 0.886 weight 1.000 ! spec=Noesy, no=279, id=278, vol=3.137108e+06 assign (segid " A" and resid 18 and name HE) (segid " A" and resid 18 and name HG2) 2.753 0.947 0.947 weight 1.000 ! spec=Noesy, no=280, id=279, vol=2.329516e+06 assign (segid " A" and resid 24 and name HN) (segid " A" and resid 23 and name HB2) 2.692 0.906 0.906 weight 1.000 ! spec=Noesy, no=281, id=280, vol=2.894874e+06 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 29 and name HG1) 3.096 1.198 1.198 weight 1.000 ! spec=Noesy, no=282, id=281, vol=1.247320e+06 assign (segid " A" and resid 4 and name HN) (segid " A" and resid 4 and name HB1) 2.907 1.056 1.056 weight 1.000 ! spec=Noesy, no=283, id=282, vol=2.044346e+06 assign (segid " A" and resid 49 and name HN) (segid " A" and resid 49 and name HB2) 2.713 0.920 0.920 weight 1.000 ! spec=Noesy, no=284, id=283, vol=2.616538e+06 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 18 and name HG1) 2.859 1.022 1.022 weight 1.000 ! spec=Noesy, no=285, id=284, vol=2.049285e+06 assign (segid " A" and resid 18 and name HE) (segid " A" and resid 18 and name HG1) 3.055 1.167 1.167 weight 1.000 ! spec=Noesy, no=286, id=285, vol=1.305568e+06 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 46 and name HB2) 3.010 1.133 1.133 weight 1.000 ! spec=Noesy, no=287, id=286, vol=1.561816e+06 assign (segid " A" and resid 4 and name HN) (segid " A" and resid 4 and name HB2) 2.740 0.939 0.939 weight 1.000 ! spec=Noesy, no=288, id=287, vol=2.552636e+06 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 46 and name HB2) 2.846 1.013 1.013 weight 1.000 ! spec=Noesy, no=289, id=288, vol=2.233733e+06 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 46 and name HB2) assign (segid " A" and resid 50 and name HN) (segid " A" and resid 50 and name HB2) 2.659 2.659 3.341 weight 1.000 ! spec=Noesy, no=290, id=289, vol=2.997818e+06 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 23 and name HG2) 2.862 1.024 1.024 weight 1.000 ! spec=Noesy, no=292, id=291, vol=1.949713e+06 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 23 and name HG2) assign (segid " A" and resid 46 and name HN) (segid " A" and resid 29 and name HB2) 3.120 1.217 1.217 weight 1.000 ! spec=Noesy, no=293, id=292, vol=1.192540e+06 assign (segid " A" and resid 26 and name HN) (segid " A" and resid 29 and name HB2) 2.939 1.080 1.080 weight 1.000 ! spec=Noesy, no=294, id=293, vol=1.678146e+06 assign (segid " A" and resid 29 and name HN) (segid " A" and resid 29 and name HB2) 2.966 1.100 1.100 weight 1.000 ! spec=Noesy, no=295, id=294, vol=1.578819e+06 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 43 and name HG1) 2.990 1.118 1.118 weight 1.000 ! spec=Noesy, no=296, id=295, vol=1.528966e+06 assign (segid " A" and resid 5 and name HN) (segid " A" and resid 5 and name HG12) 3.012 1.134 1.134 weight 1.000 ! spec=Noesy, no=297, id=296, vol=1.427588e+06 assign (segid " A" and resid 43 and name HE) (segid " A" and resid 43 and name HG1) 2.991 1.118 1.118 weight 1.000 ! spec=Noesy, no=298, id=297, vol=1.520246e+06 assign (segid " A" and resid 24 and name HN) (segid " A" and resid 22 and name HB2) 2.752 0.947 0.947 weight 1.000 ! spec=Noesy, no=299, id=298, vol=2.596014e+06 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 10 and name HB2) 2.857 1.021 1.021 weight 1.000 ! spec=Noesy, no=301, id=300, vol=1.880566e+06 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 10 and name HB2) assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 10 and name HB2) 2.825 0.998 0.998 weight 1.000 ! spec=Noesy, no=302, id=301, vol=2.186767e+06 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 10 and name HB2) assign (segid " A" and resid 46 and name HE) (segid " A" and resid 46 and name HG1) 3.012 1.134 1.134 weight 1.000 ! spec=Noesy, no=303, id=302, vol=1.423390e+06 assign (segid " A" and resid 16 and name HN) (segid " A" and resid 15 and name HB3) 2.975 1.106 1.106 weight 1.000 ! spec=Noesy, no=304, id=303, vol=1.536407e+06 or (segid " A" and resid 16 and name HN) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 16 and name HN) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 18 and name HN) (segid " A" and resid 15 and name HB3) 2.772 0.961 0.961 weight 1.000 ! spec=Noesy, no=305, id=304, vol=2.466313e+06 or (segid " A" and resid 18 and name HN) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 18 and name HN) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 18 and name HE) (segid " A" and resid 15 and name HB3) 3.011 1.133 1.133 weight 1.000 ! spec=Noesy, no=306, id=305, vol=1.400011e+06 or (segid " A" and resid 18 and name HE) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 18 and name HE) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 35 and name HD22) (segid " A" and resid 15 and name HB3) 2.702 0.912 0.912 weight 1.000 ! spec=Noesy, no=307, id=306, vol=2.543783e+06 or (segid " A" and resid 35 and name HD22) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 35 and name HD22) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 22 and name HN) (segid " A" and resid 22 and name HB1) 2.714 0.921 0.921 weight 1.000 ! spec=Noesy, no=308, id=307, vol=2.961018e+06 assign (segid " A" and resid 22 and name HE) (segid " A" and resid 22 and name HB1) 2.999 1.124 1.124 weight 1.000 ! spec=Noesy, no=309, id=308, vol=1.533061e+06 assign (segid " A" and resid 24 and name HN) (segid " A" and resid 22 and name HB1) 2.868 1.028 1.028 weight 1.000 ! spec=Noesy, no=310, id=309, vol=2.036450e+06 assign (segid " A" and resid 5 and name HN) (segid " A" and resid 5 and name HG11) 2.926 1.070 1.070 weight 1.000 ! spec=Noesy, no=311, id=310, vol=1.751252e+06 assign (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HG23) 2.994 1.120 1.120 weight 1.000 ! spec=Noesy, no=312, id=311, vol=1.534373e+06 or (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HG21) or (segid " A" and resid 24 and name HN) (segid " A" and resid 24 and name HG22) assign (segid " A" and resid 15 and name HN) (segid " A" and resid 38 and name HG23) 2.877 1.035 1.035 weight 1.000 ! spec=Noesy, no=313, id=312, vol=1.905626e+06 or (segid " A" and resid 15 and name HN) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 15 and name HN) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 39 and name HN) (segid " A" and resid 38 and name HG23) 2.749 0.945 0.945 weight 1.000 ! spec=Noesy, no=314, id=313, vol=2.573132e+06 or (segid " A" and resid 39 and name HN) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 39 and name HN) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 6 and name HN) (segid " A" and resid 5 and name HG23) 2.896 1.049 1.049 weight 1.000 ! spec=Noesy, no=315, id=314, vol=1.745809e+06 or (segid " A" and resid 6 and name HN) (segid " A" and resid 5 and name HG21) or (segid " A" and resid 6 and name HN) (segid " A" and resid 5 and name HG22) assign (segid " A" and resid 46 and name HN) (segid " A" and resid 46 and name HB1) 2.631 0.865 0.865 weight 1.000 ! spec=Noesy, no=316, id=315, vol=3.324707e+06 assign (segid " A" and resid 46 and name HE) (segid " A" and resid 46 and name HB1) 2.917 1.063 1.063 weight 1.000 ! spec=Noesy, no=317, id=316, vol=1.726278e+06 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 46 and name HB1) 3.102 1.203 1.203 weight 1.000 ! spec=Noesy, no=318, id=317, vol=1.150101e+06 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 46 and name HB1) assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 46 and name HB1) 2.758 0.951 0.951 weight 1.000 ! spec=Noesy, no=319, id=318, vol=2.691541e+06 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 46 and name HB1) assign (segid " A" and resid 29 and name HA) (segid " A" and resid 47 and name HA) 2.536 0.804 0.804 weight 1.000 ! spec=Noesy, no=320, id=319, vol=3.833106e+06 assign (segid " A" and resid 21 and name HA) (segid " A" and resid 44 and name HA) 2.691 0.905 0.905 weight 1.000 ! spec=Noesy, no=321, id=320, vol=3.126909e+06 assign (segid " A" and resid 36 and name HD21) (segid " A" and resid 33 and name HA) 2.968 1.101 1.101 weight 1.000 ! spec=Noesy, no=322, id=321, vol=1.444819e+06 assign (segid " A" and resid 35 and name HA) (segid " A" and resid 35 and name HB2) 2.816 0.991 0.991 weight 1.000 ! spec=Noesy, no=323, id=322, vol=2.146826e+06 assign (segid " A" and resid 21 and name HA) (segid " A" and resid 42 and name HB2) 2.863 1.024 1.024 weight 1.000 ! spec=Noesy, no=324, id=323, vol=2.035913e+06 assign (segid " A" and resid 21 and name HA) (segid " A" and resid 21 and name HB2) 2.755 0.949 0.949 weight 1.000 ! spec=Noesy, no=325, id=324, vol=2.592229e+06 assign (segid " A" and resid 35 and name HA) (segid " A" and resid 35 and name HB1) 3.113 1.211 1.211 weight 1.000 ! spec=Noesy, no=326, id=325, vol=1.191984e+06 assign (segid " A" and resid 29 and name HA) (segid " A" and resid 29 and name HB1) 3.018 1.138 1.138 weight 1.000 ! spec=Noesy, no=327, id=326, vol=1.394294e+06 assign (segid " A" and resid 29 and name HA) (segid " A" and resid 29 and name HG2) 2.951 1.089 1.089 weight 1.000 ! spec=Noesy, no=328, id=327, vol=1.597099e+06 assign (segid " A" and resid 29 and name HA) (segid " A" and resid 29 and name HG1) 2.706 0.916 0.916 weight 1.000 ! spec=Noesy, no=329, id=328, vol=2.669396e+06 assign (segid " A" and resid 29 and name HA) (segid " A" and resid 29 and name HB2) 2.730 0.932 0.932 weight 1.000 ! spec=Noesy, no=330, id=329, vol=2.530318e+06 assign (segid " A" and resid 45 and name HN) (segid " A" and resid 21 and name HA) 2.763 0.954 0.954 weight 1.000 ! spec=Noesy, no=332, id=331, vol=2.420639e+06 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 21 and name HA) 2.859 1.021 1.021 weight 1.000 ! spec=Noesy, no=333, id=332, vol=1.887917e+06 assign (segid " A" and resid 33 and name HE3) (segid " A" and resid 36 and name HD21) 2.665 2.665 3.335 weight 1.000 ! spec=Noesy, no=334, id=333, vol=3.241556e+06 assign (segid " A" and resid 33 and name HZ3) (segid " A" and resid 36 and name HD21) 3.092 1.195 1.195 weight 1.000 ! spec=Noesy, no=335, id=334, vol=1.192288e+06 assign (segid " A" and resid 29 and name HN) (segid " A" and resid 29 and name HA) 2.836 1.005 1.005 weight 1.000 ! spec=Noesy, no=336, id=335, vol=2.018795e+06 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 29 and name HA) 3.032 1.149 1.149 weight 1.000 ! spec=Noesy, no=337, id=336, vol=1.384810e+06 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 29 and name HA) assign (segid " A" and resid 35 and name HN) (segid " A" and resid 35 and name HA) 2.728 0.930 0.930 weight 1.000 ! spec=Noesy, no=338, id=337, vol=2.452168e+06 assign (segid " A" and resid 37 and name HN) (segid " A" and resid 35 and name HA) 2.798 0.979 0.979 weight 1.000 ! spec=Noesy, no=339, id=338, vol=2.145804e+06 assign (segid " A" and resid 32 and name HN) (segid " A" and resid 45 and name HA) 3.046 1.159 1.159 weight 1.000 ! spec=Noesy, no=340, id=339, vol=1.374330e+06 assign (segid " A" and resid 45 and name HN) (segid " A" and resid 45 and name HA) 2.751 0.946 0.946 weight 1.000 ! spec=Noesy, no=341, id=340, vol=2.552225e+06 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 30 and name HA) 2.771 0.960 0.960 weight 1.000 ! spec=Noesy, no=342, id=341, vol=2.209048e+06 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 30 and name HA) 2.670 2.670 3.330 weight 1.000 ! spec=Noesy, no=343, id=342, vol=2.897066e+06 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 30 and name HA) assign (segid " A" and resid 46 and name HN) (segid " A" and resid 46 and name HA) 2.926 1.070 1.070 weight 1.000 ! spec=Noesy, no=344, id=343, vol=1.717776e+06 assign (segid " A" and resid 28 and name HN) (segid " A" and resid 28 and name HA) 2.803 0.982 0.982 weight 1.000 ! spec=Noesy, no=346, id=345, vol=2.419004e+06 assign (segid " A" and resid 29 and name HN) (segid " A" and resid 28 and name HA) 2.715 0.921 0.921 weight 1.000 ! spec=Noesy, no=347, id=346, vol=2.646094e+06 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 32 and name HA) 2.827 0.999 0.999 weight 1.000 ! spec=Noesy, no=348, id=347, vol=2.033706e+06 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 32 and name HA) assign (segid " A" and resid 40 and name HN) (segid " A" and resid 39 and name HA) 2.979 1.109 1.109 weight 1.000 ! spec=Noesy, no=349, id=348, vol=1.504366e+06 assign (segid " A" and resid 22 and name HE) (segid " A" and resid 25 and name HA) 3.104 1.205 1.205 weight 1.000 ! spec=Noesy, no=350, id=349, vol=1.240938e+06 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 44 and name HA) 2.816 0.991 0.991 weight 1.000 ! spec=Noesy, no=351, id=350, vol=2.105900e+06 assign (segid " A" and resid 19 and name HN) (segid " A" and resid 18 and name HA) 2.928 1.072 1.072 weight 1.000 ! spec=Noesy, no=352, id=351, vol=1.719712e+06 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 18 and name HA) 2.669 0.890 0.890 weight 1.000 ! spec=Noesy, no=353, id=352, vol=3.125142e+06 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 22 and name HA) 2.675 0.894 0.894 weight 1.000 ! spec=Noesy, no=354, id=353, vol=2.896543e+06 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 22 and name HA) 2.967 1.100 1.100 weight 1.000 ! spec=Noesy, no=355, id=354, vol=1.436654e+06 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 22 and name HA) assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 22 and name HA) 2.868 1.028 1.028 weight 1.000 ! spec=Noesy, no=356, id=355, vol=1.936896e+06 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 22 and name HA) assign (segid " A" and resid 20 and name HN) (segid " A" and resid 20 and name HA) 2.841 1.009 1.009 weight 1.000 ! spec=Noesy, no=357, id=356, vol=2.170933e+06 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 20 and name HA) 2.680 0.898 0.898 weight 1.000 ! spec=Noesy, no=358, id=357, vol=2.796588e+06 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 43 and name HA) 2.761 0.953 0.953 weight 1.000 ! spec=Noesy, no=359, id=358, vol=2.330824e+06 assign (segid " A" and resid 42 and name HN) (segid " A" and resid 41 and name HA) 2.891 1.045 1.045 weight 1.000 ! spec=Noesy, no=360, id=359, vol=1.894807e+06 assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 11 and name HA) 2.706 0.915 0.915 weight 1.000 ! spec=Noesy, no=361, id=360, vol=2.737991e+06 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 11 and name HA) assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 11 and name HA) 2.885 1.040 1.040 weight 1.000 ! spec=Noesy, no=362, id=361, vol=1.627218e+06 assign (segid " A" and resid 41 and name HN) (segid " A" and resid 41 and name HA) 2.669 0.891 0.891 weight 1.000 ! spec=Noesy, no=363, id=362, vol=2.954733e+06 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 11 and name HA) 2.704 0.914 0.914 weight 1.000 ! spec=Noesy, no=364, id=363, vol=2.853342e+06 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 11 and name HA) 2.703 0.913 0.913 weight 1.000 ! spec=Noesy, no=365, id=364, vol=2.631289e+06 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 11 and name HA) assign (segid " A" and resid 35 and name HN) (segid " A" and resid 34 and name HA) 2.963 1.097 1.097 weight 1.000 ! spec=Noesy, no=366, id=365, vol=1.656328e+06 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 11 and name HB1) 2.864 1.026 1.026 weight 1.000 ! spec=Noesy, no=367, id=366, vol=1.935955e+06 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 11 and name HB1) assign (segid " A" and resid 10 and name HN) (segid " A" and resid 9 and name HA) 2.724 0.927 0.927 weight 1.000 ! spec=Noesy, no=368, id=367, vol=2.878583e+06 assign (segid " A" and resid 40 and name HN) (segid " A" and resid 38 and name HA) 2.994 1.120 1.120 weight 1.000 ! spec=Noesy, no=369, id=368, vol=1.448607e+06 assign (segid " A" and resid 39 and name HN) (segid " A" and resid 38 and name HA) 2.664 0.887 0.887 weight 1.000 ! spec=Noesy, no=370, id=369, vol=3.025036e+06 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 36 and name HA) 2.653 0.880 0.880 weight 1.000 ! spec=Noesy, no=371, id=370, vol=2.947582e+06 assign (segid " A" and resid 37 and name HN) (segid " A" and resid 36 and name HA) 2.969 1.102 1.102 weight 1.000 ! spec=Noesy, no=372, id=371, vol=1.291535e+06 assign (segid " A" and resid 3 and name HN) (segid " A" and resid 3 and name HA) 2.843 1.011 1.011 weight 1.000 ! spec=Noesy, no=373, id=372, vol=2.000434e+06 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 48 and name HA1) 2.751 0.946 0.946 weight 1.000 ! spec=Noesy, no=374, id=373, vol=2.430653e+06 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 48 and name HA1) assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 48 and name HA1) 2.944 1.083 1.083 weight 1.000 ! spec=Noesy, no=375, id=374, vol=1.569919e+06 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 48 and name HA1) assign (segid " A" and resid 21 and name HN) (segid " A" and resid 13 and name HA) 2.745 0.942 0.942 weight 1.000 ! spec=Noesy, no=376, id=375, vol=2.427964e+06 assign (segid " A" and resid 20 and name HZ3) (segid " A" and resid 13 and name HA) 2.764 0.955 0.955 weight 1.000 ! spec=Noesy, no=377, id=376, vol=2.346606e+06 assign (segid " A" and resid 20 and name HH2) (segid " A" and resid 12 and name HA) 2.894 1.047 1.047 weight 1.000 ! spec=Noesy, no=378, id=377, vol=1.816090e+06 assign (segid " A" and resid 12 and name HN) (segid " A" and resid 12 and name HA) 2.926 1.070 1.070 weight 1.000 ! spec=Noesy, no=379, id=378, vol=1.707280e+06 assign (segid " A" and resid 28 and name HN) (segid " A" and resid 27 and name HA) 2.830 1.001 1.001 weight 1.000 ! spec=Noesy, no=380, id=379, vol=2.002781e+06 assign (segid " A" and resid 34 and name HN) (segid " A" and resid 33 and name HA) 2.852 1.016 1.016 weight 1.000 ! spec=Noesy, no=381, id=380, vol=2.187838e+06 assign (segid " A" and resid 36 and name HD22) (segid " A" and resid 33 and name HA) 2.836 1.005 1.005 weight 1.000 ! spec=Noesy, no=382, id=381, vol=1.808621e+06 assign (segid " A" and resid 33 and name HD1) (segid " A" and resid 33 and name HA) 3.008 1.131 1.131 weight 1.000 ! spec=Noesy, no=383, id=382, vol=1.111220e+06 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 48 and name HA2) 2.720 0.925 0.925 weight 1.000 ! spec=Noesy, no=384, id=383, vol=2.589516e+06 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 48 and name HA2) assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 48 and name HA2) 2.918 2.918 3.082 weight 1.000 ! spec=Noesy, no=385, id=384, vol=1.630536e+06 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 48 and name HA2) assign (segid " A" and resid 20 and name HZ2) (segid " A" and resid 13 and name HB1) 2.921 2.921 3.079 weight 1.000 ! spec=Noesy, no=386, id=385, vol=1.881800e+06 assign (segid " A" and resid 20 and name HH2) (segid " A" and resid 13 and name HB1) 2.718 2.718 3.282 weight 1.000 ! spec=Noesy, no=387, id=386, vol=2.748002e+06 assign (segid " A" and resid 50 and name HN) (segid " A" and resid 50 and name HA) 2.827 0.999 0.999 weight 1.000 ! spec=Noesy, no=388, id=387, vol=1.638041e+06 assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 11 and name HB2) 2.849 1.014 1.014 weight 1.000 ! spec=Noesy, no=389, id=388, vol=1.817792e+06 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 11 and name HB2) assign (segid " A" and resid 42 and name HN) (segid " A" and resid 40 and name HA2) 2.799 0.980 0.980 weight 1.000 ! spec=Noesy, no=390, id=389, vol=2.399368e+06 assign (segid " A" and resid 8 and name HN) (segid " A" and resid 7 and name HB1) 3.004 1.128 1.128 weight 1.000 ! spec=Noesy, no=391, id=390, vol=1.474182e+06 assign (segid " A" and resid 35 and name HD22) (segid " A" and resid 15 and name HA) 3.005 1.129 1.129 weight 1.000 ! spec=Noesy, no=392, id=391, vol=1.342848e+06 assign (segid " A" and resid 7 and name HN) (segid " A" and resid 7 and name HB2) 2.721 0.926 0.926 weight 1.000 ! spec=Noesy, no=393, id=392, vol=2.690663e+06 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 23 and name HA) 2.737 0.937 0.937 weight 1.000 ! spec=Noesy, no=394, id=393, vol=2.254463e+06 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 23 and name HA) assign (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HB) 2.727 2.727 3.273 weight 1.000 ! spec=Noesy, no=395, id=394, vol=2.454661e+06 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 14 and name HB1) 2.696 0.908 0.908 weight 1.000 ! spec=Noesy, no=397, id=396, vol=2.815349e+06 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 14 and name HB1) 3.122 1.219 1.219 weight 1.000 ! spec=Noesy, no=398, id=397, vol=1.178234e+06 assign (segid " A" and resid 33 and name HE1) (segid " A" and resid 31 and name HB) 2.610 0.851 0.851 weight 1.000 ! spec=Noesy, no=399, id=398, vol=2.825522e+06 assign (segid " A" and resid 33 and name HD1) (segid " A" and resid 31 and name HB) 3.054 1.166 1.166 weight 1.000 ! spec=Noesy, no=400, id=399, vol=1.026814e+06 assign (segid " A" and resid 26 and name HD2) (segid " A" and resid 26 and name HB2) 2.693 0.906 0.906 weight 1.000 ! spec=Noesy, no=401, id=400, vol=3.010964e+06 or (segid " A" and resid 26 and name HD1) (segid " A" and resid 26 and name HB2) assign (segid " A" and resid 34 and name HN) (segid " A" and resid 33 and name HB1) 3.057 1.168 1.168 weight 1.000 ! spec=Noesy, no=404, id=403, vol=1.302510e+06 assign (segid " A" and resid 18 and name HE) (segid " A" and resid 18 and name HD2) 2.951 1.089 1.089 weight 1.000 ! spec=Noesy, no=405, id=404, vol=1.599051e+06 assign (segid " A" and resid 10 and name HN) (segid " A" and resid 9 and name HB2) 3.024 1.143 1.143 weight 1.000 ! spec=Noesy, no=406, id=405, vol=1.415451e+06 assign (segid " A" and resid 9 and name HD2) (segid " A" and resid 9 and name HB2) 3.058 1.169 1.169 weight 1.000 ! spec=Noesy, no=407, id=406, vol=1.075838e+06 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 42 and name HB1) 2.882 2.882 3.118 weight 1.000 ! spec=Noesy, no=409, id=408, vol=1.611442e+06 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 42 and name HB1) assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HB2) 3.056 1.168 1.168 weight 1.000 ! spec=Noesy, no=410, id=409, vol=1.351556e+06 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 35 and name HB2) 2.928 1.071 1.071 weight 1.000 ! spec=Noesy, no=411, id=410, vol=1.721110e+06 assign (segid " A" and resid 17 and name HD22) (segid " A" and resid 17 and name HB2) 3.096 1.198 1.198 weight 1.000 ! spec=Noesy, no=412, id=411, vol=1.115358e+06 assign (segid " A" and resid 26 and name HD2) (segid " A" and resid 25 and name HB1) 2.748 2.748 3.252 weight 1.000 ! spec=Noesy, no=413, id=412, vol=2.365557e+06 or (segid " A" and resid 26 and name HD1) (segid " A" and resid 25 and name HB1) assign (segid " A" and resid 25 and name HN) (segid " A" and resid 25 and name HB1) 2.666 0.888 0.888 weight 1.000 ! spec=Noesy, no=414, id=413, vol=2.835821e+06 assign (segid " A" and resid 10 and name HN) (segid " A" and resid 9 and name HB1) 2.850 1.015 1.015 weight 1.000 ! spec=Noesy, no=415, id=414, vol=2.023426e+06 assign (segid " A" and resid 9 and name HD2) (segid " A" and resid 9 and name HB1) 3.092 1.195 1.195 weight 1.000 ! spec=Noesy, no=417, id=416, vol=1.001013e+06 assign (segid " A" and resid 50 and name HE) (segid " A" and resid 46 and name HD2) 2.698 0.910 0.910 weight 1.000 ! spec=Noesy, no=419, id=418, vol=2.463500e+06 assign (segid " A" and resid 46 and name HE) (segid " A" and resid 46 and name HD2) 2.660 0.884 0.884 weight 1.000 ! spec=Noesy, no=420, id=419, vol=2.958536e+06 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 46 and name HD2) 3.032 1.149 1.149 weight 1.000 ! spec=Noesy, no=421, id=420, vol=1.427487e+06 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 46 and name HD2) assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 30 and name HB2) 2.894 2.894 3.106 weight 1.000 ! spec=Noesy, no=422, id=421, vol=1.565912e+06 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 30 and name HB2) assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 21 and name HB1) 2.878 1.035 1.035 weight 1.000 ! spec=Noesy, no=423, id=422, vol=2.005440e+06 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 21 and name HB1) assign (segid " A" and resid 16 and name HN) (segid " A" and resid 16 and name HB2) 2.933 2.933 3.067 weight 1.000 ! spec=Noesy, no=424, id=423, vol=1.673691e+06 assign (segid " A" and resid 16 and name HD22) (segid " A" and resid 16 and name HB2) 3.063 1.173 1.173 weight 1.000 ! spec=Noesy, no=425, id=424, vol=1.130853e+06 assign (segid " A" and resid 12 and name HD2) (segid " A" and resid 12 and name HB2) 2.676 2.676 3.324 weight 1.000 ! spec=Noesy, no=426, id=425, vol=2.412240e+06 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HB1) 2.874 1.032 1.032 weight 1.000 ! spec=Noesy, no=427, id=426, vol=1.980338e+06 assign (segid " A" and resid 17 and name HD22) (segid " A" and resid 17 and name HB1) 2.651 0.879 0.879 weight 1.000 ! spec=Noesy, no=428, id=427, vol=2.915599e+06 assign (segid " A" and resid 17 and name HD21) (segid " A" and resid 17 and name HB1) 2.969 1.102 1.102 weight 1.000 ! spec=Noesy, no=429, id=428, vol=1.391181e+06 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 42 and name HB2) 2.741 0.939 0.939 weight 1.000 ! spec=Noesy, no=430, id=429, vol=2.758107e+06 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 20 and name HB2) 2.700 0.911 0.911 weight 1.000 ! spec=Noesy, no=431, id=430, vol=2.832726e+06 assign (segid " A" and resid 37 and name HN) (segid " A" and resid 36 and name HB2) 2.824 0.997 0.997 weight 1.000 ! spec=Noesy, no=432, id=431, vol=2.179129e+06 assign (segid " A" and resid 42 and name HN) (segid " A" and resid 42 and name HB2) 2.692 0.906 0.906 weight 1.000 ! spec=Noesy, no=433, id=432, vol=2.966864e+06 assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 20 and name HB2) 2.656 2.656 3.344 weight 1.000 ! spec=Noesy, no=434, id=433, vol=2.541502e+06 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 42 and name HB2) 2.852 2.852 3.148 weight 1.000 ! spec=Noesy, no=435, id=434, vol=1.683818e+06 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 42 and name HB2) assign (segid " A" and resid 25 and name HN) (segid " A" and resid 43 and name HD2) 2.787 0.971 0.971 weight 1.000 ! spec=Noesy, no=436, id=435, vol=2.169621e+06 assign (segid " A" and resid 34 and name HN) (segid " A" and resid 33 and name HB2) 2.688 0.903 0.903 weight 1.000 ! spec=Noesy, no=437, id=436, vol=2.703580e+06 assign (segid " A" and resid 33 and name HE3) (segid " A" and resid 36 and name HB1) 2.659 0.884 0.884 weight 1.000 ! spec=Noesy, no=438, id=437, vol=2.896854e+06 assign (segid " A" and resid 46 and name HE) (segid " A" and resid 46 and name HD1) 2.728 0.931 0.931 weight 1.000 ! spec=Noesy, no=439, id=438, vol=2.526560e+06 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 30 and name HB1) 2.658 2.658 3.342 weight 1.000 ! spec=Noesy, no=440, id=439, vol=2.802962e+06 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 30 and name HB1) assign (segid " A" and resid 30 and name HN) (segid " A" and resid 30 and name HB1) 2.967 1.101 1.101 weight 1.000 ! spec=Noesy, no=441, id=440, vol=1.676846e+06 assign (segid " A" and resid 31 and name HN) (segid " A" and resid 30 and name HB1) 2.698 2.698 3.302 weight 1.000 ! spec=Noesy, no=442, id=441, vol=2.819165e+06 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 21 and name HB2) 2.973 2.973 3.027 weight 1.000 ! spec=Noesy, no=444, id=443, vol=1.343634e+06 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 21 and name HB2) assign (segid " A" and resid 12 and name HN) (segid " A" and resid 21 and name HB2) 3.114 1.212 1.212 weight 1.000 ! spec=Noesy, no=445, id=444, vol=1.218434e+06 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 21 and name HB2) 2.799 0.980 0.980 weight 1.000 ! spec=Noesy, no=446, id=445, vol=2.262099e+06 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 20 and name HB1) 2.733 0.933 0.933 weight 1.000 ! spec=Noesy, no=447, id=446, vol=2.797594e+06 assign (segid " A" and resid 38 and name HN) (segid " A" and resid 37 and name HB2) 2.960 1.095 1.095 weight 1.000 ! spec=Noesy, no=448, id=447, vol=1.660665e+06 assign (segid " A" and resid 16 and name HN) (segid " A" and resid 14 and name HB2) 3.096 3.096 2.904 weight 1.000 ! spec=Noesy, no=449, id=448, vol=1.251104e+06 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 45 and name HB1) 3.112 1.210 1.210 weight 1.000 ! spec=Noesy, no=450, id=449, vol=1.271272e+06 assign (segid " A" and resid 16 and name HN) (segid " A" and resid 16 and name HB1) 2.767 0.957 0.957 weight 1.000 ! spec=Noesy, no=451, id=450, vol=2.362073e+06 assign (segid " A" and resid 24 and name HN) (segid " A" and resid 23 and name HD1) 2.692 0.906 0.906 weight 1.000 ! spec=Noesy, no=452, id=451, vol=2.912864e+06 assign (segid " A" and resid 10 and name HA) (segid " A" and resid 10 and name HB1) 2.830 1.001 1.001 weight 1.000 ! spec=Noesy, no=453, id=452, vol=2.157826e+06 assign (segid " A" and resid 47 and name HD2) (segid " A" and resid 47 and name HG2) 2.780 0.966 0.966 weight 1.000 ! spec=Noesy, no=454, id=453, vol=2.413013e+06 assign (segid " A" and resid 47 and name HD1) (segid " A" and resid 47 and name HG2) 2.668 0.890 0.890 weight 1.000 ! spec=Noesy, no=455, id=454, vol=3.172614e+06 assign (segid " A" and resid 47 and name HD2) (segid " A" and resid 47 and name HG1) 2.685 0.901 0.901 weight 1.000 ! spec=Noesy, no=456, id=455, vol=3.060367e+06 assign (segid " A" and resid 47 and name HD1) (segid " A" and resid 47 and name HG1) 2.889 1.043 1.043 weight 1.000 ! spec=Noesy, no=457, id=456, vol=1.899160e+06 assign (segid " A" and resid 18 and name HD2) (segid " A" and resid 18 and name HB1) 3.082 1.187 1.187 weight 1.000 ! spec=Noesy, no=458, id=457, vol=1.290555e+06 assign (segid " A" and resid 18 and name HD1) (segid " A" and resid 18 and name HB1) 3.093 1.196 1.196 weight 1.000 ! spec=Noesy, no=459, id=458, vol=1.315939e+06 assign (segid " A" and resid 46 and name HD2) (segid " A" and resid 32 and name HB1) 3.095 1.197 1.197 weight 1.000 ! spec=Noesy, no=460, id=459, vol=1.313850e+06 assign (segid " A" and resid 23 and name HD1) (segid " A" and resid 23 and name HG1) 2.694 0.907 0.907 weight 1.000 ! spec=Noesy, no=461, id=460, vol=2.964245e+06 assign (segid " A" and resid 23 and name HA) (segid " A" and resid 23 and name HB2) 2.931 1.074 1.074 weight 1.000 ! spec=Noesy, no=462, id=461, vol=2.474735e+06 assign (segid " A" and resid 18 and name HD2) (segid " A" and resid 18 and name HG2) 2.780 0.966 0.966 weight 1.000 ! spec=Noesy, no=463, id=462, vol=2.457212e+06 assign (segid " A" and resid 18 and name HD1) (segid " A" and resid 18 and name HG2) 2.800 0.980 0.980 weight 1.000 ! spec=Noesy, no=464, id=463, vol=2.358803e+06 assign (segid " A" and resid 5 and name HA) (segid " A" and resid 5 and name HB) 2.784 0.969 0.969 weight 1.000 ! spec=Noesy, no=465, id=464, vol=2.345954e+06 assign (segid " A" and resid 18 and name HD2) (segid " A" and resid 18 and name HG1) 2.713 0.920 0.920 weight 1.000 ! spec=Noesy, no=467, id=466, vol=2.845614e+06 assign (segid " A" and resid 47 and name HD2) (segid " A" and resid 46 and name HB2) 3.085 1.190 1.190 weight 1.000 ! spec=Noesy, no=469, id=468, vol=1.341680e+06 assign (segid " A" and resid 47 and name HD1) (segid " A" and resid 46 and name HB2) 2.891 1.045 1.045 weight 1.000 ! spec=Noesy, no=470, id=469, vol=1.994775e+06 assign (segid " A" and resid 50 and name HA) (segid " A" and resid 50 and name HB2) 2.734 0.935 0.935 weight 1.000 ! spec=Noesy, no=471, id=470, vol=2.359614e+06 assign (segid " A" and resid 23 and name HD1) (segid " A" and resid 23 and name HG2) 2.825 0.997 0.997 weight 1.000 ! spec=Noesy, no=473, id=472, vol=2.215806e+06 assign (segid " A" and resid 10 and name HA) (segid " A" and resid 10 and name HB2) 3.093 1.196 1.196 weight 1.000 ! spec=Noesy, no=474, id=473, vol=1.277017e+06 assign (segid " A" and resid 19 and name HA2) (segid " A" and resid 46 and name HG1) 2.979 1.109 1.109 weight 1.000 ! spec=Noesy, no=475, id=474, vol=1.691879e+06 assign (segid " A" and resid 46 and name HD2) (segid " A" and resid 46 and name HG1) 2.829 1.001 1.001 weight 1.000 ! spec=Noesy, no=476, id=475, vol=2.241418e+06 assign (segid " A" and resid 18 and name HD1) (segid " A" and resid 15 and name HB3) 2.788 0.971 0.971 weight 1.000 ! spec=Noesy, no=477, id=476, vol=2.047577e+06 or (segid " A" and resid 18 and name HD1) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 18 and name HD1) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 23 and name HD1) (segid " A" and resid 22 and name HB1) 2.934 1.076 1.076 weight 1.000 ! spec=Noesy, no=478, id=477, vol=1.807896e+06 assign (segid " A" and resid 5 and name HA) (segid " A" and resid 5 and name HG11) 3.082 1.187 1.187 weight 1.000 ! spec=Noesy, no=479, id=478, vol=1.249894e+06 assign (segid " A" and resid 46 and name HG1) (segid " A" and resid 46 and name HB1) 2.923 1.068 1.068 weight 1.000 ! spec=Noesy, no=480, id=479, vol=1.877764e+06 assign (segid " A" and resid 5 and name HB) (segid " A" and resid 5 and name HG23) 2.778 0.965 0.965 weight 1.000 ! spec=Noesy, no=481, id=480, vol=2.483076e+06 or (segid " A" and resid 5 and name HB) (segid " A" and resid 5 and name HG21) or (segid " A" and resid 5 and name HB) (segid " A" and resid 5 and name HG22) assign (segid " A" and resid 5 and name HG11) (segid " A" and resid 5 and name HD13) 2.688 0.903 0.903 weight 1.000 ! spec=Noesy, no=482, id=481, vol=2.976620e+06 or (segid " A" and resid 5 and name HG11) (segid " A" and resid 5 and name HD11) or (segid " A" and resid 5 and name HG11) (segid " A" and resid 5 and name HD12) assign (segid " A" and resid 46 and name HD1) (segid " A" and resid 46 and name HB1) 3.084 1.189 1.189 weight 1.000 ! spec=Noesy, no=483, id=482, vol=1.304418e+06 assign (segid " A" and resid 23 and name HD2) (segid " A" and resid 23 and name HG2) 2.767 0.957 0.957 weight 1.000 ! spec=Noesy, no=485, id=484, vol=2.490927e+06 assign (segid " A" and resid 45 and name HB2) (segid " A" and resid 29 and name HB2) 3.040 1.155 1.155 weight 1.000 ! spec=Noesy, no=486, id=485, vol=1.341222e+06 assign (segid " A" and resid 25 and name HB2) (segid " A" and resid 29 and name HB2) 3.118 3.118 2.882 weight 1.000 ! spec=Noesy, no=487, id=486, vol=1.174095e+06 assign (segid " A" and resid 44 and name HB1) (segid " A" and resid 46 and name HG1) 3.404 1.449 1.449 weight 1.000 ! spec=Noesy, no=489, id=488, vol=8.032758e+05 assign (segid " A" and resid 46 and name HD1) (segid " A" and resid 15 and name HB3) 2.688 0.903 0.903 weight 1.000 ! spec=Noesy, no=490, id=489, vol=2.945322e+06 or (segid " A" and resid 46 and name HD1) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 46 and name HD1) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 45 and name HB2) (segid " A" and resid 22 and name HB1) 3.053 1.165 1.165 weight 1.000 ! spec=Noesy, no=491, id=490, vol=1.573646e+06 assign (segid " A" and resid 45 and name HB1) (segid " A" and resid 22 and name HB1) 2.990 1.117 1.117 weight 1.000 ! spec=Noesy, no=492, id=491, vol=1.521329e+06 assign (segid " A" and resid 22 and name HB2) (segid " A" and resid 22 and name HB1) 2.315 0.670 0.670 weight 1.000 ! spec=Noesy, no=493, id=492, vol=8.231151e+06 assign (segid " A" and resid 46 and name HD1) (segid " A" and resid 32 and name HB1) 2.882 1.038 1.038 weight 1.000 ! spec=Noesy, no=494, id=493, vol=1.951017e+06 assign (segid " A" and resid 47 and name HB2) (segid " A" and resid 47 and name HG2) 2.578 0.831 0.831 weight 1.000 ! spec=Noesy, no=495, id=494, vol=3.790374e+06 assign (segid " A" and resid 47 and name HB2) (segid " A" and resid 47 and name HG1) 2.933 1.075 1.075 weight 1.000 ! spec=Noesy, no=496, id=495, vol=1.758012e+06 assign (segid " A" and resid 23 and name HB1) (segid " A" and resid 23 and name HG1) 2.412 0.727 0.727 weight 1.000 ! spec=Noesy, no=497, id=496, vol=5.368618e+06 assign (segid " A" and resid 23 and name HB1) (segid " A" and resid 23 and name HB2) 2.064 0.532 0.532 weight 1.000 ! spec=Noesy, no=498, id=497, vol=1.462589e+07 assign (segid " A" and resid 29 and name HB1) (segid " A" and resid 29 and name HG1) 3.040 1.155 1.155 weight 1.000 ! spec=Noesy, no=499, id=498, vol=1.391436e+06 assign (segid " A" and resid 18 and name HB1) (segid " A" and resid 18 and name HG1) 2.631 0.866 0.866 weight 1.000 ! spec=Noesy, no=500, id=499, vol=3.236046e+06 assign (segid " A" and resid 23 and name HB1) (segid " A" and resid 23 and name HG2) 2.553 0.815 0.815 weight 1.000 ! spec=Noesy, no=501, id=500, vol=3.852048e+06 assign (segid " A" and resid 47 and name HG2) (segid " A" and resid 47 and name HB1) 2.538 0.805 0.805 weight 1.000 ! spec=Noesy, no=502, id=501, vol=3.826025e+06 assign (segid " A" and resid 29 and name HB1) (segid " A" and resid 29 and name HG2) 3.109 1.209 1.209 weight 1.000 ! spec=Noesy, no=503, id=502, vol=1.225720e+06 assign (segid " A" and resid 23 and name HD2) (segid " A" and resid 23 and name HG1) 2.843 1.010 1.010 weight 1.000 ! spec=Noesy, no=505, id=504, vol=2.198790e+06 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 46 and name HN) 2.694 0.907 0.907 weight 1.000 ! spec=Noesy, no=506, id=505, vol=2.933846e+06 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 45 and name HN) 2.805 0.983 0.983 weight 1.000 ! spec=Noesy, no=507, id=506, vol=2.207693e+06 assign (segid " A" and resid 28 and name HN) (segid " A" and resid 29 and name HN) 3.055 1.167 1.167 weight 1.000 ! spec=Noesy, no=508, id=507, vol=1.382457e+06 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 20 and name HH2) 3.124 1.220 1.220 weight 1.000 ! spec=Noesy, no=510, id=509, vol=1.027419e+06 assign (segid " A" and resid 36 and name HD22) (segid " A" and resid 33 and name HZ3) 2.980 1.110 1.110 weight 1.000 ! spec=Noesy, no=511, id=510, vol=1.338345e+06 assign (segid " A" and resid 22 and name HE) (segid " A" and resid 26 and name HD2) 3.119 1.216 1.216 weight 1.000 ! spec=Noesy, no=512, id=511, vol=1.164519e+06 or (segid " A" and resid 22 and name HE) (segid " A" and resid 26 and name HD1) assign (segid " A" and resid 26 and name HN) (segid " A" and resid 26 and name HD2) 2.769 0.958 0.958 weight 1.000 ! spec=Noesy, no=513, id=512, vol=2.440250e+06 or (segid " A" and resid 26 and name HN) (segid " A" and resid 26 and name HD1) assign (segid " A" and resid 31 and name HN) (segid " A" and resid 30 and name HD2) 2.851 1.016 1.016 weight 1.000 ! spec=Noesy, no=514, id=513, vol=1.985228e+06 or (segid " A" and resid 31 and name HN) (segid " A" and resid 30 and name HD1) assign (segid " A" and resid 21 and name HN) (segid " A" and resid 12 and name HN) 2.906 1.055 1.055 weight 1.000 ! spec=Noesy, no=515, id=514, vol=1.750139e+06 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 42 and name HD1) 2.912 1.060 1.060 weight 1.000 ! spec=Noesy, no=516, id=515, vol=1.772090e+06 or (segid " A" and resid 43 and name HN) (segid " A" and resid 42 and name HD2) assign (segid " A" and resid 42 and name HN) (segid " A" and resid 42 and name HD1) 2.856 1.020 1.020 weight 1.000 ! spec=Noesy, no=517, id=516, vol=2.030215e+06 or (segid " A" and resid 42 and name HN) (segid " A" and resid 42 and name HD2) assign (segid " A" and resid 19 and name HN) (segid " A" and resid 14 and name HN) 2.788 0.972 0.972 weight 1.000 ! spec=Noesy, no=518, id=517, vol=2.301787e+06 assign (segid " A" and resid 43 and name HE) (segid " A" and resid 42 and name HE2) 3.115 3.115 2.885 weight 1.000 ! spec=Noesy, no=519, id=518, vol=1.201228e+06 or (segid " A" and resid 43 and name HE) (segid " A" and resid 42 and name HE1) assign (segid " A" and resid 44 and name HN) (segid " A" and resid 36 and name HD21) 3.385 1.432 1.432 weight 1.000 ! spec=Noesy, no=520, id=519, vol=6.929602e+05 assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 35 and name HA) 3.387 1.434 1.434 weight 1.000 ! spec=Noesy, no=521, id=520, vol=6.649140e+05 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 46 and name HA) 3.331 1.387 1.387 weight 1.000 ! spec=Noesy, no=522, id=521, vol=7.983208e+05 assign (segid " A" and resid 46 and name HE) (segid " A" and resid 46 and name HA) 3.347 1.401 1.401 weight 1.000 ! spec=Noesy, no=523, id=522, vol=7.195142e+05 assign (segid " A" and resid 16 and name HN) (segid " A" and resid 14 and name HA) 3.182 1.266 1.266 weight 1.000 ! spec=Noesy, no=524, id=523, vol=1.015676e+06 assign (segid " A" and resid 28 and name HD2) (segid " A" and resid 28 and name HA) 3.375 1.424 1.424 weight 1.000 ! spec=Noesy, no=525, id=524, vol=5.947090e+05 assign (segid " A" and resid 33 and name HD1) (segid " A" and resid 32 and name HA) 3.147 1.238 1.238 weight 1.000 ! spec=Noesy, no=526, id=525, vol=9.176855e+05 assign (segid " A" and resid 10 and name HN) (segid " A" and resid 8 and name HA) 3.244 1.315 1.315 weight 1.000 ! spec=Noesy, no=527, id=526, vol=9.125185e+05 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 47 and name HA) 3.197 1.277 1.277 weight 1.000 ! spec=Noesy, no=528, id=527, vol=1.037169e+06 assign (segid " A" and resid 2 and name HD1) (segid " A" and resid 2 and name HA) 3.199 1.279 1.279 weight 1.000 ! spec=Noesy, no=529, id=528, vol=1.040834e+06 or (segid " A" and resid 2 and name HD2) (segid " A" and resid 2 and name HA) assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 22 and name HA) 3.137 1.230 1.230 weight 1.000 ! spec=Noesy, no=530, id=529, vol=9.998440e+05 assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 11 and name HA) 3.352 1.405 1.405 weight 1.000 ! spec=Noesy, no=531, id=530, vol=6.243768e+05 assign (segid " A" and resid 36 and name HN) (segid " A" and resid 34 and name HA) 3.215 1.292 1.292 weight 1.000 ! spec=Noesy, no=532, id=531, vol=8.964315e+05 assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 11 and name HB1) 3.142 1.234 1.234 weight 1.000 ! spec=Noesy, no=533, id=532, vol=9.889732e+05 assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 11 and name HB1) 3.288 1.351 1.351 weight 1.000 ! spec=Noesy, no=534, id=533, vol=7.537722e+05 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 11 and name HB1) assign (segid " A" and resid 12 and name HE1) (segid " A" and resid 38 and name HA) 3.282 1.346 1.346 weight 1.000 ! spec=Noesy, no=535, id=534, vol=5.343412e+05 assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 12 and name HA) 3.334 1.390 1.390 weight 1.000 ! spec=Noesy, no=536, id=535, vol=6.759765e+05 assign (segid " A" and resid 17 and name HD21) (segid " A" and resid 17 and name HA) 3.365 1.415 1.415 weight 1.000 ! spec=Noesy, no=538, id=537, vol=6.887262e+05 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 31 and name HA) 3.211 1.289 1.289 weight 1.000 ! spec=Noesy, no=539, id=538, vol=1.027606e+06 assign (segid " A" and resid 29 and name HN) (segid " A" and resid 27 and name HA) 3.134 1.228 1.228 weight 1.000 ! spec=Noesy, no=540, id=539, vol=1.098484e+06 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 13 and name HB2) 3.214 1.291 1.291 weight 1.000 ! spec=Noesy, no=541, id=540, vol=9.780510e+05 assign (segid " A" and resid 20 and name HZ3) (segid " A" and resid 13 and name HB1) 3.333 1.389 1.389 weight 1.000 ! spec=Noesy, no=542, id=541, vol=8.455660e+05 assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 11 and name HB2) 3.265 1.333 1.333 weight 1.000 ! spec=Noesy, no=543, id=542, vol=7.815282e+05 assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 15 and name HA) 3.172 1.258 1.258 weight 1.000 ! spec=Noesy, no=544, id=543, vol=9.955920e+05 assign (segid " A" and resid 46 and name HE) (segid " A" and resid 47 and name HD1) 3.219 1.296 1.296 weight 1.000 ! spec=Noesy, no=545, id=544, vol=9.175812e+05 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 23 and name HA) 3.138 1.231 1.231 weight 1.000 ! spec=Noesy, no=548, id=547, vol=1.183219e+06 assign (segid " A" and resid 19 and name HN) (segid " A" and resid 14 and name HB1) 3.277 3.277 2.723 weight 1.000 ! spec=Noesy, no=549, id=548, vol=6.993032e+05 assign (segid " A" and resid 33 and name HZ2) (segid " A" and resid 31 and name HB) 3.274 1.340 1.340 weight 1.000 ! spec=Noesy, no=550, id=549, vol=8.062058e+05 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 23 and name HD1) 3.191 1.273 1.273 weight 1.000 ! spec=Noesy, no=551, id=550, vol=9.973940e+05 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 23 and name HD1) assign (segid " A" and resid 22 and name HN) (segid " A" and resid 42 and name HB1) 3.199 1.280 1.280 weight 1.000 ! spec=Noesy, no=552, id=551, vol=1.093017e+06 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 18 and name HD1) 3.241 1.313 1.313 weight 1.000 ! spec=Noesy, no=553, id=552, vol=9.848020e+05 assign (segid " A" and resid 29 and name HN) (segid " A" and resid 25 and name HB1) 3.311 1.370 1.370 weight 1.000 ! spec=Noesy, no=554, id=553, vol=8.326888e+05 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 30 and name HB2) 3.182 1.266 1.266 weight 1.000 ! spec=Noesy, no=555, id=554, vol=1.101981e+06 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 21 and name HB1) 3.243 1.315 1.315 weight 1.000 ! spec=Noesy, no=556, id=555, vol=8.046132e+05 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 21 and name HB1) assign (segid " A" and resid 18 and name HE) (segid " A" and resid 16 and name HB2) 3.363 1.414 1.414 weight 1.000 ! spec=Noesy, no=557, id=556, vol=6.854932e+05 assign (segid " A" and resid 16 and name HD21) (segid " A" and resid 16 and name HB2) 3.379 1.427 1.427 weight 1.000 ! spec=Noesy, no=558, id=557, vol=6.357782e+05 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 20 and name HB2) 3.287 1.350 1.350 weight 1.000 ! spec=Noesy, no=560, id=559, vol=8.240632e+05 assign (segid " A" and resid 33 and name HZ3) (segid " A" and resid 36 and name HB1) 3.389 1.436 1.436 weight 1.000 ! spec=Noesy, no=561, id=560, vol=7.180105e+05 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 14 and name HB2) 3.231 1.305 1.305 weight 1.000 ! spec=Noesy, no=562, id=561, vol=9.435602e+05 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 16 and name HB1) 3.384 1.431 1.431 weight 1.000 ! spec=Noesy, no=563, id=562, vol=7.176922e+05 assign (segid " A" and resid 16 and name HD22) (segid " A" and resid 16 and name HB1) 3.356 1.407 1.407 weight 1.000 ! spec=Noesy, no=564, id=563, vol=6.594678e+05 assign (segid " A" and resid 18 and name HE) (segid " A" and resid 16 and name HB1) 3.168 1.254 1.254 weight 1.000 ! spec=Noesy, no=565, id=564, vol=1.001976e+06 assign (segid " A" and resid 40 and name HN) (segid " A" and resid 39 and name HB2) 3.336 1.391 1.391 weight 1.000 ! spec=Noesy, no=566, id=565, vol=7.650498e+05 assign (segid " A" and resid 28 and name HD2) (segid " A" and resid 26 and name HB1) 3.276 1.342 1.342 weight 1.000 ! spec=Noesy, no=567, id=566, vol=8.768265e+05 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 10 and name HB1) 3.382 1.429 1.429 weight 1.000 ! spec=Noesy, no=568, id=567, vol=6.920145e+05 assign (segid " A" and resid 12 and name HD2) (segid " A" and resid 10 and name HB1) 3.281 1.346 1.346 weight 1.000 ! spec=Noesy, no=569, id=568, vol=7.277642e+05 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 35 and name HB1) 3.342 1.396 1.396 weight 1.000 ! spec=Noesy, no=572, id=571, vol=8.029495e+05 assign (segid " A" and resid 36 and name HN) (segid " A" and resid 35 and name HB1) 3.359 1.411 1.411 weight 1.000 ! spec=Noesy, no=573, id=572, vol=6.664025e+05 assign (segid " A" and resid 19 and name HN) (segid " A" and resid 18 and name HB1) 3.315 1.373 1.373 weight 1.000 ! spec=Noesy, no=574, id=573, vol=8.389982e+05 assign (segid " A" and resid 24 and name HN) (segid " A" and resid 23 and name HB1) 3.220 1.296 1.296 weight 1.000 ! spec=Noesy, no=575, id=574, vol=9.943728e+05 assign (segid " A" and resid 26 and name HN) (segid " A" and resid 29 and name HG2) 3.163 1.251 1.251 weight 1.000 ! spec=Noesy, no=576, id=575, vol=1.114180e+06 assign (segid " A" and resid 33 and name HN) (segid " A" and resid 32 and name HB1) 3.304 1.364 1.364 weight 1.000 ! spec=Noesy, no=577, id=576, vol=7.750725e+05 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 32 and name HB1) 3.213 1.290 1.290 weight 1.000 ! spec=Noesy, no=578, id=577, vol=8.969788e+05 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 32 and name HB1) assign (segid " A" and resid 3 and name HN) (segid " A" and resid 3 and name HB1) 3.257 1.326 1.326 weight 1.000 ! spec=Noesy, no=579, id=578, vol=8.919440e+05 assign (segid " A" and resid 46 and name HE) (segid " A" and resid 18 and name HB2) 3.226 1.301 1.301 weight 1.000 ! spec=Noesy, no=580, id=579, vol=9.970972e+05 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 23 and name HB2) 3.235 1.308 1.308 weight 1.000 ! spec=Noesy, no=581, id=580, vol=9.015630e+05 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 23 and name HB2) assign (segid " A" and resid 30 and name HN) (segid " A" and resid 29 and name HG1) 3.312 1.371 1.371 weight 1.000 ! spec=Noesy, no=582, id=581, vol=8.839172e+05 assign (segid " A" and resid 29 and name HN) (segid " A" and resid 29 and name HG1) 3.276 1.342 1.342 weight 1.000 ! spec=Noesy, no=583, id=582, vol=1.049576e+06 assign (segid " A" and resid 7 and name HN) (segid " A" and resid 6 and name HB1) 3.195 1.276 1.276 weight 1.000 ! spec=Noesy, no=584, id=583, vol=9.821412e+05 assign (segid " A" and resid 19 and name HN) (segid " A" and resid 46 and name HB2) 3.387 3.387 2.613 weight 1.000 ! spec=Noesy, no=585, id=584, vol=7.510652e+05 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 46 and name HB2) 3.326 1.383 1.383 weight 1.000 ! spec=Noesy, no=586, id=585, vol=7.715808e+05 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 46 and name HB2) assign (segid " A" and resid 17 and name HD22) (segid " A" and resid 50 and name HB2) 3.312 1.371 1.371 weight 1.000 ! spec=Noesy, no=589, id=588, vol=6.858888e+05 assign (segid " A" and resid 6 and name HN) (segid " A" and resid 6 and name HG1) 3.150 1.241 1.241 weight 1.000 ! spec=Noesy, no=590, id=589, vol=1.161110e+06 assign (segid " A" and resid 6 and name HN) (segid " A" and resid 6 and name HG2) 3.213 1.291 1.291 weight 1.000 ! spec=Noesy, no=591, id=590, vol=1.032100e+06 assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 23 and name HG2) 3.264 1.332 1.332 weight 1.000 ! spec=Noesy, no=592, id=591, vol=8.218238e+05 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 23 and name HG2) assign (segid " A" and resid 24 and name HN) (segid " A" and resid 23 and name HG2) 3.203 1.282 1.282 weight 1.000 ! spec=Noesy, no=593, id=592, vol=1.024812e+06 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 29 and name HB2) 3.290 1.353 1.353 weight 1.000 ! spec=Noesy, no=594, id=593, vol=9.060258e+05 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 29 and name HB2) assign (segid " A" and resid 17 and name HD22) (segid " A" and resid 50 and name HB1) 3.381 1.429 1.429 weight 1.000 ! spec=Noesy, no=595, id=594, vol=6.327465e+05 assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 22 and name HB2) 3.279 1.344 1.344 weight 1.000 ! spec=Noesy, no=596, id=595, vol=7.264360e+05 assign (segid " A" and resid 32 and name HN) (segid " A" and resid 46 and name HG1) 3.270 1.336 1.336 weight 1.000 ! spec=Noesy, no=597, id=596, vol=9.135338e+05 assign (segid " A" and resid 42 and name HN) (segid " A" and resid 10 and name HB2) 3.356 1.408 1.408 weight 1.000 ! spec=Noesy, no=599, id=598, vol=7.998430e+05 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 10 and name HB2) 3.333 1.389 1.389 weight 1.000 ! spec=Noesy, no=601, id=600, vol=8.079290e+05 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 46 and name HG1) 3.147 1.238 1.238 weight 1.000 ! spec=Noesy, no=602, id=601, vol=1.137202e+06 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 46 and name HG1) 3.277 1.342 1.342 weight 1.000 ! spec=Noesy, no=603, id=602, vol=9.415002e+05 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 46 and name HG1) assign (segid " A" and resid 46 and name HN) (segid " A" and resid 46 and name HG2) 3.285 1.349 1.349 weight 1.000 ! spec=Noesy, no=604, id=603, vol=9.319655e+05 assign (segid " A" and resid 45 and name HN) (segid " A" and resid 22 and name HB1) 3.383 1.431 1.431 weight 1.000 ! spec=Noesy, no=605, id=604, vol=7.339782e+05 assign (segid " A" and resid 37 and name HN) (segid " A" and resid 38 and name HG23) 3.315 1.373 1.373 weight 1.000 ! spec=Noesy, no=606, id=605, vol=7.586002e+05 or (segid " A" and resid 37 and name HN) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 37 and name HN) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 37 and name HN) (segid " A" and resid 38 and name HG13) 3.269 1.336 1.336 weight 1.000 ! spec=Noesy, no=607, id=606, vol=7.961390e+05 or (segid " A" and resid 37 and name HN) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 37 and name HN) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 5 and name HN) (segid " A" and resid 5 and name HG23) 3.142 1.234 1.234 weight 1.000 ! spec=Noesy, no=608, id=607, vol=1.127989e+06 or (segid " A" and resid 5 and name HN) (segid " A" and resid 5 and name HG21) or (segid " A" and resid 5 and name HN) (segid " A" and resid 5 and name HG22) assign (segid " A" and resid 33 and name HH2) (segid " A" and resid 31 and name HG22) 3.243 1.315 1.315 weight 1.000 ! spec=Noesy, no=609, id=608, vol=9.028225e+05 or (segid " A" and resid 33 and name HH2) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 33 and name HH2) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 33 and name HZ3) (segid " A" and resid 31 and name HG22) 3.245 1.317 1.317 weight 1.000 ! spec=Noesy, no=610, id=609, vol=9.053932e+05 or (segid " A" and resid 33 and name HZ3) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 33 and name HZ3) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 43 and name HE) (segid " A" and resid 31 and name HG22) 3.247 3.247 2.753 weight 1.000 ! spec=Noesy, no=611, id=610, vol=8.583992e+05 or (segid " A" and resid 43 and name HE) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 43 and name HE) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 31 and name HA) (segid " A" and resid 31 and name HB) 2.893 1.046 1.046 weight 1.000 ! spec=Noesy, no=613, id=612, vol=1.925389e+06 assign (segid " A" and resid 11 and name HB1) (segid " A" and resid 8 and name HB1) 3.347 1.400 1.400 weight 1.000 ! spec=Noesy, no=614, id=613, vol=7.481365e+05 assign (segid " A" and resid 9 and name HA) (segid " A" and resid 8 and name HB1) 3.255 1.324 1.324 weight 1.000 ! spec=Noesy, no=615, id=614, vol=9.425345e+05 assign (segid " A" and resid 13 and name HA) (segid " A" and resid 20 and name HB1) 3.266 3.266 2.734 weight 1.000 ! spec=Noesy, no=616, id=615, vol=8.435518e+05 assign (segid " A" and resid 15 and name HA) (segid " A" and resid 35 and name HB2) 3.216 3.216 2.784 weight 1.000 ! spec=Noesy, no=617, id=616, vol=1.033634e+06 assign (segid " A" and resid 23 and name HA) (segid " A" and resid 43 and name HD2) 3.311 1.370 1.370 weight 1.000 ! spec=Noesy, no=618, id=617, vol=8.456370e+05 assign (segid " A" and resid 11 and name HB2) (segid " A" and resid 8 and name HB1) 3.141 1.233 1.233 weight 1.000 ! spec=Noesy, no=619, id=618, vol=1.187744e+06 assign (segid " A" and resid 15 and name HA) (segid " A" and resid 14 and name HB2) 3.361 1.412 1.412 weight 1.000 ! spec=Noesy, no=620, id=619, vol=7.818185e+05 assign (segid " A" and resid 31 and name HA) (segid " A" and resid 32 and name HB2) 3.343 1.397 1.397 weight 1.000 ! spec=Noesy, no=621, id=620, vol=8.234038e+05 assign (segid " A" and resid 24 and name HA) (segid " A" and resid 25 and name HB2) 3.284 1.348 1.348 weight 1.000 ! spec=Noesy, no=622, id=621, vol=8.987282e+05 assign (segid " A" and resid 47 and name HD2) (segid " A" and resid 47 and name HB2) 3.150 1.240 1.240 weight 1.000 ! spec=Noesy, no=623, id=622, vol=1.158651e+06 assign (segid " A" and resid 23 and name HA) (segid " A" and resid 23 and name HD2) 3.300 1.361 1.361 weight 1.000 ! spec=Noesy, no=624, id=623, vol=8.964750e+05 assign (segid " A" and resid 47 and name HD2) (segid " A" and resid 47 and name HB1) 3.289 1.352 1.352 weight 1.000 ! spec=Noesy, no=625, id=624, vol=8.859670e+05 assign (segid " A" and resid 18 and name HD2) (segid " A" and resid 18 and name HB2) 3.229 1.303 1.303 weight 1.000 ! spec=Noesy, no=627, id=626, vol=9.506530e+05 assign (segid " A" and resid 18 and name HD1) (segid " A" and resid 18 and name HB2) 3.175 1.260 1.260 weight 1.000 ! spec=Noesy, no=628, id=627, vol=1.101035e+06 assign (segid " A" and resid 23 and name HD1) (segid " A" and resid 23 and name HB2) 3.328 1.384 1.384 weight 1.000 ! spec=Noesy, no=629, id=628, vol=8.375932e+05 assign (segid " A" and resid 6 and name HA) (segid " A" and resid 4 and name HB2) 3.264 3.264 2.736 weight 1.000 ! spec=Noesy, no=630, id=629, vol=6.699625e+05 assign (segid " A" and resid 23 and name HA) (segid " A" and resid 23 and name HG2) 3.177 1.262 1.262 weight 1.000 ! spec=Noesy, no=633, id=632, vol=1.147570e+06 assign (segid " A" and resid 5 and name HA) (segid " A" and resid 5 and name HG12) 3.322 1.380 1.380 weight 1.000 ! spec=Noesy, no=634, id=633, vol=8.028140e+05 assign (segid " A" and resid 31 and name HA) (segid " A" and resid 43 and name HB2) 3.339 1.394 1.394 weight 1.000 ! spec=Noesy, no=635, id=634, vol=7.931820e+05 assign (segid " A" and resid 5 and name HB) (segid " A" and resid 5 and name HG12) 3.185 1.268 1.268 weight 1.000 ! spec=Noesy, no=638, id=637, vol=1.038322e+06 assign (segid " A" and resid 32 and name HB2) (segid " A" and resid 46 and name HG1) 3.259 1.328 1.328 weight 1.000 ! spec=Noesy, no=639, id=638, vol=1.004940e+06 assign (segid " A" and resid 46 and name HB2) (segid " A" and resid 46 and name HG1) 2.826 0.998 0.998 weight 1.000 ! spec=Noesy, no=640, id=639, vol=2.257303e+06 assign (segid " A" and resid 46 and name HB2) (segid " A" and resid 46 and name HG2) 3.042 1.157 1.157 weight 1.000 ! spec=Noesy, no=641, id=640, vol=1.424357e+06 assign (segid " A" and resid 35 and name HB1) (segid " A" and resid 15 and name HB3) 2.956 1.092 1.092 weight 1.000 ! spec=Noesy, no=642, id=641, vol=1.496020e+06 or (segid " A" and resid 35 and name HB1) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 35 and name HB1) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 18 and name HB1) (segid " A" and resid 15 and name HB3) 3.018 1.139 1.139 weight 1.000 ! spec=Noesy, no=643, id=642, vol=1.449392e+06 or (segid " A" and resid 18 and name HB1) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 18 and name HB1) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 18 and name HB2) (segid " A" and resid 15 and name HB3) 2.882 1.038 1.038 weight 1.000 ! spec=Noesy, no=644, id=643, vol=1.921448e+06 or (segid " A" and resid 18 and name HB2) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 18 and name HB2) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 5 and name HB) (segid " A" and resid 5 and name HG11) 3.250 1.321 1.321 weight 1.000 ! spec=Noesy, no=645, id=644, vol=9.977980e+05 assign (segid " A" and resid 47 and name HD1) (segid " A" and resid 46 and name HB1) 3.395 1.440 1.440 weight 1.000 ! spec=Noesy, no=646, id=645, vol=7.488730e+05 assign (segid " A" and resid 46 and name HD2) (segid " A" and resid 46 and name HB1) 3.361 1.412 1.412 weight 1.000 ! spec=Noesy, no=647, id=646, vol=7.871532e+05 assign (segid " A" and resid 46 and name HG2) (segid " A" and resid 46 and name HB1) 3.168 1.255 1.255 weight 1.000 ! spec=Noesy, no=648, id=647, vol=1.161781e+06 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 42 and name HN) 3.390 1.436 1.436 weight 1.000 ! spec=Noesy, no=649, id=648, vol=7.028930e+05 assign (segid " A" and resid 37 and name HN) (segid " A" and resid 39 and name HN) 3.345 1.398 1.398 weight 1.000 ! spec=Noesy, no=650, id=649, vol=7.078150e+05 assign (segid " A" and resid 26 and name HN) (segid " A" and resid 29 and name HN) 3.322 1.379 1.379 weight 1.000 ! spec=Noesy, no=651, id=650, vol=8.338115e+05 assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 35 and name HN) 3.136 1.229 1.229 weight 1.000 ! spec=Noesy, no=652, id=651, vol=1.034326e+06 assign (segid " A" and resid 32 and name HN) (segid " A" and resid 33 and name HN) 3.381 1.429 1.429 weight 1.000 ! spec=Noesy, no=653, id=652, vol=7.218288e+05 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 30 and name HD2) 3.319 1.377 1.377 weight 1.000 ! spec=Noesy, no=654, id=653, vol=7.752680e+05 or (segid " A" and resid 48 and name HN) (segid " A" and resid 30 and name HD1) assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 12 and name HN) 3.282 1.346 1.346 weight 1.000 ! spec=Noesy, no=655, id=654, vol=7.482055e+05 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 42 and name HD1) 3.347 1.400 1.400 weight 1.000 ! spec=Noesy, no=656, id=655, vol=7.515570e+05 or (segid " A" and resid 22 and name HN) (segid " A" and resid 42 and name HD2) assign (segid " A" and resid 20 and name HN) (segid " A" and resid 19 and name HN) 3.362 1.413 1.413 weight 1.000 ! spec=Noesy, no=657, id=656, vol=7.328190e+05 assign (segid " A" and resid 27 and name HN) (segid " A" and resid 28 and name HN) 3.210 1.288 1.288 weight 1.000 ! spec=Noesy, no=658, id=657, vol=9.033888e+05 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 49 and name HN) 3.099 1.200 1.200 weight 1.000 ! spec=Noesy, no=659, id=658, vol=1.173144e+06 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 20 and name HD1) 3.181 1.265 1.265 weight 1.000 ! spec=Noesy, no=660, id=659, vol=9.792925e+05 assign (segid " A" and resid 20 and name HE3) (segid " A" and resid 20 and name HH2) 2.581 2.581 3.419 weight 1.000 ! spec=Noesy, no=661, id=660, vol=2.438644e+06 assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 21 and name HA) 3.432 1.472 1.472 weight 1.000 ! spec=Noesy, no=663, id=662, vol=6.750700e+05 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 21 and name HA) assign (segid " A" and resid 46 and name HN) (segid " A" and resid 29 and name HA) 3.686 1.698 1.698 weight 1.000 ! spec=Noesy, no=664, id=663, vol=4.136700e+05 assign (segid " A" and resid 38 and name HN) (segid " A" and resid 35 and name HA) 3.651 1.666 1.666 weight 1.000 ! spec=Noesy, no=665, id=664, vol=4.325235e+05 assign (segid " A" and resid 35 and name HD22) (segid " A" and resid 35 and name HA) 3.666 1.680 1.680 weight 1.000 ! spec=Noesy, no=666, id=665, vol=3.978912e+05 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 30 and name HA) 3.469 3.469 2.531 weight 1.000 ! spec=Noesy, no=667, id=666, vol=5.182515e+05 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 30 and name HA) assign (segid " A" and resid 17 and name HN) (segid " A" and resid 14 and name HA) 3.484 1.517 1.517 weight 1.000 ! spec=Noesy, no=668, id=667, vol=6.143622e+05 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 42 and name HA) 3.572 1.595 1.595 weight 1.000 ! spec=Noesy, no=669, id=668, vol=5.063542e+05 assign (segid " A" and resid 26 and name HD2) (segid " A" and resid 25 and name HA) 3.618 1.636 1.636 weight 1.000 ! spec=Noesy, no=672, id=671, vol=4.979285e+05 or (segid " A" and resid 26 and name HD1) (segid " A" and resid 25 and name HA) assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 47 and name HA) 3.573 1.596 1.596 weight 1.000 ! spec=Noesy, no=673, id=672, vol=5.492620e+05 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 47 and name HA) assign (segid " A" and resid 20 and name HN) (segid " A" and resid 44 and name HA) 3.500 1.531 1.531 weight 1.000 ! spec=Noesy, no=674, id=673, vol=5.749742e+05 assign (segid " A" and resid 18 and name HE) (segid " A" and resid 18 and name HA) 3.588 1.609 1.609 weight 1.000 ! spec=Noesy, no=675, id=674, vol=4.515100e+05 assign (segid " A" and resid 24 and name HN) (segid " A" and resid 22 and name HA) 3.426 1.468 1.468 weight 1.000 ! spec=Noesy, no=676, id=675, vol=6.879802e+05 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 20 and name HA) 3.544 1.570 1.570 weight 1.000 ! spec=Noesy, no=677, id=676, vol=4.613785e+05 assign (segid " A" and resid 36 and name HD22) (segid " A" and resid 43 and name HA) 3.534 1.561 1.561 weight 1.000 ! spec=Noesy, no=678, id=677, vol=4.993985e+05 assign (segid " A" and resid 12 and name HN) (segid " A" and resid 11 and name HB1) 3.474 1.508 1.508 weight 1.000 ! spec=Noesy, no=679, id=678, vol=5.746358e+05 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 49 and name HA) 3.580 1.602 1.602 weight 1.000 ! spec=Noesy, no=680, id=679, vol=4.362898e+05 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 49 and name HA) assign (segid " A" and resid 36 and name HD22) (segid " A" and resid 36 and name HA) 3.637 1.654 1.654 weight 1.000 ! spec=Noesy, no=681, id=680, vol=4.003430e+05 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 16 and name HA) 3.512 1.541 1.541 weight 1.000 ! spec=Noesy, no=682, id=681, vol=5.777270e+05 assign (segid " A" and resid 16 and name HD22) (segid " A" and resid 16 and name HA) 3.553 1.578 1.578 weight 1.000 ! spec=Noesy, no=683, id=682, vol=4.592922e+05 assign (segid " A" and resid 35 and name HN) (segid " A" and resid 33 and name HA) 3.550 1.576 1.576 weight 1.000 ! spec=Noesy, no=684, id=683, vol=5.590108e+05 assign (segid " A" and resid 33 and name HZ3) (segid " A" and resid 33 and name HA) 3.533 1.560 1.560 weight 1.000 ! spec=Noesy, no=685, id=684, vol=5.295505e+05 assign (segid " A" and resid 46 and name HE) (segid " A" and resid 47 and name HD2) 3.692 1.703 1.703 weight 1.000 ! spec=Noesy, no=686, id=685, vol=4.149932e+05 assign (segid " A" and resid 43 and name HE) (segid " A" and resid 24 and name HA) 3.576 1.598 1.598 weight 1.000 ! spec=Noesy, no=687, id=686, vol=4.693525e+05 assign (segid " A" and resid 12 and name HN) (segid " A" and resid 11 and name HB2) 3.520 1.549 1.549 weight 1.000 ! spec=Noesy, no=688, id=687, vol=5.602520e+05 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 15 and name HA) 3.715 1.725 1.725 weight 1.000 ! spec=Noesy, no=689, id=688, vol=3.995410e+05 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 47 and name HD1) 3.728 1.737 1.737 weight 1.000 ! spec=Noesy, no=690, id=689, vol=3.976545e+05 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 47 and name HD1) assign (segid " A" and resid 32 and name HN) (segid " A" and resid 31 and name HB) 3.490 1.522 1.522 weight 1.000 ! spec=Noesy, no=691, id=690, vol=5.999128e+05 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 31 and name HB) 3.690 1.702 1.702 weight 1.000 ! spec=Noesy, no=692, id=691, vol=4.054285e+05 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 31 and name HB) assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 23 and name HD1) 3.452 1.490 1.490 weight 1.000 ! spec=Noesy, no=694, id=693, vol=6.121608e+05 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 23 and name HD1) assign (segid " A" and resid 14 and name HN) (segid " A" and resid 19 and name HA2) 3.511 1.541 1.541 weight 1.000 ! spec=Noesy, no=695, id=694, vol=5.711738e+05 assign (segid " A" and resid 12 and name HN) (segid " A" and resid 12 and name HB1) 3.452 1.489 1.489 weight 1.000 ! spec=Noesy, no=696, id=695, vol=6.589260e+05 assign (segid " A" and resid 36 and name HD22) (segid " A" and resid 33 and name HB1) 3.682 1.695 1.695 weight 1.000 ! spec=Noesy, no=697, id=696, vol=3.718938e+05 assign (segid " A" and resid 41 and name HN) (segid " A" and resid 42 and name HB1) 3.542 1.568 1.568 weight 1.000 ! spec=Noesy, no=698, id=697, vol=5.758078e+05 assign (segid " A" and resid 17 and name HD21) (segid " A" and resid 17 and name HB2) 3.468 1.504 1.504 weight 1.000 ! spec=Noesy, no=699, id=698, vol=5.347668e+05 assign (segid " A" and resid 16 and name HN) (segid " A" and resid 18 and name HD1) 3.593 1.614 1.614 weight 1.000 ! spec=Noesy, no=700, id=699, vol=5.447678e+05 assign (segid " A" and resid 37 and name HN) (segid " A" and resid 35 and name HB2) 3.646 1.662 1.662 weight 1.000 ! spec=Noesy, no=701, id=700, vol=4.358185e+05 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 25 and name HB1) 3.459 1.496 1.496 weight 1.000 ! spec=Noesy, no=702, id=701, vol=6.934885e+05 assign (segid " A" and resid 50 and name HN) (segid " A" and resid 50 and name HD2) 3.617 1.636 1.636 weight 1.000 ! spec=Noesy, no=703, id=702, vol=4.757088e+05 assign (segid " A" and resid 32 and name HN) (segid " A" and resid 46 and name HD2) 3.692 1.703 1.703 weight 1.000 ! spec=Noesy, no=704, id=703, vol=4.499838e+05 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 46 and name HD2) 3.673 1.687 1.687 weight 1.000 ! spec=Noesy, no=705, id=704, vol=4.778148e+05 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 21 and name HB1) 3.510 1.540 1.540 weight 1.000 ! spec=Noesy, no=706, id=705, vol=6.313020e+05 assign (segid " A" and resid 12 and name HE1) (segid " A" and resid 12 and name HB2) 3.702 1.713 1.713 weight 1.000 ! spec=Noesy, no=707, id=706, vol=3.058798e+05 assign (segid " A" and resid 20 and name HE3) (segid " A" and resid 12 and name HB2) 3.679 3.679 2.321 weight 1.000 ! spec=Noesy, no=708, id=707, vol=3.829400e+05 assign (segid " A" and resid 33 and name HH2) (segid " A" and resid 36 and name HB2) 3.501 3.501 2.499 weight 1.000 ! spec=Noesy, no=709, id=708, vol=6.220328e+05 assign (segid " A" and resid 33 and name HH2) (segid " A" and resid 43 and name HD1) 3.475 1.509 1.509 weight 1.000 ! spec=Noesy, no=710, id=709, vol=6.274705e+05 assign (segid " A" and resid 33 and name HE1) (segid " A" and resid 33 and name HB2) 3.485 1.518 1.518 weight 1.000 ! spec=Noesy, no=711, id=710, vol=5.187248e+05 assign (segid " A" and resid 35 and name HN) (segid " A" and resid 36 and name HB1) 3.454 1.491 1.491 weight 1.000 ! spec=Noesy, no=712, id=711, vol=7.236002e+05 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 46 and name HD1) 3.721 1.730 1.730 weight 1.000 ! spec=Noesy, no=713, id=712, vol=4.111618e+05 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 8 and name HB1) 3.486 1.519 1.519 weight 1.000 ! spec=Noesy, no=714, id=713, vol=6.089592e+05 assign (segid " A" and resid 34 and name HN) (segid " A" and resid 44 and name HB1) 3.576 1.599 1.599 weight 1.000 ! spec=Noesy, no=715, id=714, vol=4.091965e+05 assign (segid " A" and resid 40 and name HN) (segid " A" and resid 39 and name HB1) 3.504 1.534 1.534 weight 1.000 ! spec=Noesy, no=716, id=715, vol=6.086822e+05 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 45 and name HB2) 3.454 1.491 1.491 weight 1.000 ! spec=Noesy, no=717, id=716, vol=6.484552e+05 assign (segid " A" and resid 36 and name HN) (segid " A" and resid 37 and name HB1) 3.698 1.709 1.709 weight 1.000 ! spec=Noesy, no=718, id=717, vol=3.827815e+05 assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 20 and name HB1) 3.662 1.676 1.676 weight 1.000 ! spec=Noesy, no=719, id=718, vol=4.034708e+05 assign (segid " A" and resid 12 and name HE1) (segid " A" and resid 14 and name HB2) 3.493 1.525 1.525 weight 1.000 ! spec=Noesy, no=720, id=719, vol=4.850545e+05 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 45 and name HB1) 3.660 1.674 1.674 weight 1.000 ! spec=Noesy, no=721, id=720, vol=4.710945e+05 assign (segid " A" and resid 26 and name HN) (segid " A" and resid 45 and name HB1) 3.470 1.505 1.505 weight 1.000 ! spec=Noesy, no=722, id=721, vol=6.016690e+05 assign (segid " A" and resid 16 and name HD21) (segid " A" and resid 16 and name HB1) 3.566 1.590 1.590 weight 1.000 ! spec=Noesy, no=723, id=722, vol=4.521010e+05 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 39 and name HB2) 3.472 1.507 1.507 weight 1.000 ! spec=Noesy, no=724, id=723, vol=6.086492e+05 assign (segid " A" and resid 29 and name HN) (segid " A" and resid 26 and name HB1) 3.483 1.517 1.517 weight 1.000 ! spec=Noesy, no=725, id=724, vol=6.226855e+05 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 32 and name HB2) 3.560 1.584 1.584 weight 1.000 ! spec=Noesy, no=726, id=725, vol=4.945225e+05 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 32 and name HB2) assign (segid " A" and resid 46 and name HN) (segid " A" and resid 29 and name HB1) 3.660 1.674 1.674 weight 1.000 ! spec=Noesy, no=729, id=728, vol=4.645795e+05 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 29 and name HB1) 3.485 1.518 1.518 weight 1.000 ! spec=Noesy, no=730, id=729, vol=6.307168e+05 assign (segid " A" and resid 28 and name HD2) (segid " A" and resid 29 and name HG2) 3.652 1.667 1.667 weight 1.000 ! spec=Noesy, no=731, id=730, vol=4.024882e+05 assign (segid " A" and resid 26 and name HD2) (segid " A" and resid 29 and name HG2) 3.509 1.539 1.539 weight 1.000 ! spec=Noesy, no=732, id=731, vol=5.788662e+05 or (segid " A" and resid 26 and name HD1) (segid " A" and resid 29 and name HG2) assign (segid " A" and resid 30 and name HN) (segid " A" and resid 29 and name HG2) 3.584 1.605 1.605 weight 1.000 ! spec=Noesy, no=733, id=732, vol=5.481800e+05 assign (segid " A" and resid 4 and name HN) (segid " A" and resid 3 and name HB1) 3.530 1.558 1.558 weight 1.000 ! spec=Noesy, no=734, id=733, vol=5.427052e+05 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 23 and name HG1) 3.475 1.509 1.509 weight 1.000 ! spec=Noesy, no=735, id=734, vol=6.114425e+05 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 23 and name HG1) assign (segid " A" and resid 6 and name HE) (segid " A" and resid 6 and name HB2) 3.573 1.595 1.595 weight 1.000 ! spec=Noesy, no=736, id=735, vol=4.827345e+05 assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 23 and name HB2) 3.514 1.544 1.544 weight 1.000 ! spec=Noesy, no=737, id=736, vol=5.629762e+05 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 23 and name HB2) assign (segid " A" and resid 26 and name HN) (segid " A" and resid 29 and name HG1) 3.495 1.527 1.527 weight 1.000 ! spec=Noesy, no=738, id=737, vol=6.087140e+05 assign (segid " A" and resid 7 and name HN) (segid " A" and resid 6 and name HG1) 3.688 1.700 1.700 weight 1.000 ! spec=Noesy, no=740, id=739, vol=4.141352e+05 assign (segid " A" and resid 7 and name HN) (segid " A" and resid 6 and name HG2) 3.644 1.660 1.660 weight 1.000 ! spec=Noesy, no=741, id=740, vol=4.571558e+05 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 29 and name HB2) 3.444 1.482 1.482 weight 1.000 ! spec=Noesy, no=742, id=741, vol=6.392565e+05 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 50 and name HB1) 3.663 1.677 1.677 weight 1.000 ! spec=Noesy, no=743, id=742, vol=4.450110e+05 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 50 and name HB1) assign (segid " A" and resid 44 and name HN) (segid " A" and resid 43 and name HG1) 3.623 1.641 1.641 weight 1.000 ! spec=Noesy, no=744, id=743, vol=4.553725e+05 assign (segid " A" and resid 12 and name HD2) (segid " A" and resid 10 and name HB2) 3.648 1.663 1.663 weight 1.000 ! spec=Noesy, no=745, id=744, vol=3.818085e+05 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 15 and name HB3) 3.573 1.596 1.596 weight 1.000 ! spec=Noesy, no=746, id=745, vol=5.175018e+05 or (segid " A" and resid 17 and name HN) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 17 and name HN) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 14 and name HN) (segid " A" and resid 15 and name HB3) 3.439 1.478 1.478 weight 1.000 ! spec=Noesy, no=747, id=746, vol=6.211128e+05 or (segid " A" and resid 14 and name HN) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 14 and name HN) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 26 and name HN) (segid " A" and resid 22 and name HB1) 3.618 3.618 2.382 weight 1.000 ! spec=Noesy, no=748, id=747, vol=4.740532e+05 assign (segid " A" and resid 6 and name HN) (segid " A" and resid 5 and name HG11) 3.696 1.708 1.708 weight 1.000 ! spec=Noesy, no=749, id=748, vol=4.628222e+05 assign (segid " A" and resid 12 and name HD2) (segid " A" and resid 38 and name HG23) 3.587 1.608 1.608 weight 1.000 ! spec=Noesy, no=750, id=749, vol=4.932828e+05 or (segid " A" and resid 12 and name HD2) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 12 and name HD2) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 7 and name HN) (segid " A" and resid 5 and name HG23) 3.467 1.503 1.503 weight 1.000 ! spec=Noesy, no=751, id=750, vol=5.736270e+05 or (segid " A" and resid 7 and name HN) (segid " A" and resid 5 and name HG21) or (segid " A" and resid 7 and name HN) (segid " A" and resid 5 and name HG22) assign (segid " A" and resid 30 and name HN) (segid " A" and resid 46 and name HB1) 3.560 1.585 1.585 weight 1.000 ! spec=Noesy, no=752, id=751, vol=5.672842e+05 assign (segid " A" and resid 36 and name HD21) (segid " A" and resid 43 and name HA) 3.469 1.505 1.505 weight 1.000 ! spec=Noesy, no=753, id=752, vol=5.964655e+05 assign (segid " A" and resid 45 and name HA) (segid " A" and resid 31 and name HA) 3.226 1.301 1.301 weight 1.000 ! spec=Noesy, no=754, id=753, vol=9.453280e+05 assign (segid " A" and resid 23 and name HD2) (segid " A" and resid 23 and name HB2) 3.508 1.538 1.538 weight 1.000 ! spec=Noesy, no=755, id=754, vol=6.297240e+05 assign (segid " A" and resid 26 and name HB1) (segid " A" and resid 29 and name HG1) 3.544 1.570 1.570 weight 1.000 ! spec=Noesy, no=756, id=755, vol=5.466052e+05 assign (segid " A" and resid 47 and name HB2) (segid " A" and resid 29 and name HG1) 3.618 1.636 1.636 weight 1.000 ! spec=Noesy, no=757, id=756, vol=5.359282e+05 assign (segid " A" and resid 48 and name HA1) (segid " A" and resid 46 and name HB2) 3.554 1.579 1.579 weight 1.000 ! spec=Noesy, no=758, id=757, vol=6.094328e+05 assign (segid " A" and resid 46 and name HD1) (segid " A" and resid 46 and name HB2) 3.226 1.300 1.300 weight 1.000 ! spec=Noesy, no=759, id=758, vol=1.015023e+06 assign (segid " A" and resid 19 and name HA2) (segid " A" and resid 46 and name HB2) 3.839 1.842 1.842 weight 1.000 ! spec=Noesy, no=761, id=760, vol=4.494305e+05 assign (segid " A" and resid 50 and name HA) (segid " A" and resid 49 and name HB1) 3.672 1.686 1.686 weight 1.000 ! spec=Noesy, no=765, id=764, vol=4.316402e+05 assign (segid " A" and resid 24 and name HA) (segid " A" and resid 43 and name HG1) 3.724 1.733 1.733 weight 1.000 ! spec=Noesy, no=767, id=766, vol=3.970022e+05 assign (segid " A" and resid 47 and name HD2) (segid " A" and resid 46 and name HG1) 3.703 1.714 1.714 weight 1.000 ! spec=Noesy, no=768, id=767, vol=4.163275e+05 assign (segid " A" and resid 42 and name HB1) (segid " A" and resid 10 and name HB2) 3.552 1.577 1.577 weight 1.000 ! spec=Noesy, no=769, id=768, vol=5.784700e+05 assign (segid " A" and resid 47 and name HD2) (segid " A" and resid 15 and name HB3) 3.542 3.542 2.458 weight 1.000 ! spec=Noesy, no=771, id=770, vol=5.153318e+05 or (segid " A" and resid 47 and name HD2) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 47 and name HD2) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 44 and name HB2) (segid " A" and resid 15 and name HB3) 3.677 1.690 1.690 weight 1.000 ! spec=Noesy, no=772, id=771, vol=4.107672e+05 or (segid " A" and resid 44 and name HB2) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 44 and name HB2) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 32 and name HB2) (segid " A" and resid 15 and name HB3) 3.577 1.599 1.599 weight 1.000 ! spec=Noesy, no=773, id=772, vol=5.596858e+05 or (segid " A" and resid 32 and name HB2) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 32 and name HB2) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 42 and name HB2) (segid " A" and resid 22 and name HB1) 3.624 1.642 1.642 weight 1.000 ! spec=Noesy, no=774, id=773, vol=4.547495e+05 assign (segid " A" and resid 44 and name HB2) (segid " A" and resid 38 and name HG23) 3.596 1.616 1.616 weight 1.000 ! spec=Noesy, no=776, id=775, vol=4.928012e+05 or (segid " A" and resid 44 and name HB2) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 44 and name HB2) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 36 and name HA) (segid " A" and resid 38 and name HG23) 3.568 1.592 1.592 weight 1.000 ! spec=Noesy, no=777, id=776, vol=5.439278e+05 or (segid " A" and resid 36 and name HA) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 36 and name HA) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 44 and name HB1) (segid " A" and resid 38 and name HG23) 3.375 1.424 1.424 weight 1.000 ! spec=Noesy, no=778, id=777, vol=7.470535e+05 or (segid " A" and resid 44 and name HB1) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 44 and name HB1) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 37 and name HB1) (segid " A" and resid 38 and name HG13) 3.456 1.493 1.493 weight 1.000 ! spec=Noesy, no=779, id=778, vol=6.549800e+05 or (segid " A" and resid 37 and name HB1) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 37 and name HB1) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 47 and name HD2) (segid " A" and resid 46 and name HB1) 3.660 1.675 1.675 weight 1.000 ! spec=Noesy, no=780, id=779, vol=4.773782e+05 assign (segid " A" and resid 33 and name HB1) (segid " A" and resid 31 and name HG22) 4.646 2.698 2.698 weight 1.000 ! spec=Noesy, no=781, id=780, vol=2.454360e+05 or (segid " A" and resid 33 and name HB1) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 33 and name HB1) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 44 and name HB1) (segid " A" and resid 31 and name HG22) 3.684 1.697 1.697 weight 1.000 ! spec=Noesy, no=782, id=781, vol=3.944238e+05 or (segid " A" and resid 44 and name HB1) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 44 and name HB1) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 37 and name HA) (segid " A" and resid 36 and name HB2) 3.712 1.723 1.723 weight 1.000 ! spec=Noesy, no=783, id=782, vol=4.088628e+05 assign (segid " A" and resid 43 and name HA) (segid " A" and resid 43 and name HD1) 3.462 1.498 1.498 weight 1.000 ! spec=Noesy, no=784, id=783, vol=6.766030e+05 assign (segid " A" and resid 11 and name HB2) (segid " A" and resid 8 and name HB2) 3.499 1.531 1.531 weight 1.000 ! spec=Noesy, no=785, id=784, vol=6.017338e+05 assign (segid " A" and resid 36 and name HA) (segid " A" and resid 39 and name HB2) 3.035 1.151 1.151 weight 1.000 ! spec=Noesy, no=786, id=785, vol=1.406184e+06 assign (segid " A" and resid 47 and name HD1) (segid " A" and resid 47 and name HB2) 3.454 1.491 1.491 weight 1.000 ! spec=Noesy, no=787, id=786, vol=7.132648e+05 assign (segid " A" and resid 31 and name HB) (segid " A" and resid 30 and name HA) 3.506 1.536 1.536 weight 1.000 ! spec=Noesy, no=788, id=787, vol=6.006880e+05 assign (segid " A" and resid 30 and name HB2) (segid " A" and resid 30 and name HA) 2.465 0.759 0.759 weight 1.000 ! spec=Noesy, no=789, id=788, vol=4.453845e+06 assign (segid " A" and resid 30 and name HB1) (segid " A" and resid 30 and name HA) 2.277 0.648 0.648 weight 1.000 ! spec=Noesy, no=790, id=789, vol=6.905423e+06 assign (segid " A" and resid 47 and name HD1) (segid " A" and resid 46 and name HA) 2.556 0.817 0.817 weight 1.000 ! spec=Noesy, no=791, id=790, vol=4.057787e+06 assign (segid " A" and resid 46 and name HD2) (segid " A" and resid 46 and name HA) 3.436 1.476 1.476 weight 1.000 ! spec=Noesy, no=792, id=791, vol=6.845865e+05 assign (segid " A" and resid 47 and name HG2) (segid " A" and resid 46 and name HA) 3.615 1.633 1.633 weight 1.000 ! spec=Noesy, no=793, id=792, vol=5.099950e+05 assign (segid " A" and resid 47 and name HG1) (segid " A" and resid 46 and name HA) 3.586 1.608 1.608 weight 1.000 ! spec=Noesy, no=794, id=793, vol=5.272685e+05 assign (segid " A" and resid 46 and name HB2) (segid " A" and resid 46 and name HA) 2.847 1.013 1.013 weight 1.000 ! spec=Noesy, no=795, id=794, vol=2.120874e+06 assign (segid " A" and resid 46 and name HG1) (segid " A" and resid 46 and name HA) 3.017 1.138 1.138 weight 1.000 ! spec=Noesy, no=796, id=795, vol=1.491532e+06 assign (segid " A" and resid 46 and name HG2) (segid " A" and resid 46 and name HA) 3.023 1.143 1.143 weight 1.000 ! spec=Noesy, no=797, id=796, vol=1.499781e+06 assign (segid " A" and resid 26 and name HB1) (segid " A" and resid 26 and name HA) 2.968 1.101 1.101 weight 1.000 ! spec=Noesy, no=798, id=797, vol=1.480374e+06 assign (segid " A" and resid 15 and name HA) (segid " A" and resid 14 and name HA) 3.122 3.122 2.878 weight 1.000 ! spec=Noesy, no=799, id=798, vol=1.199130e+06 assign (segid " A" and resid 38 and name HG23) (segid " A" and resid 14 and name HA) 2.491 0.775 0.775 weight 1.000 ! spec=Noesy, no=800, id=799, vol=4.389474e+06 or (segid " A" and resid 38 and name HG22) (segid " A" and resid 14 and name HA) or (segid " A" and resid 38 and name HG21) (segid " A" and resid 14 and name HA) assign (segid " A" and resid 38 and name HG13) (segid " A" and resid 14 and name HA) 2.936 2.936 3.064 weight 1.000 ! spec=Noesy, no=801, id=800, vol=1.635502e+06 or (segid " A" and resid 38 and name HG12) (segid " A" and resid 14 and name HA) or (segid " A" and resid 38 and name HG11) (segid " A" and resid 14 and name HA) assign (segid " A" and resid 15 and name HB3) (segid " A" and resid 19 and name HA1) 2.954 1.090 1.090 weight 1.000 ! spec=Noesy, no=803, id=802, vol=1.694159e+06 or (segid " A" and resid 15 and name HB2) (segid " A" and resid 19 and name HA1) or (segid " A" and resid 15 and name HB1) (segid " A" and resid 19 and name HA1) assign (segid " A" and resid 44 and name HB2) (segid " A" and resid 19 and name HA1) 3.544 1.570 1.570 weight 1.000 ! spec=Noesy, no=804, id=803, vol=5.292700e+05 assign (segid " A" and resid 46 and name HD1) (segid " A" and resid 32 and name HA) 3.464 1.500 1.500 weight 1.000 ! spec=Noesy, no=805, id=804, vol=6.551620e+05 assign (segid " A" and resid 46 and name HG1) (segid " A" and resid 19 and name HA1) 3.316 1.374 1.374 weight 1.000 ! spec=Noesy, no=806, id=805, vol=8.667152e+05 assign (segid " A" and resid 46 and name HG2) (segid " A" and resid 19 and name HA1) 3.327 1.384 1.384 weight 1.000 ! spec=Noesy, no=807, id=806, vol=8.647112e+05 assign (segid " A" and resid 33 and name HB2) (segid " A" and resid 32 and name HA) 3.534 1.561 1.561 weight 1.000 ! spec=Noesy, no=809, id=808, vol=5.825108e+05 assign (segid " A" and resid 32 and name HB2) (segid " A" and resid 32 and name HA) 3.028 1.146 1.146 weight 1.000 ! spec=Noesy, no=810, id=809, vol=1.321378e+06 assign (segid " A" and resid 38 and name HB) (segid " A" and resid 39 and name HA) 4.591 2.634 2.634 weight 1.000 ! spec=Noesy, no=811, id=810, vol=1.718892e+05 assign (segid " A" and resid 23 and name HA) (segid " A" and resid 42 and name HA) 2.676 0.895 0.895 weight 1.000 ! spec=Noesy, no=812, id=811, vol=3.020822e+06 assign (segid " A" and resid 42 and name HB1) (segid " A" and resid 42 and name HA) 3.184 1.267 1.267 weight 1.000 ! spec=Noesy, no=813, id=812, vol=1.065883e+06 assign (segid " A" and resid 21 and name HB1) (segid " A" and resid 39 and name HA) 3.848 1.851 1.851 weight 1.000 ! spec=Noesy, no=814, id=813, vol=4.498288e+05 assign (segid " A" and resid 39 and name HB1) (segid " A" and resid 39 and name HA) 2.763 0.954 0.954 weight 1.000 ! spec=Noesy, no=816, id=815, vol=2.142143e+06 assign (segid " A" and resid 39 and name HB2) (segid " A" and resid 39 and name HA) 2.796 0.977 0.977 weight 1.000 ! spec=Noesy, no=817, id=816, vol=2.125790e+06 assign (segid " A" and resid 43 and name HG2) (segid " A" and resid 42 and name HA) 3.321 1.378 1.378 weight 1.000 ! spec=Noesy, no=818, id=817, vol=8.078368e+05 assign (segid " A" and resid 38 and name HG23) (segid " A" and resid 39 and name HA) 3.209 1.287 1.287 weight 1.000 ! spec=Noesy, no=819, id=818, vol=9.839702e+05 or (segid " A" and resid 38 and name HG22) (segid " A" and resid 39 and name HA) or (segid " A" and resid 38 and name HG21) (segid " A" and resid 39 and name HA) assign (segid " A" and resid 26 and name HB1) (segid " A" and resid 25 and name HA) 3.654 1.669 1.669 weight 1.000 ! spec=Noesy, no=821, id=820, vol=4.847915e+05 assign (segid " A" and resid 47 and name HB2) (segid " A" and resid 47 and name HA) 2.387 0.712 0.712 weight 1.000 ! spec=Noesy, no=822, id=821, vol=5.900270e+06 assign (segid " A" and resid 22 and name HD1) (segid " A" and resid 25 and name HA) 2.612 0.853 0.853 weight 1.000 ! spec=Noesy, no=823, id=822, vol=3.738276e+06 assign (segid " A" and resid 47 and name HG2) (segid " A" and resid 47 and name HA) 3.078 1.184 1.184 weight 1.000 ! spec=Noesy, no=824, id=823, vol=1.336050e+06 assign (segid " A" and resid 29 and name HB1) (segid " A" and resid 25 and name HA) 3.428 1.469 1.469 weight 1.000 ! spec=Noesy, no=825, id=824, vol=7.203898e+05 assign (segid " A" and resid 47 and name HG1) (segid " A" and resid 47 and name HA) 3.130 1.225 1.225 weight 1.000 ! spec=Noesy, no=826, id=825, vol=1.209886e+06 assign (segid " A" and resid 29 and name HG2) (segid " A" and resid 47 and name HA) 3.046 1.160 1.160 weight 1.000 ! spec=Noesy, no=827, id=826, vol=1.361269e+06 assign (segid " A" and resid 29 and name HG1) (segid " A" and resid 47 and name HA) 2.667 0.889 0.889 weight 1.000 ! spec=Noesy, no=828, id=827, vol=2.844601e+06 assign (segid " A" and resid 29 and name HB2) (segid " A" and resid 47 and name HA) 3.277 1.342 1.342 weight 1.000 ! spec=Noesy, no=829, id=828, vol=8.983025e+05 assign (segid " A" and resid 45 and name HB1) (segid " A" and resid 25 and name HA) 3.135 1.229 1.229 weight 1.000 ! spec=Noesy, no=830, id=829, vol=1.140858e+06 assign (segid " A" and resid 18 and name HD2) (segid " A" and resid 18 and name HA) 3.289 1.352 1.352 weight 1.000 ! spec=Noesy, no=831, id=830, vol=8.889250e+05 assign (segid " A" and resid 18 and name HB2) (segid " A" and resid 18 and name HA) 2.767 0.957 0.957 weight 1.000 ! spec=Noesy, no=832, id=831, vol=2.608378e+06 assign (segid " A" and resid 18 and name HG1) (segid " A" and resid 18 and name HA) 2.699 0.910 0.910 weight 1.000 ! spec=Noesy, no=833, id=832, vol=3.008922e+06 assign (segid " A" and resid 15 and name HB3) (segid " A" and resid 18 and name HA) 3.373 1.422 1.422 weight 1.000 ! spec=Noesy, no=834, id=833, vol=7.626892e+05 or (segid " A" and resid 15 and name HB2) (segid " A" and resid 18 and name HA) or (segid " A" and resid 15 and name HB1) (segid " A" and resid 18 and name HA) assign (segid " A" and resid 44 and name HB2) (segid " A" and resid 44 and name HA) 2.682 0.899 0.899 weight 1.000 ! spec=Noesy, no=835, id=834, vol=2.845669e+06 assign (segid " A" and resid 44 and name HB1) (segid " A" and resid 44 and name HA) 2.749 0.944 0.944 weight 1.000 ! spec=Noesy, no=836, id=835, vol=2.426170e+06 assign (segid " A" and resid 23 and name HD2) (segid " A" and resid 22 and name HA) 2.495 0.778 0.778 weight 1.000 ! spec=Noesy, no=837, id=836, vol=5.121636e+06 assign (segid " A" and resid 22 and name HB1) (segid " A" and resid 22 and name HA) 2.773 0.961 0.961 weight 1.000 ! spec=Noesy, no=838, id=837, vol=2.587490e+06 assign (segid " A" and resid 23 and name HD1) (segid " A" and resid 22 and name HA) 2.551 0.813 0.813 weight 1.000 ! spec=Noesy, no=839, id=838, vol=4.084698e+06 assign (segid " A" and resid 22 and name HB2) (segid " A" and resid 22 and name HA) 2.770 0.959 0.959 weight 1.000 ! spec=Noesy, no=842, id=841, vol=2.418938e+06 assign (segid " A" and resid 44 and name HB2) (segid " A" and resid 20 and name HA) 3.459 3.459 2.541 weight 1.000 ! spec=Noesy, no=843, id=842, vol=1.289334e+06 assign (segid " A" and resid 20 and name HB1) (segid " A" and resid 20 and name HA) 2.942 1.082 1.082 weight 1.000 ! spec=Noesy, no=844, id=843, vol=1.689171e+06 assign (segid " A" and resid 39 and name HB1) (segid " A" and resid 43 and name HA) 3.373 1.422 1.422 weight 1.000 ! spec=Noesy, no=847, id=846, vol=6.911580e+05 assign (segid " A" and resid 44 and name HB1) (segid " A" and resid 43 and name HA) 2.945 2.945 3.055 weight 1.000 ! spec=Noesy, no=848, id=847, vol=1.576864e+06 assign (segid " A" and resid 39 and name HB2) (segid " A" and resid 43 and name HA) 3.307 1.367 1.367 weight 1.000 ! spec=Noesy, no=849, id=848, vol=7.670362e+05 assign (segid " A" and resid 43 and name HG1) (segid " A" and resid 43 and name HA) 3.024 1.143 1.143 weight 1.000 ! spec=Noesy, no=850, id=849, vol=1.466084e+06 assign (segid " A" and resid 21 and name HB1) (segid " A" and resid 11 and name HA) 3.084 3.084 2.916 weight 1.000 ! spec=Noesy, no=852, id=851, vol=1.116576e+06 assign (segid " A" and resid 12 and name HB2) (segid " A" and resid 11 and name HA) 3.341 3.341 2.659 weight 1.000 ! spec=Noesy, no=853, id=852, vol=7.165848e+05 assign (segid " A" and resid 7 and name HB1) (segid " A" and resid 7 and name HA) 2.663 0.886 0.886 weight 1.000 ! spec=Noesy, no=855, id=854, vol=2.806034e+06 assign (segid " A" and resid 7 and name HB2) (segid " A" and resid 7 and name HA) 2.745 0.942 0.942 weight 1.000 ! spec=Noesy, no=856, id=855, vol=2.331779e+06 assign (segid " A" and resid 11 and name HB2) (segid " A" and resid 11 and name HB1) 2.071 0.536 0.536 weight 1.000 ! spec=Noesy, no=859, id=857, vol=1.458708e+07 assign (segid " A" and resid 8 and name HB2) (segid " A" and resid 11 and name HB1) 3.285 1.349 1.349 weight 1.000 ! spec=Noesy, no=860, id=858, vol=8.132765e+05 assign (segid " A" and resid 5 and name HG23) (segid " A" and resid 6 and name HA) 3.673 1.687 1.687 weight 1.000 ! spec=Noesy, no=862, id=860, vol=4.370375e+05 or (segid " A" and resid 5 and name HG21) (segid " A" and resid 6 and name HA) or (segid " A" and resid 5 and name HG22) (segid " A" and resid 6 and name HA) assign (segid " A" and resid 9 and name HB1) (segid " A" and resid 9 and name HA) 2.512 0.788 0.788 weight 1.000 ! spec=Noesy, no=863, id=861, vol=4.138635e+06 assign (segid " A" and resid 49 and name HB1) (segid " A" and resid 49 and name HA) 2.790 0.973 0.973 weight 1.000 ! spec=Noesy, no=864, id=862, vol=2.373175e+06 assign (segid " A" and resid 37 and name HB2) (segid " A" and resid 37 and name HA) 2.303 0.663 0.663 weight 1.000 ! spec=Noesy, no=866, id=864, vol=6.850874e+06 assign (segid " A" and resid 38 and name HG23) (segid " A" and resid 38 and name HA) 2.520 0.794 0.794 weight 1.000 ! spec=Noesy, no=867, id=865, vol=4.072153e+06 or (segid " A" and resid 38 and name HG22) (segid " A" and resid 38 and name HA) or (segid " A" and resid 38 and name HG21) (segid " A" and resid 38 and name HA) assign (segid " A" and resid 38 and name HG13) (segid " A" and resid 38 and name HA) 2.182 0.595 0.595 weight 1.000 ! spec=Noesy, no=868, id=866, vol=9.650928e+06 or (segid " A" and resid 38 and name HG12) (segid " A" and resid 38 and name HA) or (segid " A" and resid 38 and name HG11) (segid " A" and resid 38 and name HA) assign (segid " A" and resid 36 and name HB1) (segid " A" and resid 36 and name HA) 2.565 0.823 0.823 weight 1.000 ! spec=Noesy, no=869, id=867, vol=3.665177e+06 assign (segid " A" and resid 39 and name HB1) (segid " A" and resid 36 and name HA) 2.987 1.115 1.115 weight 1.000 ! spec=Noesy, no=870, id=868, vol=1.472692e+06 assign (segid " A" and resid 44 and name HB1) (segid " A" and resid 36 and name HA) 2.717 0.923 0.923 weight 1.000 ! spec=Noesy, no=871, id=869, vol=2.401589e+06 assign (segid " A" and resid 29 and name HG1) (segid " A" and resid 48 and name HA1) 3.339 3.339 2.661 weight 1.000 ! spec=Noesy, no=873, id=871, vol=7.834658e+05 assign (segid " A" and resid 44 and name HB2) (segid " A" and resid 31 and name HA) 3.610 3.610 2.390 weight 1.000 ! spec=Noesy, no=876, id=874, vol=2.858640e+05 assign (segid " A" and resid 5 and name HG23) (segid " A" and resid 5 and name HA) 2.578 0.831 0.831 weight 1.000 ! spec=Noesy, no=878, id=876, vol=3.599316e+06 or (segid " A" and resid 5 and name HG21) (segid " A" and resid 5 and name HA) or (segid " A" and resid 5 and name HG22) (segid " A" and resid 5 and name HA) assign (segid " A" and resid 5 and name HD13) (segid " A" and resid 5 and name HA) 3.187 1.269 1.269 weight 1.000 ! spec=Noesy, no=879, id=877, vol=9.559348e+05 or (segid " A" and resid 5 and name HD11) (segid " A" and resid 5 and name HA) or (segid " A" and resid 5 and name HD12) (segid " A" and resid 5 and name HA) assign (segid " A" and resid 16 and name HN) (segid " A" and resid 18 and name HN) 3.549 1.574 1.574 weight 1.000 ! spec=Noesy, no=880, id=878, vol=5.094115e+05 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 29 and name HN) 3.602 1.622 1.622 weight 1.000 ! spec=Noesy, no=881, id=879, vol=5.129895e+05 assign (segid " A" and resid 37 and name HN) (segid " A" and resid 35 and name HN) 3.475 1.509 1.509 weight 1.000 ! spec=Noesy, no=882, id=880, vol=5.231202e+05 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 20 and name HZ2) 3.445 1.484 1.484 weight 1.000 ! spec=Noesy, no=883, id=881, vol=5.699015e+05 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 20 and name HZ2) 3.458 3.458 2.542 weight 1.000 ! spec=Noesy, no=884, id=882, vol=5.980548e+05 assign (segid " A" and resid 50 and name HN) (segid " A" and resid 17 and name HD22) 3.624 3.624 2.376 weight 1.000 ! spec=Noesy, no=885, id=883, vol=4.661325e+05 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 36 and name HN) 3.725 1.734 1.734 weight 1.000 ! spec=Noesy, no=886, id=884, vol=4.081640e+05 assign (segid " A" and resid 36 and name HD22) (segid " A" and resid 36 and name HN) 3.583 1.605 1.605 weight 1.000 ! spec=Noesy, no=887, id=885, vol=4.277020e+05 assign (segid " A" and resid 9 and name HN) (segid " A" and resid 11 and name HN) 3.561 1.585 1.585 weight 1.000 ! spec=Noesy, no=888, id=886, vol=5.081595e+05 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 20 and name HE3) 3.524 1.552 1.552 weight 1.000 ! spec=Noesy, no=889, id=887, vol=5.393040e+05 assign (segid " A" and resid 40 and name HN) (segid " A" and resid 38 and name HN) 3.657 1.672 1.672 weight 1.000 ! spec=Noesy, no=890, id=888, vol=4.072742e+05 assign (segid " A" and resid 9 and name HN) (segid " A" and resid 9 and name HD2) 3.527 1.555 1.555 weight 1.000 ! spec=Noesy, no=891, id=889, vol=5.271612e+05 assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 20 and name HZ3) 3.690 3.690 2.310 weight 1.000 ! spec=Noesy, no=892, id=890, vol=3.604590e+05 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 20 and name HZ3) 3.403 1.448 1.448 weight 1.000 ! spec=Noesy, no=893, id=891, vol=6.053038e+05 assign (segid " A" and resid 22 and name HE) (segid " A" and resid 26 and name HE1) 3.553 1.578 1.578 weight 1.000 ! spec=Noesy, no=894, id=892, vol=5.543345e+05 or (segid " A" and resid 22 and name HE) (segid " A" and resid 26 and name HE2) assign (segid " A" and resid 27 and name HN) (segid " A" and resid 28 and name HD2) 3.581 1.603 1.603 weight 1.000 ! spec=Noesy, no=895, id=893, vol=5.228190e+05 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 18 and name HE) 3.567 1.591 1.591 weight 1.000 ! spec=Noesy, no=896, id=894, vol=5.467985e+05 assign (segid " A" and resid 28 and name HE1) (segid " A" and resid 26 and name HD2) 3.567 1.590 1.590 weight 1.000 ! spec=Noesy, no=897, id=895, vol=4.813728e+05 or (segid " A" and resid 28 and name HE1) (segid " A" and resid 26 and name HD1) assign (segid " A" and resid 32 and name HN) (segid " A" and resid 30 and name HD2) 3.665 1.679 1.679 weight 1.000 ! spec=Noesy, no=898, id=896, vol=4.583922e+05 or (segid " A" and resid 32 and name HN) (segid " A" and resid 30 and name HD1) assign (segid " A" and resid 46 and name HN) (segid " A" and resid 30 and name HD2) 3.512 1.542 1.542 weight 1.000 ! spec=Noesy, no=899, id=897, vol=5.801195e+05 or (segid " A" and resid 46 and name HN) (segid " A" and resid 30 and name HD1) assign (segid " A" and resid 49 and name HN) (segid " A" and resid 30 and name HD2) 3.450 1.488 1.488 weight 1.000 ! spec=Noesy, no=900, id=898, vol=6.216488e+05 or (segid " A" and resid 49 and name HN) (segid " A" and resid 30 and name HD1) assign (segid " A" and resid 10 and name HN) (segid " A" and resid 42 and name HE2) 3.685 1.697 1.697 weight 1.000 ! spec=Noesy, no=901, id=899, vol=4.256432e+05 or (segid " A" and resid 10 and name HN) (segid " A" and resid 42 and name HE1) assign (segid " A" and resid 13 and name HN) (segid " A" and resid 12 and name HN) 3.512 1.542 1.542 weight 1.000 ! spec=Noesy, no=902, id=900, vol=5.206508e+05 assign (segid " A" and resid 41 and name HN) (segid " A" and resid 42 and name HD1) 3.697 1.709 1.709 weight 1.000 ! spec=Noesy, no=903, id=901, vol=4.104320e+05 or (segid " A" and resid 41 and name HN) (segid " A" and resid 42 and name HD2) assign (segid " A" and resid 30 and name HN) (segid " A" and resid 30 and name HE2) 3.562 1.586 1.586 weight 1.000 ! spec=Noesy, no=904, id=902, vol=5.570698e+05 or (segid " A" and resid 30 and name HN) (segid " A" and resid 30 and name HE1) assign (segid " A" and resid 32 and name HN) (segid " A" and resid 30 and name HE2) 3.695 1.707 1.707 weight 1.000 ! spec=Noesy, no=905, id=903, vol=4.154582e+05 or (segid " A" and resid 32 and name HN) (segid " A" and resid 30 and name HE1) assign (segid " A" and resid 49 and name HN) (segid " A" and resid 30 and name HE2) 3.650 1.666 1.666 weight 1.000 ! spec=Noesy, no=906, id=904, vol=4.382055e+05 or (segid " A" and resid 49 and name HN) (segid " A" and resid 30 and name HE1) assign (segid " A" and resid 25 and name HN) (segid " A" and resid 24 and name HN) 3.235 1.308 1.308 weight 1.000 ! spec=Noesy, no=907, id=905, vol=8.591952e+05 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 45 and name HN) 3.686 1.699 1.699 weight 1.000 ! spec=Noesy, no=908, id=906, vol=4.336528e+05 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 45 and name HN) 3.336 1.391 1.391 weight 1.000 ! spec=Noesy, no=909, id=907, vol=7.016265e+05 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 31 and name HN) 3.673 1.686 1.686 weight 1.000 ! spec=Noesy, no=910, id=908, vol=4.117660e+05 assign (segid " A" and resid 32 and name HN) (segid " A" and resid 31 and name HN) 3.595 1.616 1.616 weight 1.000 ! spec=Noesy, no=911, id=909, vol=4.885672e+05 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 21 and name HN) 3.666 1.680 1.680 weight 1.000 ! spec=Noesy, no=912, id=910, vol=4.669962e+05 assign (segid " A" and resid 32 and name HN) (segid " A" and resid 44 and name HN) 3.679 1.692 1.692 weight 1.000 ! spec=Noesy, no=913, id=911, vol=4.169300e+05 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 48 and name HN) 3.384 1.431 1.431 weight 1.000 ! spec=Noesy, no=914, id=912, vol=7.533268e+05 assign (segid " A" and resid 6 and name HN) (segid " A" and resid 5 and name HN) 3.261 1.329 1.329 weight 1.000 ! spec=Noesy, no=915, id=913, vol=7.755760e+05 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 14 and name HN) 3.364 1.415 1.415 weight 1.000 ! spec=Noesy, no=916, id=914, vol=6.535035e+05 assign (segid " A" and resid 12 and name HD2) (segid " A" and resid 12 and name HN) 3.237 1.310 1.310 weight 1.000 ! spec=Noesy, no=917, id=915, vol=7.512768e+05 assign (segid " A" and resid 26 and name HN) (segid " A" and resid 29 and name HA) 3.788 1.794 1.794 weight 1.000 ! spec=Noesy, no=918, id=916, vol=3.537028e+05 assign (segid " A" and resid 49 and name HN) (segid " A" and resid 29 and name HA) 3.986 1.986 1.986 weight 1.000 ! spec=Noesy, no=919, id=917, vol=2.595138e+05 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 29 and name HA) 3.788 1.794 1.794 weight 1.000 ! spec=Noesy, no=920, id=918, vol=3.292712e+05 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 29 and name HA) assign (segid " A" and resid 28 and name HD2) (segid " A" and resid 29 and name HA) 4.319 2.332 2.332 weight 1.000 ! spec=Noesy, no=921, id=919, vol=1.508038e+05 assign (segid " A" and resid 34 and name HN) (segid " A" and resid 35 and name HA) 3.753 1.760 1.760 weight 1.000 ! spec=Noesy, no=922, id=920, vol=3.619412e+05 assign (segid " A" and resid 34 and name HD1) (segid " A" and resid 35 and name HA) 3.738 1.747 1.747 weight 1.000 ! spec=Noesy, no=923, id=921, vol=3.577678e+05 or (segid " A" and resid 34 and name HD2) (segid " A" and resid 35 and name HA) assign (segid " A" and resid 15 and name HN) (segid " A" and resid 35 and name HA) 4.351 2.366 2.366 weight 1.000 ! spec=Noesy, no=924, id=922, vol=1.490365e+05 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 45 and name HA) 4.310 2.322 2.322 weight 1.000 ! spec=Noesy, no=925, id=923, vol=1.573618e+05 assign (segid " A" and resid 46 and name HE) (segid " A" and resid 45 and name HA) 4.740 2.808 2.808 weight 1.000 ! spec=Noesy, no=926, id=924, vol=7.096700e+04 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 30 and name HA) 4.601 2.646 2.646 weight 1.000 ! spec=Noesy, no=927, id=925, vol=1.084062e+05 assign (segid " A" and resid 29 and name HN) (segid " A" and resid 30 and name HA) 4.254 2.262 2.262 weight 1.000 ! spec=Noesy, no=928, id=926, vol=1.599815e+05 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 46 and name HA) 4.285 2.295 2.295 weight 1.000 ! spec=Noesy, no=929, id=927, vol=1.781620e+05 assign (segid " A" and resid 45 and name HN) (segid " A" and resid 46 and name HA) 4.511 2.544 2.544 weight 1.000 ! spec=Noesy, no=930, id=928, vol=1.121888e+05 assign (segid " A" and resid 19 and name HN) (segid " A" and resid 46 and name HA) 4.270 2.279 2.279 weight 1.000 ! spec=Noesy, no=931, id=929, vol=1.567340e+05 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 46 and name HA) 3.882 1.884 1.884 weight 1.000 ! spec=Noesy, no=932, id=930, vol=3.294028e+05 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 46 and name HA) assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 46 and name HA) 4.361 2.377 2.377 weight 1.000 ! spec=Noesy, no=933, id=931, vol=1.355585e+05 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 46 and name HA) assign (segid " A" and resid 25 and name HN) (segid " A" and resid 26 and name HA) 3.799 1.804 1.804 weight 1.000 ! spec=Noesy, no=934, id=932, vol=3.824490e+05 assign (segid " A" and resid 26 and name HZ) (segid " A" and resid 26 and name HA) 3.742 3.742 2.258 weight 1.000 ! spec=Noesy, no=935, id=933, vol=3.840308e+05 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 28 and name HA) 4.857 2.949 2.949 weight 1.000 ! spec=Noesy, no=936, id=934, vol=1.128205e+05 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 14 and name HA) 4.667 2.723 2.723 weight 1.000 ! spec=Noesy, no=937, id=935, vol=9.216650e+04 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 28 and name HA) 4.315 2.328 2.328 weight 1.000 ! spec=Noesy, no=939, id=936, vol=1.661302e+05 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 19 and name HA1) 3.881 1.882 1.882 weight 1.000 ! spec=Noesy, no=940, id=937, vol=3.331685e+05 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 32 and name HA) 4.449 2.474 2.474 weight 1.000 ! spec=Noesy, no=941, id=938, vol=1.597562e+05 assign (segid " A" and resid 35 and name HN) (segid " A" and resid 32 and name HA) 4.106 2.108 2.108 weight 1.000 ! spec=Noesy, no=942, id=939, vol=2.375395e+05 assign (segid " A" and resid 33 and name HE1) (segid " A" and resid 32 and name HA) 4.414 2.436 2.436 weight 1.000 ! spec=Noesy, no=943, id=940, vol=1.262305e+05 assign (segid " A" and resid 24 and name HN) (segid " A" and resid 42 and name HA) 4.808 2.890 2.890 weight 1.000 ! spec=Noesy, no=944, id=941, vol=7.982950e+04 assign (segid " A" and resid 38 and name HN) (segid " A" and resid 39 and name HA) 4.074 2.075 2.075 weight 1.000 ! spec=Noesy, no=945, id=942, vol=2.516162e+05 assign (segid " A" and resid 12 and name HN) (segid " A" and resid 39 and name HA) 3.976 1.976 1.976 weight 1.000 ! spec=Noesy, no=946, id=943, vol=2.909112e+05 assign (segid " A" and resid 7 and name HN) (segid " A" and resid 8 and name HA) 4.052 2.053 2.053 weight 1.000 ! spec=Noesy, no=947, id=944, vol=2.241338e+05 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 8 and name HA) 3.751 1.759 1.759 weight 1.000 ! spec=Noesy, no=948, id=945, vol=3.888845e+05 assign (segid " A" and resid 49 and name HN) (segid " A" and resid 47 and name HA) 3.880 1.882 1.882 weight 1.000 ! spec=Noesy, no=950, id=947, vol=3.148652e+05 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 47 and name HA) 4.028 2.028 2.028 weight 1.000 ! spec=Noesy, no=951, id=948, vol=2.054110e+05 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 47 and name HA) assign (segid " A" and resid 46 and name HE) (segid " A" and resid 18 and name HA) 3.865 1.867 1.867 weight 1.000 ! spec=Noesy, no=952, id=949, vol=3.092610e+05 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 18 and name HA) 3.984 1.984 1.984 weight 1.000 ! spec=Noesy, no=953, id=950, vol=2.692035e+05 assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 22 and name HA) 4.449 2.474 2.474 weight 1.000 ! spec=Noesy, no=954, id=951, vol=1.241668e+05 assign (segid " A" and resid 20 and name HE3) (segid " A" and resid 20 and name HA) 4.379 2.397 2.397 weight 1.000 ! spec=Noesy, no=955, id=952, vol=1.239390e+05 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 43 and name HA) 3.842 1.845 1.845 weight 1.000 ! spec=Noesy, no=956, id=953, vol=3.139745e+05 assign (segid " A" and resid 43 and name HE) (segid " A" and resid 43 and name HA) 3.930 1.930 1.930 weight 1.000 ! spec=Noesy, no=957, id=954, vol=2.822062e+05 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 11 and name HA) 4.255 2.263 2.263 weight 1.000 ! spec=Noesy, no=958, id=955, vol=1.639995e+05 assign (segid " A" and resid 40 and name HN) (segid " A" and resid 41 and name HA) 4.384 2.403 2.403 weight 1.000 ! spec=Noesy, no=959, id=956, vol=1.436935e+05 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 11 and name HA) 3.826 1.830 1.830 weight 1.000 ! spec=Noesy, no=960, id=957, vol=2.529938e+05 assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 34 and name HA) 4.549 2.586 2.586 weight 1.000 ! spec=Noesy, no=961, id=958, vol=1.043185e+05 assign (segid " A" and resid 37 and name HN) (segid " A" and resid 34 and name HA) 4.695 2.756 2.756 weight 1.000 ! spec=Noesy, no=962, id=959, vol=1.489250e+04 assign (segid " A" and resid 35 and name HD22) (segid " A" and resid 34 and name HA) 4.800 2.880 2.880 weight 1.000 ! spec=Noesy, no=963, id=960, vol=6.673250e+04 assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 11 and name HB1) 3.964 1.964 1.964 weight 1.000 ! spec=Noesy, no=964, id=961, vol=2.202970e+05 assign (segid " A" and resid 36 and name HN) (segid " A" and resid 37 and name HA) 4.192 2.197 2.197 weight 1.000 ! spec=Noesy, no=965, id=962, vol=1.455928e+05 assign (segid " A" and resid 35 and name HN) (segid " A" and resid 36 and name HA) 3.810 1.814 1.814 weight 1.000 ! spec=Noesy, no=966, id=963, vol=3.759602e+05 assign (segid " A" and resid 2 and name HD1) (segid " A" and resid 3 and name HA) 4.424 2.446 2.446 weight 1.000 ! spec=Noesy, no=967, id=964, vol=1.554462e+05 or (segid " A" and resid 2 and name HD2) (segid " A" and resid 3 and name HA) assign (segid " A" and resid 16 and name HD21) (segid " A" and resid 16 and name HA) 3.824 1.828 1.828 weight 1.000 ! spec=Noesy, no=969, id=966, vol=3.092502e+05 assign (segid " A" and resid 45 and name HN) (segid " A" and resid 31 and name HA) 3.920 1.921 1.921 weight 1.000 ! spec=Noesy, no=970, id=967, vol=2.955230e+05 assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 12 and name HA) 4.520 2.554 2.554 weight 1.000 ! spec=Noesy, no=971, id=968, vol=1.046222e+05 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 12 and name HA) assign (segid " A" and resid 33 and name HE1) (segid " A" and resid 31 and name HA) 4.463 2.489 2.489 weight 1.000 ! spec=Noesy, no=972, id=969, vol=1.020488e+05 assign (segid " A" and resid 26 and name HD2) (segid " A" and resid 27 and name HA) 4.169 2.172 2.172 weight 1.000 ! spec=Noesy, no=973, id=970, vol=1.851180e+05 or (segid " A" and resid 26 and name HD1) (segid " A" and resid 27 and name HA) assign (segid " A" and resid 28 and name HD2) (segid " A" and resid 27 and name HA) 4.199 2.204 2.204 weight 1.000 ! spec=Noesy, no=974, id=971, vol=1.700115e+05 assign (segid " A" and resid 33 and name HE1) (segid " A" and resid 33 and name HA) 4.259 2.268 2.268 weight 1.000 ! spec=Noesy, no=975, id=972, vol=1.503590e+05 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 33 and name HA) 4.356 2.372 2.372 weight 1.000 ! spec=Noesy, no=976, id=973, vol=1.424230e+05 assign (segid " A" and resid 37 and name HN) (segid " A" and resid 33 and name HA) 4.233 2.240 2.240 weight 1.000 ! spec=Noesy, no=977, id=974, vol=1.463192e+05 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 47 and name HD2) 4.258 2.267 2.267 weight 1.000 ! spec=Noesy, no=978, id=975, vol=1.553002e+05 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 47 and name HD2) assign (segid " A" and resid 20 and name HN) (segid " A" and resid 47 and name HD2) 4.075 2.076 2.076 weight 1.000 ! spec=Noesy, no=979, id=976, vol=1.995825e+05 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 47 and name HD2) 3.790 1.796 1.796 weight 1.000 ! spec=Noesy, no=980, id=977, vol=3.535482e+05 assign (segid " A" and resid 2 and name HN) (segid " A" and resid 1 and name HA) 3.997 1.997 1.997 weight 1.000 ! spec=Noesy, no=981, id=978, vol=2.282848e+05 assign (segid " A" and resid 45 and name HN) (segid " A" and resid 47 and name HD2) 4.269 2.279 2.279 weight 1.000 ! spec=Noesy, no=982, id=979, vol=1.623880e+05 assign (segid " A" and resid 6 and name HE) (segid " A" and resid 1 and name HA) 4.294 2.305 2.305 weight 1.000 ! spec=Noesy, no=983, id=980, vol=1.283005e+05 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 13 and name HB2) 3.930 1.931 1.931 weight 1.000 ! spec=Noesy, no=984, id=981, vol=2.983792e+05 assign (segid " A" and resid 19 and name HN) (segid " A" and resid 13 and name HB2) 3.755 1.763 1.763 weight 1.000 ! spec=Noesy, no=985, id=982, vol=3.534638e+05 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 48 and name HA2) 4.399 2.419 2.419 weight 1.000 ! spec=Noesy, no=986, id=983, vol=1.371482e+05 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 24 and name HA) 4.564 2.604 2.604 weight 1.000 ! spec=Noesy, no=987, id=984, vol=1.156608e+05 assign (segid " A" and resid 6 and name HE) (segid " A" and resid 13 and name HB1) 3.994 1.994 1.994 weight 1.000 ! spec=Noesy, no=988, id=985, vol=1.536608e+05 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 13 and name HB1) 4.405 2.426 2.426 weight 1.000 ! spec=Noesy, no=990, id=987, vol=1.458108e+05 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 13 and name HB1) 4.760 2.832 2.832 weight 1.000 ! spec=Noesy, no=991, id=988, vol=8.309075e+04 assign (segid " A" and resid 20 and name HE3) (segid " A" and resid 13 and name HB1) 3.885 1.886 1.886 weight 1.000 ! spec=Noesy, no=992, id=989, vol=2.710395e+05 assign (segid " A" and resid 8 and name HN) (segid " A" and resid 11 and name HB2) 4.079 2.080 2.080 weight 1.000 ! spec=Noesy, no=993, id=990, vol=2.246870e+05 assign (segid " A" and resid 10 and name HN) (segid " A" and resid 11 and name HB2) 3.742 1.751 1.751 weight 1.000 ! spec=Noesy, no=994, id=991, vol=3.739478e+05 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 11 and name HB2) 4.695 2.756 2.756 weight 1.000 ! spec=Noesy, no=995, id=992, vol=1.040068e+05 assign (segid " A" and resid 17 and name HD21) (segid " A" and resid 50 and name HA) 3.951 1.951 1.951 weight 1.000 ! spec=Noesy, no=998, id=995, vol=2.240090e+05 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 50 and name HA) 3.844 1.847 1.847 weight 1.000 ! spec=Noesy, no=999, id=996, vol=3.411952e+05 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 50 and name HA) assign (segid " A" and resid 19 and name HN) (segid " A" and resid 47 and name HD1) 3.922 1.923 1.923 weight 1.000 ! spec=Noesy, no=1002, id=999, vol=2.815965e+05 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 47 and name HD1) 4.623 2.671 2.671 weight 1.000 ! spec=Noesy, no=1004, id=1001, vol=1.063920e+05 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 47 and name HD1) 4.124 2.126 2.126 weight 1.000 ! spec=Noesy, no=1005, id=1002, vol=2.283998e+05 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 47 and name HD1) 3.929 1.930 1.930 weight 1.000 ! spec=Noesy, no=1006, id=1003, vol=2.968748e+05 assign (segid " A" and resid 16 and name HD22) (segid " A" and resid 15 and name HA) 4.554 2.593 2.593 weight 1.000 ! spec=Noesy, no=1008, id=1005, vol=9.552025e+04 assign (segid " A" and resid 18 and name HE) (segid " A" and resid 15 and name HA) 4.071 2.072 2.072 weight 1.000 ! spec=Noesy, no=1009, id=1006, vol=2.302248e+05 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 47 and name HD1) 4.341 2.355 2.355 weight 1.000 ! spec=Noesy, no=1010, id=1007, vol=1.145705e+05 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 47 and name HD1) assign (segid " A" and resid 22 and name HN) (segid " A" and resid 23 and name HA) 4.161 2.164 2.164 weight 1.000 ! spec=Noesy, no=1012, id=1009, vol=2.132468e+05 assign (segid " A" and resid 10 and name HN) (segid " A" and resid 7 and name HB2) 4.388 2.406 2.406 weight 1.000 ! spec=Noesy, no=1013, id=1010, vol=1.257735e+05 assign (segid " A" and resid 42 and name HN) (segid " A" and resid 23 and name HA) 4.246 2.253 2.253 weight 1.000 ! spec=Noesy, no=1014, id=1011, vol=1.570000e+05 assign (segid " A" and resid 43 and name HE) (segid " A" and resid 23 and name HA) 4.360 2.376 2.376 weight 1.000 ! spec=Noesy, no=1015, id=1012, vol=1.443322e+05 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 14 and name HB1) 4.016 2.016 2.016 weight 1.000 ! spec=Noesy, no=1016, id=1013, vol=2.439825e+05 assign (segid " A" and resid 38 and name HN) (segid " A" and resid 14 and name HB1) 4.089 2.090 2.090 weight 1.000 ! spec=Noesy, no=1017, id=1014, vol=2.063955e+05 assign (segid " A" and resid 33 and name HN) (segid " A" and resid 31 and name HB) 3.756 1.763 1.763 weight 1.000 ! spec=Noesy, no=1018, id=1015, vol=3.461212e+05 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 31 and name HB) 4.754 2.825 2.825 weight 1.000 ! spec=Noesy, no=1019, id=1016, vol=8.364375e+04 assign (segid " A" and resid 26 and name HZ) (segid " A" and resid 26 and name HB2) 4.167 2.171 2.171 weight 1.000 ! spec=Noesy, no=1020, id=1017, vol=1.965115e+05 assign (segid " A" and resid 22 and name HE) (segid " A" and resid 26 and name HB2) 4.132 2.135 2.135 weight 1.000 ! spec=Noesy, no=1021, id=1018, vol=2.357498e+05 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 23 and name HD1) 3.921 1.921 1.921 weight 1.000 ! spec=Noesy, no=1023, id=1020, vol=2.891062e+05 assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 23 and name HD1) 3.919 1.920 1.920 weight 1.000 ! spec=Noesy, no=1024, id=1021, vol=2.439262e+05 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 19 and name HA2) 4.257 2.265 2.265 weight 1.000 ! spec=Noesy, no=1025, id=1022, vol=1.721362e+05 assign (segid " A" and resid 45 and name HN) (segid " A" and resid 19 and name HA2) 3.789 1.794 1.794 weight 1.000 ! spec=Noesy, no=1026, id=1023, vol=3.596295e+05 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 19 and name HA2) 4.483 2.512 2.512 weight 1.000 ! spec=Noesy, no=1027, id=1024, vol=1.155972e+05 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 19 and name HA2) 3.791 1.797 1.797 weight 1.000 ! spec=Noesy, no=1028, id=1025, vol=3.710212e+05 assign (segid " A" and resid 46 and name HE) (segid " A" and resid 19 and name HA2) 3.867 1.869 1.869 weight 1.000 ! spec=Noesy, no=1029, id=1026, vol=3.147658e+05 assign (segid " A" and resid 17 and name HD22) (segid " A" and resid 19 and name HA2) 4.616 2.663 2.663 weight 1.000 ! spec=Noesy, no=1030, id=1027, vol=1.129520e+05 assign (segid " A" and resid 20 and name HZ3) (segid " A" and resid 12 and name HB1) 4.051 2.051 2.051 weight 1.000 ! spec=Noesy, no=1031, id=1028, vol=2.265532e+05 assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 12 and name HB1) 4.735 2.803 2.803 weight 1.000 ! spec=Noesy, no=1032, id=1029, vol=8.517300e+04 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 12 and name HB1) 4.566 2.606 2.606 weight 1.000 ! spec=Noesy, no=1033, id=1030, vol=1.209890e+05 assign (segid " A" and resid 20 and name HH2) (segid " A" and resid 12 and name HB1) 4.362 2.379 2.379 weight 1.000 ! spec=Noesy, no=1034, id=1031, vol=1.435378e+05 assign (segid " A" and resid 33 and name HE1) (segid " A" and resid 33 and name HB1) 3.980 1.980 1.980 weight 1.000 ! spec=Noesy, no=1035, id=1032, vol=2.134238e+05 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 18 and name HD2) 3.740 1.748 1.748 weight 1.000 ! spec=Noesy, no=1036, id=1033, vol=4.034322e+05 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 9 and name HB2) 4.294 2.305 2.305 weight 1.000 ! spec=Noesy, no=1037, id=1034, vol=1.590252e+05 assign (segid " A" and resid 12 and name HN) (segid " A" and resid 42 and name HB1) 4.728 2.794 2.794 weight 1.000 ! spec=Noesy, no=1038, id=1035, vol=8.791375e+04 assign (segid " A" and resid 2 and name HE1) (segid " A" and resid 18 and name HD1) 4.453 2.479 2.479 weight 1.000 ! spec=Noesy, no=1040, id=1037, vol=1.089535e+05 or (segid " A" and resid 2 and name HE2) (segid " A" and resid 18 and name HD1) assign (segid " A" and resid 33 and name HE1) (segid " A" and resid 30 and name HB2) 4.809 2.891 2.891 weight 1.000 ! spec=Noesy, no=1046, id=1043, vol=8.352100e+04 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 30 and name HB2) 4.333 2.347 2.347 weight 1.000 ! spec=Noesy, no=1047, id=1044, vol=1.641415e+05 assign (segid " A" and resid 45 and name HN) (segid " A" and resid 21 and name HB1) 4.307 2.319 2.319 weight 1.000 ! spec=Noesy, no=1048, id=1045, vol=1.603502e+05 assign (segid " A" and resid 42 and name HN) (segid " A" and resid 21 and name HB1) 4.143 2.146 2.146 weight 1.000 ! spec=Noesy, no=1049, id=1046, vol=2.066395e+05 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 21 and name HB1) 4.224 2.230 2.230 weight 1.000 ! spec=Noesy, no=1050, id=1047, vol=1.734735e+05 assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 21 and name HB1) 3.796 1.801 1.801 weight 1.000 ! spec=Noesy, no=1051, id=1048, vol=2.943565e+05 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 16 and name HB2) 4.816 2.899 2.899 weight 1.000 ! spec=Noesy, no=1053, id=1049, vol=7.131925e+04 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 12 and name HB2) 4.247 2.254 2.254 weight 1.000 ! spec=Noesy, no=1054, id=1050, vol=1.777428e+05 assign (segid " A" and resid 20 and name HZ3) (segid " A" and resid 12 and name HB2) 3.935 1.936 1.936 weight 1.000 ! spec=Noesy, no=1055, id=1051, vol=2.921118e+05 assign (segid " A" and resid 20 and name HH2) (segid " A" and resid 12 and name HB2) 4.172 2.175 2.175 weight 1.000 ! spec=Noesy, no=1056, id=1052, vol=1.810370e+05 assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 20 and name HB2) 3.904 1.905 1.905 weight 1.000 ! spec=Noesy, no=1060, id=1056, vol=2.650575e+05 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 44 and name HB2) 4.311 2.323 2.323 weight 1.000 ! spec=Noesy, no=1061, id=1057, vol=1.590250e+05 assign (segid " A" and resid 41 and name HN) (segid " A" and resid 42 and name HB2) 3.988 1.988 1.988 weight 1.000 ! spec=Noesy, no=1062, id=1058, vol=2.729812e+05 assign (segid " A" and resid 38 and name HN) (segid " A" and resid 36 and name HB2) 4.062 2.063 2.063 weight 1.000 ! spec=Noesy, no=1064, id=1060, vol=2.327320e+05 assign (segid " A" and resid 35 and name HD22) (segid " A" and resid 44 and name HB2) 4.622 2.671 2.671 weight 1.000 ! spec=Noesy, no=1065, id=1061, vol=5.600625e+04 assign (segid " A" and resid 12 and name HN) (segid " A" and resid 42 and name HB2) 4.524 2.558 2.558 weight 1.000 ! spec=Noesy, no=1066, id=1062, vol=1.045372e+05 assign (segid " A" and resid 24 and name HN) (segid " A" and resid 43 and name HD2) 3.889 1.890 1.890 weight 1.000 ! spec=Noesy, no=1067, id=1063, vol=3.129082e+05 assign (segid " A" and resid 33 and name HZ2) (segid " A" and resid 43 and name HD1) 3.868 1.870 1.870 weight 1.000 ! spec=Noesy, no=1068, id=1064, vol=3.335748e+05 assign (segid " A" and resid 34 and name HD1) (segid " A" and resid 33 and name HB2) 4.040 2.040 2.040 weight 1.000 ! spec=Noesy, no=1069, id=1065, vol=2.517045e+05 or (segid " A" and resid 34 and name HD2) (segid " A" and resid 33 and name HB2) assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 46 and name HD1) 4.209 2.214 2.214 weight 1.000 ! spec=Noesy, no=1070, id=1066, vol=1.832160e+05 assign (segid " A" and resid 10 and name HN) (segid " A" and resid 8 and name HB1) 3.854 1.856 1.856 weight 1.000 ! spec=Noesy, no=1071, id=1067, vol=3.239650e+05 assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 44 and name HB1) 4.354 2.370 2.370 weight 1.000 ! spec=Noesy, no=1072, id=1068, vol=1.464972e+05 assign (segid " A" and resid 35 and name HN) (segid " A" and resid 44 and name HB1) 3.953 1.953 1.953 weight 1.000 ! spec=Noesy, no=1073, id=1069, vol=3.041035e+05 assign (segid " A" and resid 24 and name HN) (segid " A" and resid 45 and name HB2) 4.630 2.679 2.679 weight 1.000 ! spec=Noesy, no=1074, id=1070, vol=8.933450e+04 assign (segid " A" and resid 26 and name HN) (segid " A" and resid 45 and name HB2) 3.788 1.794 1.794 weight 1.000 ! spec=Noesy, no=1075, id=1071, vol=3.643475e+05 assign (segid " A" and resid 12 and name HD2) (segid " A" and resid 21 and name HB2) 3.948 1.949 1.949 weight 1.000 ! spec=Noesy, no=1076, id=1072, vol=2.335150e+05 assign (segid " A" and resid 20 and name HE3) (segid " A" and resid 20 and name HB1) 4.573 2.614 2.614 weight 1.000 ! spec=Noesy, no=1077, id=1073, vol=1.006078e+05 assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 14 and name HB2) 4.127 2.129 2.129 weight 1.000 ! spec=Noesy, no=1078, id=1074, vol=2.216295e+05 assign (segid " A" and resid 35 and name HD22) (segid " A" and resid 14 and name HB2) 4.387 2.406 2.406 weight 1.000 ! spec=Noesy, no=1079, id=1075, vol=1.386432e+05 assign (segid " A" and resid 25 and name HN) (segid " A" and resid 45 and name HB1) 4.375 2.392 2.392 weight 1.000 ! spec=Noesy, no=1080, id=1076, vol=1.473725e+05 assign (segid " A" and resid 29 and name HN) (segid " A" and resid 45 and name HB1) 4.505 2.537 2.537 weight 1.000 ! spec=Noesy, no=1081, id=1077, vol=1.580560e+05 assign (segid " A" and resid 28 and name HD2) (segid " A" and resid 45 and name HB1) 4.744 2.814 2.814 weight 1.000 ! spec=Noesy, no=1082, id=1078, vol=8.015525e+04 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 45 and name HB1) 4.799 2.879 2.879 weight 1.000 ! spec=Noesy, no=1083, id=1079, vol=2.639375e+04 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 45 and name HB1) assign (segid " A" and resid 10 and name HN) (segid " A" and resid 8 and name HB2) 4.020 2.020 2.020 weight 1.000 ! spec=Noesy, no=1084, id=1080, vol=2.562285e+05 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 8 and name HB2) 3.867 1.869 1.869 weight 1.000 ! spec=Noesy, no=1085, id=1081, vol=3.301772e+05 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 8 and name HB2) 4.100 2.102 2.102 weight 1.000 ! spec=Noesy, no=1086, id=1082, vol=2.338755e+05 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 8 and name HB2) assign (segid " A" and resid 7 and name HN) (segid " A" and resid 8 and name HB2) 4.312 2.324 2.324 weight 1.000 ! spec=Noesy, no=1087, id=1083, vol=1.574680e+05 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 16 and name HB1) 4.489 2.519 2.519 weight 1.000 ! spec=Noesy, no=1088, id=1084, vol=1.178988e+05 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 16 and name HB1) 3.814 1.818 1.818 weight 1.000 ! spec=Noesy, no=1089, id=1085, vol=3.686155e+05 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 39 and name HB2) 4.413 2.435 2.435 weight 1.000 ! spec=Noesy, no=1090, id=1086, vol=1.418408e+05 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 39 and name HB2) 3.824 1.828 1.828 weight 1.000 ! spec=Noesy, no=1091, id=1087, vol=3.362598e+05 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 39 and name HB2) 4.762 2.834 2.834 weight 1.000 ! spec=Noesy, no=1092, id=1088, vol=8.213800e+04 assign (segid " A" and resid 36 and name HN) (segid " A" and resid 39 and name HB2) 4.360 2.377 2.377 weight 1.000 ! spec=Noesy, no=1093, id=1089, vol=1.280605e+05 assign (segid " A" and resid 38 and name HN) (segid " A" and resid 39 and name HB2) 3.846 3.846 2.154 weight 1.000 ! spec=Noesy, no=1094, id=1090, vol=3.239925e+05 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 39 and name HB2) 4.489 2.518 2.518 weight 1.000 ! spec=Noesy, no=1095, id=1091, vol=1.138858e+05 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 39 and name HB2) assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 39 and name HB2) 3.948 1.948 1.948 weight 1.000 ! spec=Noesy, no=1096, id=1092, vol=2.873952e+05 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 39 and name HB2) assign (segid " A" and resid 28 and name HN) (segid " A" and resid 26 and name HB1) 3.804 1.809 1.809 weight 1.000 ! spec=Noesy, no=1097, id=1093, vol=3.726610e+05 assign (segid " A" and resid 22 and name HE) (segid " A" and resid 26 and name HB1) 4.040 2.040 2.040 weight 1.000 ! spec=Noesy, no=1098, id=1094, vol=2.624645e+05 assign (segid " A" and resid 26 and name HZ) (segid " A" and resid 26 and name HB1) 4.505 2.537 2.537 weight 1.000 ! spec=Noesy, no=1099, id=1095, vol=1.162792e+05 assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 32 and name HB2) 3.834 1.838 1.838 weight 1.000 ! spec=Noesy, no=1100, id=1096, vol=3.208590e+05 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 25 and name HB2) 3.890 1.892 1.892 weight 1.000 ! spec=Noesy, no=1101, id=1097, vol=2.906635e+05 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 32 and name HB2) 3.904 1.906 1.906 weight 1.000 ! spec=Noesy, no=1102, id=1098, vol=3.250135e+05 assign (segid " A" and resid 34 and name HN) (segid " A" and resid 32 and name HB2) 4.076 2.077 2.077 weight 1.000 ! spec=Noesy, no=1103, id=1099, vol=1.873835e+05 assign (segid " A" and resid 35 and name HN) (segid " A" and resid 32 and name HB2) 3.833 1.837 1.837 weight 1.000 ! spec=Noesy, no=1104, id=1100, vol=3.716465e+05 assign (segid " A" and resid 46 and name HE) (segid " A" and resid 32 and name HB2) 3.936 1.936 1.936 weight 1.000 ! spec=Noesy, no=1105, id=1101, vol=2.837400e+05 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 38 and name HB) 4.365 2.382 2.382 weight 1.000 ! spec=Noesy, no=1107, id=1103, vol=1.405172e+05 assign (segid " A" and resid 12 and name HN) (segid " A" and resid 10 and name HB1) 4.536 2.571 2.571 weight 1.000 ! spec=Noesy, no=1112, id=1107, vol=1.146362e+05 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 47 and name HG2) 4.161 2.164 2.164 weight 1.000 ! spec=Noesy, no=1113, id=1108, vol=2.022405e+05 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 35 and name HB1) 4.448 2.473 2.473 weight 1.000 ! spec=Noesy, no=1114, id=1109, vol=1.415072e+05 assign (segid " A" and resid 37 and name HN) (segid " A" and resid 35 and name HB1) 3.976 1.976 1.976 weight 1.000 ! spec=Noesy, no=1115, id=1110, vol=2.307710e+05 assign (segid " A" and resid 28 and name HE1) (segid " A" and resid 47 and name HG2) 4.522 2.556 2.556 weight 1.000 ! spec=Noesy, no=1116, id=1111, vol=1.016832e+05 assign (segid " A" and resid 34 and name HD1) (segid " A" and resid 35 and name HB1) 4.261 2.269 2.269 weight 1.000 ! spec=Noesy, no=1118, id=1113, vol=1.779122e+05 or (segid " A" and resid 34 and name HD2) (segid " A" and resid 35 and name HB1) assign (segid " A" and resid 46 and name HE) (segid " A" and resid 47 and name HG2) 4.334 2.347 2.347 weight 1.000 ! spec=Noesy, no=1119, id=1114, vol=1.508190e+05 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 47 and name HG2) 4.646 2.698 2.698 weight 1.000 ! spec=Noesy, no=1120, id=1115, vol=1.234562e+05 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 47 and name HG2) assign (segid " A" and resid 22 and name HE) (segid " A" and resid 29 and name HB1) 4.146 2.148 2.148 weight 1.000 ! spec=Noesy, no=1121, id=1116, vol=2.121852e+05 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 18 and name HB1) 4.336 2.350 2.350 weight 1.000 ! spec=Noesy, no=1122, id=1117, vol=1.448308e+05 assign (segid " A" and resid 49 and name HN) (segid " A" and resid 47 and name HB1) 4.274 2.283 2.283 weight 1.000 ! spec=Noesy, no=1125, id=1120, vol=1.653165e+05 assign (segid " A" and resid 22 and name HE) (segid " A" and resid 29 and name HG2) 4.344 2.358 2.358 weight 1.000 ! spec=Noesy, no=1126, id=1121, vol=1.443300e+05 assign (segid " A" and resid 28 and name HN) (segid " A" and resid 29 and name HG2) 4.752 2.823 2.823 weight 1.000 ! spec=Noesy, no=1127, id=1122, vol=9.868225e+04 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 32 and name HB1) 3.896 1.898 1.898 weight 1.000 ! spec=Noesy, no=1128, id=1123, vol=3.088938e+05 assign (segid " A" and resid 34 and name HD1) (segid " A" and resid 32 and name HB1) 4.639 2.690 2.690 weight 1.000 ! spec=Noesy, no=1129, id=1124, vol=7.757100e+04 or (segid " A" and resid 34 and name HD2) (segid " A" and resid 32 and name HB1) assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 32 and name HB1) 4.100 2.102 2.102 weight 1.000 ! spec=Noesy, no=1130, id=1125, vol=2.068330e+05 assign (segid " A" and resid 35 and name HN) (segid " A" and resid 32 and name HB1) 4.078 2.079 2.079 weight 1.000 ! spec=Noesy, no=1131, id=1126, vol=2.379878e+05 assign (segid " A" and resid 46 and name HE) (segid " A" and resid 32 and name HB1) 3.870 1.872 1.872 weight 1.000 ! spec=Noesy, no=1132, id=1127, vol=3.309900e+05 assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 23 and name HG1) 3.754 1.762 1.762 weight 1.000 ! spec=Noesy, no=1133, id=1128, vol=3.528748e+05 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 23 and name HG1) assign (segid " A" and resid 15 and name HN) (segid " A" and resid 18 and name HB2) 4.636 2.686 2.686 weight 1.000 ! spec=Noesy, no=1134, id=1129, vol=9.129525e+04 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 18 and name HB2) 3.935 1.936 1.936 weight 1.000 ! spec=Noesy, no=1135, id=1130, vol=2.879678e+05 assign (segid " A" and resid 4 and name HN) (segid " A" and resid 3 and name HB2) 3.983 1.983 1.983 weight 1.000 ! spec=Noesy, no=1136, id=1131, vol=2.438065e+05 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 18 and name HG2) 3.909 1.910 1.910 weight 1.000 ! spec=Noesy, no=1137, id=1132, vol=3.065595e+05 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 29 and name HG1) 4.343 2.358 2.358 weight 1.000 ! spec=Noesy, no=1138, id=1133, vol=1.548890e+05 assign (segid " A" and resid 28 and name HD2) (segid " A" and resid 29 and name HG1) 3.872 1.875 1.875 weight 1.000 ! spec=Noesy, no=1139, id=1134, vol=2.716038e+05 assign (segid " A" and resid 26 and name HD2) (segid " A" and resid 29 and name HG1) 4.020 2.020 2.020 weight 1.000 ! spec=Noesy, no=1140, id=1135, vol=2.607250e+05 or (segid " A" and resid 26 and name HD1) (segid " A" and resid 29 and name HG1) assign (segid " A" and resid 4 and name HE) (segid " A" and resid 6 and name HB1) 4.474 2.502 2.502 weight 1.000 ! spec=Noesy, no=1141, id=1136, vol=1.366465e+05 assign (segid " A" and resid 8 and name HN) (segid " A" and resid 6 and name HB1) 3.871 1.873 1.873 weight 1.000 ! spec=Noesy, no=1142, id=1137, vol=3.154590e+05 assign (segid " A" and resid 6 and name HE) (segid " A" and resid 6 and name HB1) 4.080 2.081 2.081 weight 1.000 ! spec=Noesy, no=1143, id=1138, vol=2.083065e+05 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 46 and name HB2) 4.206 2.211 2.211 weight 1.000 ! spec=Noesy, no=1144, id=1139, vol=2.071848e+05 assign (segid " A" and resid 6 and name HE) (segid " A" and resid 6 and name HG1) 3.873 1.875 1.875 weight 1.000 ! spec=Noesy, no=1152, id=1147, vol=3.245520e+05 assign (segid " A" and resid 3 and name HN) (segid " A" and resid 4 and name HG1) 4.581 2.623 2.623 weight 1.000 ! spec=Noesy, no=1153, id=1148, vol=9.147900e+04 assign (segid " A" and resid 6 and name HE) (segid " A" and resid 6 and name HG2) 3.889 1.890 1.890 weight 1.000 ! spec=Noesy, no=1154, id=1149, vol=3.278138e+05 assign (segid " A" and resid 22 and name HE) (segid " A" and resid 29 and name HB2) 4.314 2.327 2.327 weight 1.000 ! spec=Noesy, no=1158, id=1153, vol=1.672312e+05 assign (segid " A" and resid 45 and name HN) (segid " A" and resid 29 and name HB2) 4.318 2.330 2.330 weight 1.000 ! spec=Noesy, no=1159, id=1154, vol=1.458575e+05 assign (segid " A" and resid 25 and name HN) (segid " A" and resid 43 and name HG1) 3.991 1.991 1.991 weight 1.000 ! spec=Noesy, no=1160, id=1155, vol=2.566425e+05 assign (segid " A" and resid 31 and name HN) (segid " A" and resid 43 and name HG1) 4.327 2.341 2.341 weight 1.000 ! spec=Noesy, no=1161, id=1156, vol=1.560428e+05 assign (segid " A" and resid 33 and name HH2) (segid " A" and resid 43 and name HG1) 4.352 2.368 2.368 weight 1.000 ! spec=Noesy, no=1162, id=1157, vol=1.487102e+05 assign (segid " A" and resid 33 and name HZ3) (segid " A" and resid 43 and name HG1) 4.820 2.905 2.905 weight 1.000 ! spec=Noesy, no=1163, id=1158, vol=6.832525e+04 assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 43 and name HG1) 4.632 2.682 2.682 weight 1.000 ! spec=Noesy, no=1164, id=1159, vol=9.425475e+04 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 43 and name HG1) assign (segid " A" and resid 36 and name HD22) (segid " A" and resid 43 and name HG1) 4.351 2.366 2.366 weight 1.000 ! spec=Noesy, no=1165, id=1160, vol=1.311298e+05 assign (segid " A" and resid 26 and name HN) (segid " A" and resid 22 and name HB2) 4.009 2.009 2.009 weight 1.000 ! spec=Noesy, no=1167, id=1162, vol=2.821140e+05 assign (segid " A" and resid 26 and name HE1) (segid " A" and resid 22 and name HB2) 4.268 2.276 2.276 weight 1.000 ! spec=Noesy, no=1168, id=1163, vol=1.833328e+05 or (segid " A" and resid 26 and name HE2) (segid " A" and resid 22 and name HB2) assign (segid " A" and resid 30 and name HN) (segid " A" and resid 46 and name HG1) 4.667 2.723 2.723 weight 1.000 ! spec=Noesy, no=1169, id=1164, vol=9.657350e+04 assign (segid " A" and resid 19 and name HN) (segid " A" and resid 46 and name HG1) 4.014 2.014 2.014 weight 1.000 ! spec=Noesy, no=1175, id=1170, vol=2.331625e+05 assign (segid " A" and resid 35 and name HD22) (segid " A" and resid 46 and name HG1) 4.356 2.372 2.372 weight 1.000 ! spec=Noesy, no=1176, id=1171, vol=1.388208e+05 assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 46 and name HG1) 3.758 1.766 1.766 weight 1.000 ! spec=Noesy, no=1177, id=1172, vol=3.377602e+05 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 46 and name HG1) assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 46 and name HG2) 4.097 2.098 2.098 weight 1.000 ! spec=Noesy, no=1178, id=1173, vol=2.242828e+05 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 46 and name HG2) assign (segid " A" and resid 35 and name HN) (segid " A" and resid 15 and name HB3) 3.904 1.906 1.906 weight 1.000 ! spec=Noesy, no=1179, id=1174, vol=3.241045e+05 or (segid " A" and resid 35 and name HN) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 35 and name HN) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 36 and name HN) (segid " A" and resid 15 and name HB3) 4.253 2.261 2.261 weight 1.000 ! spec=Noesy, no=1180, id=1175, vol=1.634405e+05 or (segid " A" and resid 36 and name HN) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 36 and name HN) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 34 and name HE2) (segid " A" and resid 15 and name HB3) 4.635 2.685 2.685 weight 1.000 ! spec=Noesy, no=1181, id=1176, vol=8.668075e+04 or (segid " A" and resid 34 and name HE2) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 34 and name HE2) (segid " A" and resid 15 and name HB1) or (segid " A" and resid 34 and name HE1) (segid " A" and resid 15 and name HB3) or (segid " A" and resid 34 and name HE1) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 34 and name HE1) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 16 and name HD22) (segid " A" and resid 15 and name HB3) 4.498 2.529 2.529 weight 1.000 ! spec=Noesy, no=1182, id=1177, vol=1.061010e+05 or (segid " A" and resid 16 and name HD22) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 16 and name HD22) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 34 and name HD1) (segid " A" and resid 15 and name HB3) 4.151 2.154 2.154 weight 1.000 ! spec=Noesy, no=1183, id=1178, vol=1.919968e+05 or (segid " A" and resid 34 and name HD1) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 34 and name HD1) (segid " A" and resid 15 and name HB1) or (segid " A" and resid 34 and name HD2) (segid " A" and resid 15 and name HB3) or (segid " A" and resid 34 and name HD2) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 34 and name HD2) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 16 and name HD21) (segid " A" and resid 15 and name HB3) 4.364 2.380 2.380 weight 1.000 ! spec=Noesy, no=1184, id=1179, vol=1.309175e+05 or (segid " A" and resid 16 and name HD21) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 16 and name HD21) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 22 and name HB1) 3.903 3.903 2.097 weight 1.000 ! spec=Noesy, no=1185, id=1180, vol=2.714695e+05 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 22 and name HB1) 4.276 2.285 2.285 weight 1.000 ! spec=Noesy, no=1186, id=1181, vol=1.656370e+05 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 22 and name HB1) 4.522 2.556 2.556 weight 1.000 ! spec=Noesy, no=1187, id=1182, vol=1.205220e+05 assign (segid " A" and resid 26 and name HE1) (segid " A" and resid 22 and name HB1) 4.026 2.026 2.026 weight 1.000 ! spec=Noesy, no=1188, id=1183, vol=2.651232e+05 or (segid " A" and resid 26 and name HE2) (segid " A" and resid 22 and name HB1) assign (segid " A" and resid 26 and name HZ) (segid " A" and resid 22 and name HB1) 4.396 2.416 2.416 weight 1.000 ! spec=Noesy, no=1189, id=1184, vol=1.384305e+05 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 22 and name HB1) 4.122 2.124 2.124 weight 1.000 ! spec=Noesy, no=1190, id=1185, vol=2.049090e+05 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 22 and name HB1) assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 22 and name HB1) 4.039 2.040 2.040 weight 1.000 ! spec=Noesy, no=1191, id=1186, vol=2.561448e+05 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 22 and name HB1) assign (segid " A" and resid 26 and name HN) (segid " A" and resid 24 and name HG23) 4.143 2.146 2.146 weight 1.000 ! spec=Noesy, no=1192, id=1187, vol=2.262495e+05 or (segid " A" and resid 26 and name HN) (segid " A" and resid 24 and name HG21) or (segid " A" and resid 26 and name HN) (segid " A" and resid 24 and name HG22) assign (segid " A" and resid 26 and name HE1) (segid " A" and resid 24 and name HG23) 4.140 2.142 2.142 weight 1.000 ! spec=Noesy, no=1193, id=1188, vol=2.016948e+05 or (segid " A" and resid 26 and name HE1) (segid " A" and resid 24 and name HG21) or (segid " A" and resid 26 and name HE1) (segid " A" and resid 24 and name HG22) or (segid " A" and resid 26 and name HE2) (segid " A" and resid 24 and name HG23) or (segid " A" and resid 26 and name HE2) (segid " A" and resid 24 and name HG21) or (segid " A" and resid 26 and name HE2) (segid " A" and resid 24 and name HG22) assign (segid " A" and resid 26 and name HD2) (segid " A" and resid 24 and name HG23) 4.173 2.177 2.177 weight 1.000 ! spec=Noesy, no=1194, id=1189, vol=1.996410e+05 or (segid " A" and resid 26 and name HD2) (segid " A" and resid 24 and name HG21) or (segid " A" and resid 26 and name HD2) (segid " A" and resid 24 and name HG22) or (segid " A" and resid 26 and name HD1) (segid " A" and resid 24 and name HG23) or (segid " A" and resid 26 and name HD1) (segid " A" and resid 24 and name HG21) or (segid " A" and resid 26 and name HD1) (segid " A" and resid 24 and name HG22) assign (segid " A" and resid 43 and name HE) (segid " A" and resid 24 and name HG23) 4.106 2.107 2.107 weight 1.000 ! spec=Noesy, no=1195, id=1190, vol=1.958892e+05 or (segid " A" and resid 43 and name HE) (segid " A" and resid 24 and name HG21) or (segid " A" and resid 43 and name HE) (segid " A" and resid 24 and name HG22) assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 24 and name HG23) 4.834 2.921 2.921 weight 1.000 ! spec=Noesy, no=1196, id=1191, vol=6.786325e+04 or (segid " A" and resid 42 and name HD1) (segid " A" and resid 24 and name HG21) or (segid " A" and resid 42 and name HD1) (segid " A" and resid 24 and name HG22) or (segid " A" and resid 42 and name HD2) (segid " A" and resid 24 and name HG23) or (segid " A" and resid 42 and name HD2) (segid " A" and resid 24 and name HG21) or (segid " A" and resid 42 and name HD2) (segid " A" and resid 24 and name HG22) assign (segid " A" and resid 44 and name HN) (segid " A" and resid 38 and name HG23) 4.389 2.408 2.408 weight 1.000 ! spec=Noesy, no=1197, id=1192, vol=1.415582e+05 or (segid " A" and resid 44 and name HN) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 44 and name HN) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 16 and name HN) (segid " A" and resid 38 and name HG23) 4.050 2.050 2.050 weight 1.000 ! spec=Noesy, no=1198, id=1193, vol=2.436378e+05 or (segid " A" and resid 16 and name HN) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 16 and name HN) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 16 and name HD22) (segid " A" and resid 38 and name HG23) 4.842 2.931 2.931 weight 1.000 ! spec=Noesy, no=1199, id=1194, vol=7.936075e+04 or (segid " A" and resid 16 and name HD22) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 16 and name HD22) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 38 and name HG23) 4.507 2.539 2.539 weight 1.000 ! spec=Noesy, no=1200, id=1195, vol=1.245740e+05 or (segid " A" and resid 35 and name HD21) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 35 and name HD21) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 40 and name HN) (segid " A" and resid 38 and name HG23) 3.930 1.931 1.931 weight 1.000 ! spec=Noesy, no=1201, id=1196, vol=3.116120e+05 or (segid " A" and resid 40 and name HN) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 40 and name HN) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 40 and name HN) (segid " A" and resid 38 and name HG13) 3.873 1.875 1.875 weight 1.000 ! spec=Noesy, no=1202, id=1197, vol=3.345888e+05 or (segid " A" and resid 40 and name HN) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 40 and name HN) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 35 and name HD22) (segid " A" and resid 38 and name HG13) 4.667 2.723 2.723 weight 1.000 ! spec=Noesy, no=1203, id=1198, vol=1.036835e+05 or (segid " A" and resid 35 and name HD22) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 35 and name HD22) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 5 and name HG23) 4.431 2.454 2.454 weight 1.000 ! spec=Noesy, no=1204, id=1199, vol=1.478880e+05 or (segid " A" and resid 42 and name HE2) (segid " A" and resid 5 and name HG21) or (segid " A" and resid 42 and name HE2) (segid " A" and resid 5 and name HG22) or (segid " A" and resid 42 and name HE1) (segid " A" and resid 5 and name HG23) or (segid " A" and resid 42 and name HE1) (segid " A" and resid 5 and name HG21) or (segid " A" and resid 42 and name HE1) (segid " A" and resid 5 and name HG22) assign (segid " A" and resid 4 and name HN) (segid " A" and resid 5 and name HD13) 4.785 2.862 2.862 weight 1.000 ! spec=Noesy, no=1205, id=1200, vol=7.828275e+04 or (segid " A" and resid 4 and name HN) (segid " A" and resid 5 and name HD11) or (segid " A" and resid 4 and name HN) (segid " A" and resid 5 and name HD12) assign (segid " A" and resid 22 and name HN) (segid " A" and resid 31 and name HG22) 4.721 2.786 2.786 weight 1.000 ! spec=Noesy, no=1206, id=1201, vol=9.470875e+04 or (segid " A" and resid 22 and name HN) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 22 and name HN) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 46 and name HN) (segid " A" and resid 31 and name HG22) 4.240 2.248 2.248 weight 1.000 ! spec=Noesy, no=1207, id=1202, vol=1.767975e+05 or (segid " A" and resid 46 and name HN) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 46 and name HN) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 25 and name HN) (segid " A" and resid 31 and name HG22) 4.297 2.308 2.308 weight 1.000 ! spec=Noesy, no=1208, id=1203, vol=1.495685e+05 or (segid " A" and resid 25 and name HN) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 25 and name HN) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 43 and name HN) (segid " A" and resid 31 and name HG22) 3.819 1.824 1.824 weight 1.000 ! spec=Noesy, no=1209, id=1204, vol=3.541522e+05 or (segid " A" and resid 43 and name HN) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 43 and name HN) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 34 and name HN) (segid " A" and resid 31 and name HG22) 3.975 1.975 1.975 weight 1.000 ! spec=Noesy, no=1210, id=1205, vol=2.604618e+05 or (segid " A" and resid 34 and name HN) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 34 and name HN) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 31 and name HG22) 3.716 1.726 1.726 weight 1.000 ! spec=Noesy, no=1211, id=1206, vol=3.897598e+05 or (segid " A" and resid 30 and name HD2) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 30 and name HD2) (segid " A" and resid 31 and name HG23) or (segid " A" and resid 30 and name HD1) (segid " A" and resid 31 and name HG22) or (segid " A" and resid 30 and name HD1) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 30 and name HD1) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 31 and name HG22) 4.208 2.213 2.213 weight 1.000 ! spec=Noesy, no=1212, id=1207, vol=1.742948e+05 or (segid " A" and resid 30 and name HE2) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 30 and name HE2) (segid " A" and resid 31 and name HG23) or (segid " A" and resid 30 and name HE1) (segid " A" and resid 31 and name HG22) or (segid " A" and resid 30 and name HE1) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 30 and name HE1) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 45 and name HA) (segid " A" and resid 31 and name HG22) 4.370 2.387 2.387 weight 1.000 ! spec=Noesy, no=1213, id=1208, vol=1.615130e+05 or (segid " A" and resid 45 and name HA) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 45 and name HA) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 36 and name HD21) (segid " A" and resid 36 and name HA) 4.172 2.176 2.176 weight 1.000 ! spec=Noesy, no=1214, id=1209, vol=1.943278e+05 assign (segid " A" and resid 21 and name HA) (segid " A" and resid 14 and name HB1) 4.557 2.595 2.595 weight 1.000 ! spec=Noesy, no=1215, id=1210, vol=1.104858e+05 assign (segid " A" and resid 36 and name HD21) (segid " A" and resid 33 and name HB1) 4.062 2.062 2.062 weight 1.000 ! spec=Noesy, no=1216, id=1211, vol=2.180288e+05 assign (segid " A" and resid 21 and name HA) (segid " A" and resid 42 and name HB1) 3.808 1.813 1.813 weight 1.000 ! spec=Noesy, no=1217, id=1212, vol=3.829585e+05 assign (segid " A" and resid 21 and name HA) (segid " A" and resid 39 and name HB2) 4.368 2.385 2.385 weight 1.000 ! spec=Noesy, no=1218, id=1213, vol=1.863458e+05 assign (segid " A" and resid 36 and name HD21) (segid " A" and resid 43 and name HG1) 4.282 2.292 2.292 weight 1.000 ! spec=Noesy, no=1221, id=1216, vol=1.804085e+05 assign (segid " A" and resid 21 and name HA) (segid " A" and resid 22 and name HB1) 3.775 1.781 1.781 weight 1.000 ! spec=Noesy, no=1222, id=1217, vol=4.060408e+05 assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 21 and name HN) 3.869 1.871 1.871 weight 1.000 ! spec=Noesy, no=1223, id=1218, vol=2.692798e+05 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 21 and name HN) 3.811 1.815 1.815 weight 1.000 ! spec=Noesy, no=1224, id=1219, vol=3.697982e+05 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 42 and name HN) 4.361 2.378 2.378 weight 1.000 ! spec=Noesy, no=1225, id=1220, vol=1.543770e+05 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 14 and name HN) 3.725 1.734 1.734 weight 1.000 ! spec=Noesy, no=1226, id=1221, vol=3.825575e+05 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 14 and name HN) 3.805 1.810 1.810 weight 1.000 ! spec=Noesy, no=1227, id=1222, vol=3.631212e+05 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 18 and name HN) 4.315 2.327 2.327 weight 1.000 ! spec=Noesy, no=1228, id=1223, vol=1.538592e+05 assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 20 and name HZ2) 4.434 2.458 2.458 weight 1.000 ! spec=Noesy, no=1229, id=1224, vol=1.170482e+05 assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 36 and name HN) 4.307 2.319 2.319 weight 1.000 ! spec=Noesy, no=1230, id=1225, vol=1.409478e+05 assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 34 and name HD1) 3.764 1.771 1.771 weight 1.000 ! spec=Noesy, no=1232, id=1227, vol=3.302608e+05 or (segid " A" and resid 35 and name HD21) (segid " A" and resid 34 and name HD2) assign (segid " A" and resid 15 and name HN) (segid " A" and resid 38 and name HN) 4.578 2.620 2.620 weight 1.000 ! spec=Noesy, no=1233, id=1228, vol=1.101308e+05 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 20 and name HD1) 4.287 2.297 2.297 weight 1.000 ! spec=Noesy, no=1234, id=1229, vol=1.738718e+05 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 20 and name HD1) 3.937 1.937 1.937 weight 1.000 ! spec=Noesy, no=1235, id=1230, vol=2.979995e+05 assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 42 and name HE2) 4.507 2.540 2.540 weight 1.000 ! spec=Noesy, no=1236, id=1231, vol=9.529325e+04 or (segid " A" and resid 20 and name HE1) (segid " A" and resid 42 and name HE1) assign (segid " A" and resid 22 and name HN) (segid " A" and resid 42 and name HE2) 4.421 2.443 2.443 weight 1.000 ! spec=Noesy, no=1237, id=1232, vol=1.524485e+05 or (segid " A" and resid 22 and name HN) (segid " A" and resid 42 and name HE1) assign (segid " A" and resid 22 and name HN) (segid " A" and resid 24 and name HN) 4.261 2.270 2.270 weight 1.000 ! spec=Noesy, no=1238, id=1233, vol=1.771448e+05 assign (segid " A" and resid 33 and name HE1) (segid " A" and resid 31 and name HN) 3.729 1.738 1.738 weight 1.000 ! spec=Noesy, no=1239, id=1234, vol=3.269748e+05 assign (segid " A" and resid 33 and name HE1) (segid " A" and resid 33 and name HH2) 3.525 1.553 1.553 weight 1.000 ! spec=Noesy, no=1240, id=1235, vol=4.407240e+05 assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 16 and name HN) 4.561 2.601 2.601 weight 1.000 ! spec=Noesy, no=1241, id=1236, vol=1.249535e+05 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 17 and name HN) 3.922 1.923 1.923 weight 1.000 ! spec=Noesy, no=1242, id=1237, vol=2.909325e+05 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 19 and name HN) 3.994 1.994 1.994 weight 1.000 ! spec=Noesy, no=1243, id=1238, vol=2.583230e+05 assign (segid " A" and resid 35 and name HD21) (segid " A" and resid 34 and name HN) 3.946 1.946 1.946 weight 1.000 ! spec=Noesy, no=1244, id=1239, vol=2.610312e+05 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 38 and name HN) 4.788 2.866 2.866 weight 1.000 ! spec=Noesy, no=1245, id=1240, vol=8.378625e+04 assign (segid " A" and resid 28 and name HE1) (segid " A" and resid 28 and name HD2) 3.944 1.945 1.945 weight 1.000 ! spec=Noesy, no=1247, id=1242, vol=2.692420e+05 assign (segid " A" and resid 28 and name HN) (segid " A" and resid 28 and name HD2) 3.983 1.983 1.983 weight 1.000 ! spec=Noesy, no=1248, id=1243, vol=2.739168e+05 assign (segid " A" and resid 5 and name HN) (segid " A" and resid 20 and name HH2) 4.822 2.907 2.907 weight 1.000 ! spec=Noesy, no=1249, id=1244, vol=8.861750e+04 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 20 and name HH2) 4.554 2.593 2.593 weight 1.000 ! spec=Noesy, no=1250, id=1245, vol=1.133052e+05 assign (segid " A" and resid 22 and name HE) (segid " A" and resid 26 and name HZ) 4.123 2.125 2.125 weight 1.000 ! spec=Noesy, no=1251, id=1246, vol=2.194722e+05 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 46 and name HE) 4.028 2.028 2.028 weight 1.000 ! spec=Noesy, no=1252, id=1247, vol=2.553565e+05 assign (segid " A" and resid 49 and name HN) (segid " A" and resid 49 and name HE) 4.496 2.527 2.527 weight 1.000 ! spec=Noesy, no=1253, id=1248, vol=1.050142e+05 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 33 and name HZ3) 4.839 2.927 2.927 weight 1.000 ! spec=Noesy, no=1254, id=1249, vol=8.345650e+04 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 2 and name HD1) 4.586 2.629 2.629 weight 1.000 ! spec=Noesy, no=1255, id=1250, vol=1.066498e+05 or (segid " A" and resid 17 and name HN) (segid " A" and resid 2 and name HD2) assign (segid " A" and resid 4 and name HN) (segid " A" and resid 2 and name HD1) 4.271 2.280 2.280 weight 1.000 ! spec=Noesy, no=1256, id=1251, vol=1.715142e+05 or (segid " A" and resid 4 and name HN) (segid " A" and resid 2 and name HD2) assign (segid " A" and resid 3 and name HN) (segid " A" and resid 2 and name HD1) 4.023 2.023 2.023 weight 1.000 ! spec=Noesy, no=1257, id=1252, vol=2.373350e+05 or (segid " A" and resid 3 and name HN) (segid " A" and resid 2 and name HD2) assign (segid " A" and resid 25 and name HN) (segid " A" and resid 26 and name HD2) 4.170 2.174 2.174 weight 1.000 ! spec=Noesy, no=1258, id=1253, vol=2.039085e+05 or (segid " A" and resid 25 and name HN) (segid " A" and resid 26 and name HD1) assign (segid " A" and resid 45 and name HN) (segid " A" and resid 26 and name HD2) 4.764 2.837 2.837 weight 1.000 ! spec=Noesy, no=1259, id=1254, vol=7.832550e+04 or (segid " A" and resid 45 and name HN) (segid " A" and resid 26 and name HD1) assign (segid " A" and resid 25 and name HN) (segid " A" and resid 43 and name HE) 4.144 2.147 2.147 weight 1.000 ! spec=Noesy, no=1260, id=1255, vol=1.991270e+05 assign (segid " A" and resid 43 and name HN) (segid " A" and resid 43 and name HE) 4.115 2.117 2.117 weight 1.000 ! spec=Noesy, no=1261, id=1256, vol=2.153650e+05 assign (segid " A" and resid 45 and name HN) (segid " A" and resid 20 and name HD1) 4.590 2.633 2.633 weight 1.000 ! spec=Noesy, no=1262, id=1257, vol=1.186658e+05 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD21) 4.058 2.059 2.059 weight 1.000 ! spec=Noesy, no=1263, id=1258, vol=2.563728e+05 assign (segid " A" and resid 50 and name HN) (segid " A" and resid 30 and name HD2) 3.731 3.731 2.269 weight 1.000 ! spec=Noesy, no=1264, id=1259, vol=3.886122e+05 or (segid " A" and resid 50 and name HN) (segid " A" and resid 30 and name HD1) assign (segid " A" and resid 41 and name HN) (segid " A" and resid 42 and name HE2) 4.451 2.477 2.477 weight 1.000 ! spec=Noesy, no=1265, id=1260, vol=1.347658e+05 or (segid " A" and resid 41 and name HN) (segid " A" and resid 42 and name HE1) assign (segid " A" and resid 7 and name HN) (segid " A" and resid 42 and name HE2) 4.185 2.189 2.189 weight 1.000 ! spec=Noesy, no=1267, id=1262, vol=1.804845e+05 or (segid " A" and resid 7 and name HN) (segid " A" and resid 42 and name HE1) assign (segid " A" and resid 43 and name HN) (segid " A" and resid 42 and name HE2) 3.930 1.931 1.931 weight 1.000 ! spec=Noesy, no=1268, id=1263, vol=2.933130e+05 or (segid " A" and resid 43 and name HN) (segid " A" and resid 42 and name HE1) assign (segid " A" and resid 12 and name HE1) (segid " A" and resid 12 and name HN) 4.231 2.238 2.238 weight 1.000 ! spec=Noesy, no=1269, id=1264, vol=1.474495e+05 assign (segid " A" and resid 10 and name HN) (segid " A" and resid 42 and name HD1) 4.071 2.071 2.071 weight 1.000 ! spec=Noesy, no=1270, id=1265, vol=2.282190e+05 or (segid " A" and resid 10 and name HN) (segid " A" and resid 42 and name HD2) assign (segid " A" and resid 46 and name HN) (segid " A" and resid 30 and name HE2) 3.780 1.786 1.786 weight 1.000 ! spec=Noesy, no=1271, id=1266, vol=3.785480e+05 or (segid " A" and resid 46 and name HN) (segid " A" and resid 30 and name HE1) assign (segid " A" and resid 48 and name HN) (segid " A" and resid 30 and name HE2) 3.831 1.835 1.835 weight 1.000 ! spec=Noesy, no=1272, id=1267, vol=3.324098e+05 or (segid " A" and resid 48 and name HN) (segid " A" and resid 30 and name HE1) assign (segid " A" and resid 31 and name HN) (segid " A" and resid 30 and name HE2) 4.036 2.036 2.036 weight 1.000 ! spec=Noesy, no=1273, id=1268, vol=2.482458e+05 or (segid " A" and resid 31 and name HN) (segid " A" and resid 30 and name HE1) assign (segid " A" and resid 50 and name HN) (segid " A" and resid 30 and name HE2) 4.116 2.117 2.117 weight 1.000 ! spec=Noesy, no=1274, id=1269, vol=2.015905e+05 or (segid " A" and resid 50 and name HN) (segid " A" and resid 30 and name HE1) assign (segid " A" and resid 34 and name HN) (segid " A" and resid 30 and name HE2) 4.228 2.235 2.235 weight 1.000 ! spec=Noesy, no=1275, id=1270, vol=1.704650e+05 or (segid " A" and resid 34 and name HN) (segid " A" and resid 30 and name HE1) assign (segid " A" and resid 48 and name HN) (segid " A" and resid 29 and name HN) 3.823 1.826 1.826 weight 1.000 ! spec=Noesy, no=1276, id=1271, vol=3.296675e+05 assign (segid " A" and resid 22 and name HE) (segid " A" and resid 29 and name HN) 4.647 2.699 2.699 weight 1.000 ! spec=Noesy, no=1277, id=1272, vol=1.029190e+05 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 35 and name HN) 4.532 2.568 2.568 weight 1.000 ! spec=Noesy, no=1278, id=1273, vol=1.128270e+05 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 33 and name HE3) 4.645 2.697 2.697 weight 1.000 ! spec=Noesy, no=1279, id=1274, vol=9.485425e+04 assign (segid " A" and resid 16 and name HN) (segid " A" and resid 16 and name HD22) 3.873 1.875 1.875 weight 1.000 ! spec=Noesy, no=1280, id=1275, vol=3.112850e+05 assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 13 and name HN) 4.272 2.281 2.281 weight 1.000 ! spec=Noesy, no=1281, id=1276, vol=1.492918e+05 assign (segid " A" and resid 45 and name HN) (segid " A" and resid 21 and name HN) 4.293 2.304 2.304 weight 1.000 ! spec=Noesy, no=1282, id=1277, vol=1.501085e+05 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 21 and name HN) 4.191 2.195 2.195 weight 1.000 ! spec=Noesy, no=1283, id=1278, vol=1.687960e+05 assign (segid " A" and resid 43 and name HE) (segid " A" and resid 36 and name HD21) 4.474 2.502 2.502 weight 1.000 ! spec=Noesy, no=1284, id=1279, vol=1.169252e+05 assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 21 and name HA) 3.929 1.930 1.930 weight 1.000 ! spec=Noesy, no=1285, id=1280, vol=2.404575e+05 assign (segid " A" and resid 42 and name HE2) (segid " A" and resid 21 and name HA) 4.004 2.004 2.004 weight 1.000 ! spec=Noesy, no=1286, id=1281, vol=2.232832e+05 or (segid " A" and resid 42 and name HE1) (segid " A" and resid 21 and name HA) assign (segid " A" and resid 12 and name HN) (segid " A" and resid 21 and name HA) 4.101 2.103 2.103 weight 1.000 ! spec=Noesy, no=1287, id=1282, vol=2.154385e+05 assign (segid " A" and resid 42 and name HN) (segid " A" and resid 42 and name HE2) 3.871 1.873 1.873 weight 1.000 ! spec=Noesy, no=1289, id=1284, vol=2.885698e+05 or (segid " A" and resid 42 and name HN) (segid " A" and resid 42 and name HE1) assign (segid " A" and resid 29 and name HA) (segid " A" and resid 25 and name HB1) 3.766 1.773 1.773 weight 1.000 ! spec=Noesy, no=1291, id=1286, vol=3.660082e+05 assign (segid " A" and resid 29 and name HA) (segid " A" and resid 30 and name HB2) 4.740 2.809 2.809 weight 1.000 ! spec=Noesy, no=1292, id=1287, vol=8.952875e+04 assign (segid " A" and resid 29 and name HA) (segid " A" and resid 30 and name HB1) 4.182 2.186 2.186 weight 1.000 ! spec=Noesy, no=1293, id=1288, vol=1.988190e+05 assign (segid " A" and resid 29 and name HA) (segid " A" and resid 45 and name HB1) 4.358 2.374 2.374 weight 1.000 ! spec=Noesy, no=1294, id=1289, vol=1.801300e+05 assign (segid " A" and resid 29 and name HA) (segid " A" and resid 47 and name HB2) 3.612 1.631 1.631 weight 1.000 ! spec=Noesy, no=1295, id=1290, vol=4.878060e+05 assign (segid " A" and resid 29 and name HA) (segid " A" and resid 48 and name HA1) 3.759 1.767 1.767 weight 1.000 ! spec=Noesy, no=1296, id=1291, vol=3.833530e+05 assign (segid " A" and resid 29 and name HA) (segid " A" and resid 48 and name HA2) 3.843 1.846 1.846 weight 1.000 ! spec=Noesy, no=1297, id=1292, vol=3.344670e+05 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 44 and name HN) 4.138 2.140 2.140 weight 1.000 ! spec=Noesy, no=1298, id=1293, vol=2.341400e+05 assign (segid " A" and resid 22 and name HN) (segid " A" and resid 20 and name HN) 4.652 2.705 2.705 weight 1.000 ! spec=Noesy, no=1299, id=1294, vol=9.920625e+04 assign (segid " A" and resid 46 and name HN) (segid " A" and resid 31 and name HN) 4.487 2.517 2.517 weight 1.000 ! spec=Noesy, no=1300, id=1295, vol=1.314328e+05 assign (segid " A" and resid 16 and name HN) (segid " A" and resid 19 and name HN) 4.367 2.384 2.384 weight 1.000 ! spec=Noesy, no=1301, id=1296, vol=1.401308e+05 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 36 and name HD22) 3.929 1.929 1.929 weight 1.000 ! spec=Noesy, no=1302, id=1297, vol=2.885258e+05 assign (segid " A" and resid 15 and name HN) (segid " A" and resid 35 and name HD22) 3.400 1.445 1.445 weight 1.000 ! spec=Noesy, no=1303, id=1298, vol=7.330368e+05 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 19 and name HN) 4.104 2.105 2.105 weight 1.000 ! spec=Noesy, no=1304, id=1299, vol=1.464230e+05 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 14 and name HN) 3.589 1.610 1.610 weight 1.000 ! spec=Noesy, no=1305, id=1300, vol=4.980462e+05 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 17 and name HD22) 4.133 2.135 2.135 weight 1.000 ! spec=Noesy, no=1306, id=1301, vol=2.154840e+05 assign (segid " A" and resid 20 and name HZ2) (segid " A" and resid 20 and name HZ3) 3.369 1.419 1.419 weight 1.000 ! spec=Noesy, no=1309, id=1304, vol=5.873662e+05 assign (segid " A" and resid 36 and name HD22) (segid " A" and resid 33 and name HH2) 4.329 2.342 2.342 weight 1.000 ! spec=Noesy, no=1310, id=1305, vol=1.309282e+05 assign (segid " A" and resid 29 and name HN) (segid " A" and resid 28 and name HD2) 4.308 2.319 2.319 weight 1.000 ! spec=Noesy, no=1311, id=1306, vol=1.467005e+05 assign (segid " A" and resid 35 and name HN) (segid " A" and resid 35 and name HD22) 3.788 1.794 1.794 weight 1.000 ! spec=Noesy, no=1312, id=1307, vol=3.434098e+05 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HD21) 4.610 2.657 2.657 weight 1.000 ! spec=Noesy, no=1313, id=1308, vol=9.819375e+04 assign (segid " A" and resid 26 and name HZ) (segid " A" and resid 26 and name HD2) 2.577 2.577 3.423 weight 1.000 ! spec=Noesy, no=1314, id=1309, vol=1.584364e+06 or (segid " A" and resid 26 and name HZ) (segid " A" and resid 26 and name HD1) assign (segid " A" and resid 20 and name HE3) (segid " A" and resid 20 and name HD1) 3.688 1.700 1.700 weight 1.000 ! spec=Noesy, no=1315, id=1310, vol=4.348865e+05 assign (segid " A" and resid 33 and name HN) (segid " A" and resid 30 and name HE2) 3.484 3.484 2.516 weight 1.000 ! spec=Noesy, no=1316, id=1311, vol=5.339270e+05 or (segid " A" and resid 33 and name HN) (segid " A" and resid 30 and name HE1) assign (segid " A" and resid 11 and name HN) (segid " A" and resid 12 and name HN) 3.577 1.599 1.599 weight 1.000 ! spec=Noesy, no=1317, id=1312, vol=5.245010e+05 assign (segid " A" and resid 11 and name HN) (segid " A" and resid 42 and name HE2) 3.269 1.336 1.336 weight 1.000 ! spec=Noesy, no=1318, id=1313, vol=8.755485e+05 or (segid " A" and resid 11 and name HN) (segid " A" and resid 42 and name HE1) assign (segid " A" and resid 33 and name HH2) (segid " A" and resid 36 and name HD21) 3.804 1.809 1.809 weight 1.000 ! spec=Noesy, no=1320, id=1315, vol=3.613700e+05 assign (segid " A" and resid 20 and name HE1) (segid " A" and resid 21 and name HB1) 4.025 2.025 2.025 weight 1.000 ! spec=Noesy, no=1321, id=1316, vol=2.368495e+05 assign (segid " A" and resid 20 and name HN) (segid " A" and resid 46 and name HG2) 3.255 1.324 1.324 weight 1.000 ! spec=Noesy, no=1323, id=1318, vol=9.482508e+05 assign (segid " A" and resid 32 and name HN) (segid " A" and resid 46 and name HB1) 4.016 2.016 2.016 weight 1.000 ! spec=Noesy, no=1324, id=1319, vol=2.548065e+05 assign (segid " A" and resid 12 and name HE1) (segid " A" and resid 38 and name HG13) 2.556 2.556 3.444 weight 1.000 ! spec=Noesy, no=1325, id=1320, vol=3.593744e+06 or (segid " A" and resid 12 and name HE1) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 12 and name HE1) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 5 and name HN) (segid " A" and resid 5 and name HD13) 3.954 1.954 1.954 weight 1.000 ! spec=Noesy, no=1326, id=1321, vol=3.473825e+05 or (segid " A" and resid 5 and name HN) (segid " A" and resid 5 and name HD11) or (segid " A" and resid 5 and name HN) (segid " A" and resid 5 and name HD12) assign (segid " A" and resid 16 and name HN) (segid " A" and resid 38 and name HG13) 4.310 2.322 2.322 weight 1.000 ! spec=Noesy, no=1327, id=1322, vol=1.836175e+05 or (segid " A" and resid 16 and name HN) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 16 and name HN) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 41 and name HN) (segid " A" and resid 10 and name HB2) 3.603 1.623 1.623 weight 1.000 ! spec=Noesy, no=1328, id=1323, vol=5.488058e+05 assign (segid " A" and resid 22 and name HE) (segid " A" and resid 22 and name HB2) 3.383 1.431 1.431 weight 1.000 ! spec=Noesy, no=1329, id=1324, vol=9.139422e+05 assign (segid " A" and resid 5 and name HN) (segid " A" and resid 4 and name HG1) 3.855 1.858 1.858 weight 1.000 ! spec=Noesy, no=1330, id=1325, vol=3.622878e+05 assign (segid " A" and resid 4 and name HN) (segid " A" and resid 4 and name HG1) 3.379 1.427 1.427 weight 1.000 ! spec=Noesy, no=1331, id=1326, vol=7.705435e+05 assign (segid " A" and resid 22 and name HE) (segid " A" and resid 29 and name HG1) 4.276 2.285 2.285 weight 1.000 ! spec=Noesy, no=1333, id=1328, vol=1.780048e+05 assign (segid " A" and resid 8 and name HN) (segid " A" and resid 6 and name HB2) 3.538 1.564 1.564 weight 1.000 ! spec=Noesy, no=1334, id=1329, vol=6.324558e+05 assign (segid " A" and resid 48 and name HN) (segid " A" and resid 29 and name HG2) 3.587 1.608 1.608 weight 1.000 ! spec=Noesy, no=1335, id=1330, vol=5.574895e+05 assign (segid " A" and resid 44 and name HN) (segid " A" and resid 32 and name HB1) 4.330 2.344 2.344 weight 1.000 ! spec=Noesy, no=1336, id=1331, vol=1.666132e+05 assign (segid " A" and resid 12 and name HE1) (segid " A" and resid 39 and name HB2) 4.061 2.062 2.062 weight 1.000 ! spec=Noesy, no=1337, id=1332, vol=1.904880e+05 assign (segid " A" and resid 37 and name HN) (segid " A" and resid 14 and name HB1) 4.854 2.945 2.945 weight 1.000 ! spec=Noesy, no=1340, id=1335, vol=1.053608e+05 assign (segid " A" and resid 8 and name HN) (segid " A" and resid 7 and name HB2) 3.175 1.260 1.260 weight 1.000 ! spec=Noesy, no=1341, id=1336, vol=1.222221e+06 assign (segid " A" and resid 7 and name HN) (segid " A" and resid 7 and name HB1) 2.776 0.963 0.963 weight 1.000 ! spec=Noesy, no=1342, id=1337, vol=2.382191e+06 assign (segid " A" and resid 13 and name HN) (segid " A" and resid 13 and name HB2) 2.721 0.925 0.925 weight 1.000 ! spec=Noesy, no=1343, id=1338, vol=2.592096e+06 assign (segid " A" and resid 17 and name HN) (segid " A" and resid 13 and name HB1) 3.742 1.751 1.751 weight 1.000 ! spec=Noesy, no=1344, id=1339, vol=4.003705e+05 assign (segid " A" and resid 19 and name HN) (segid " A" and resid 17 and name HA) 2.713 0.920 0.920 weight 1.000 ! spec=Noesy, no=1345, id=1340, vol=3.327642e+06 assign (segid " A" and resid 31 and name HN) (segid " A" and resid 31 and name HA) 2.682 0.899 0.899 weight 1.000 ! spec=Noesy, no=1346, id=1341, vol=3.093207e+06 assign (segid " A" and resid 33 and name HE3) (segid " A" and resid 34 and name HA) 4.089 2.090 2.090 weight 1.000 ! spec=Noesy, no=1347, id=1342, vol=2.533180e+05 assign (segid " A" and resid 21 and name HN) (segid " A" and resid 13 and name HB2) 4.256 2.264 2.264 weight 1.000 ! spec=Noesy, no=1348, id=1343, vol=1.749492e+05 assign (segid " A" and resid 14 and name HN) (segid " A" and resid 13 and name HB1) 2.715 2.715 3.285 weight 1.000 ! spec=Noesy, no=1349, id=1344, vol=2.889918e+06 assign (segid " A" and resid 35 and name HN) (segid " A" and resid 34 and name HB1) 2.542 0.808 0.808 weight 1.000 ! spec=Noesy, no=1351, id=1346, vol=4.376159e+06 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 17 and name HB1) 3.442 1.481 1.481 weight 1.000 ! spec=Noesy, no=1352, id=1347, vol=6.897482e+05 assign (segid " A" and resid 29 and name HN) (segid " A" and resid 25 and name HB2) 3.830 1.834 1.834 weight 1.000 ! spec=Noesy, no=1353, id=1348, vol=4.138670e+05 assign (segid " A" and resid 39 and name HN) (segid " A" and resid 38 and name HG13) 3.095 1.198 1.198 weight 1.000 ! spec=Noesy, no=1354, id=1349, vol=1.309602e+06 or (segid " A" and resid 39 and name HN) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 39 and name HN) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 26 and name HD2) (segid " A" and resid 29 and name HB2) 4.430 2.453 2.453 weight 1.000 ! spec=Noesy, no=1355, id=1350, vol=1.261540e+05 or (segid " A" and resid 26 and name HD1) (segid " A" and resid 29 and name HB2) assign (segid " A" and resid 30 and name HD2) (segid " A" and resid 29 and name HB1) 4.149 2.151 2.151 weight 1.000 ! spec=Noesy, no=1356, id=1351, vol=1.959125e+05 or (segid " A" and resid 30 and name HD1) (segid " A" and resid 29 and name HB1) assign (segid " A" and resid 2 and name HE1) (segid " A" and resid 19 and name HA2) 4.550 2.588 2.588 weight 1.000 ! spec=Noesy, no=1357, id=1352, vol=1.106830e+05 or (segid " A" and resid 2 and name HE2) (segid " A" and resid 19 and name HA2) assign (segid " A" and resid 20 and name HH2) (segid " A" and resid 13 and name HB2) 3.067 3.067 2.933 weight 1.000 ! spec=Noesy, no=1358, id=1353, vol=1.491666e+06 assign (segid " A" and resid 20 and name HD1) (segid " A" and resid 20 and name HA) 3.200 1.280 1.280 weight 1.000 ! spec=Noesy, no=1359, id=1354, vol=8.820880e+05 assign (segid " A" and resid 30 and name HE2) (segid " A" and resid 29 and name HB2) 3.742 3.742 2.258 weight 1.000 ! spec=Noesy, no=1360, id=1355, vol=3.798572e+05 or (segid " A" and resid 30 and name HE1) (segid " A" and resid 29 and name HB2) assign (segid " A" and resid 35 and name HA) (segid " A" and resid 38 and name HG13) 4.592 2.636 2.636 weight 1.000 ! spec=Noesy, no=1361, id=1356, vol=1.511152e+05 or (segid " A" and resid 35 and name HA) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 35 and name HA) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 35 and name HA) (segid " A" and resid 38 and name HG23) 4.544 2.581 2.581 weight 1.000 ! spec=Noesy, no=1362, id=1357, vol=1.656500e+05 or (segid " A" and resid 35 and name HA) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 35 and name HA) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 35 and name HA) (segid " A" and resid 15 and name HB3) 4.244 2.251 2.251 weight 1.000 ! spec=Noesy, no=1363, id=1358, vol=1.637690e+05 or (segid " A" and resid 35 and name HA) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 35 and name HA) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 45 and name HA) (segid " A" and resid 29 and name HB2) 4.251 2.259 2.259 weight 1.000 ! spec=Noesy, no=1365, id=1360, vol=1.808198e+05 assign (segid " A" and resid 45 and name HA) (segid " A" and resid 44 and name HA) 4.633 2.683 2.683 weight 1.000 ! spec=Noesy, no=1366, id=1361, vol=1.201030e+05 assign (segid " A" and resid 35 and name HA) (segid " A" and resid 34 and name HA) 4.255 2.263 2.263 weight 1.000 ! spec=Noesy, no=1367, id=1362, vol=1.767795e+05 assign (segid " A" and resid 21 and name HA) (segid " A" and resid 39 and name HA) 4.582 2.625 2.625 weight 1.000 ! spec=Noesy, no=1368, id=1363, vol=1.301322e+05 assign (segid " A" and resid 35 and name HA) (segid " A" and resid 15 and name HA) 4.370 2.387 2.387 weight 1.000 ! spec=Noesy, no=1369, id=1364, vol=1.419445e+05 assign (segid " A" and resid 21 and name HA) (segid " A" and resid 21 and name HB1) 3.056 1.168 1.168 weight 1.000 ! spec=Noesy, no=1370, id=1365, vol=1.328315e+06 assign (segid " A" and resid 45 and name HA) (segid " A" and resid 45 and name HB2) 3.538 1.565 1.565 weight 1.000 ! spec=Noesy, no=1372, id=1367, vol=6.124608e+05 assign (segid " A" and resid 45 and name HA) (segid " A" and resid 45 and name HB1) 3.323 1.380 1.380 weight 1.000 ! spec=Noesy, no=1373, id=1368, vol=7.971960e+05 assign (segid " A" and resid 45 and name HA) (segid " A" and resid 46 and name HB1) 4.422 2.445 2.445 weight 1.000 ! spec=Noesy, no=1375, id=1370, vol=1.301745e+05 assign (segid " A" and resid 13 and name HA) (segid " A" and resid 20 and name HA) 2.076 0.539 0.539 weight 1.000 ! spec=Noesy, no=1376, id=1371, vol=1.218425e+07 assign (segid " A" and resid 36 and name HA) (segid " A" and resid 44 and name HA) 3.854 1.857 1.857 weight 1.000 ! spec=Noesy, no=1377, id=1372, vol=3.031542e+05 assign (segid " A" and resid 36 and name HA) (segid " A" and resid 43 and name HA) 3.359 1.411 1.411 weight 1.000 ! spec=Noesy, no=1378, id=1373, vol=7.368732e+05 assign (segid " A" and resid 36 and name HA) (segid " A" and resid 39 and name HA) 4.052 2.053 2.053 weight 1.000 ! spec=Noesy, no=1379, id=1374, vol=2.311635e+05 assign (segid " A" and resid 38 and name HA) (segid " A" and resid 39 and name HA) 3.994 1.994 1.994 weight 1.000 ! spec=Noesy, no=1380, id=1375, vol=2.428082e+05 assign (segid " A" and resid 27 and name HA) (segid " A" and resid 28 and name HA) 3.155 1.244 1.244 weight 1.000 ! spec=Noesy, no=1383, id=1378, vol=1.069358e+06 assign (segid " A" and resid 27 and name HA) (segid " A" and resid 26 and name HA) 3.075 1.182 1.182 weight 1.000 ! spec=Noesy, no=1384, id=1379, vol=1.139821e+06 assign (segid " A" and resid 47 and name HD2) (segid " A" and resid 46 and name HA) 2.332 0.680 0.680 weight 1.000 ! spec=Noesy, no=1385, id=1380, vol=7.080242e+06 assign (segid " A" and resid 47 and name HD2) (segid " A" and resid 19 and name HA1) 3.169 1.256 1.256 weight 1.000 ! spec=Noesy, no=1386, id=1381, vol=1.063933e+06 assign (segid " A" and resid 13 and name HB2) (segid " A" and resid 14 and name HA) 4.184 2.188 2.188 weight 1.000 ! spec=Noesy, no=1387, id=1382, vol=2.340470e+05 assign (segid " A" and resid 13 and name HB1) (segid " A" and resid 14 and name HA) 4.176 2.180 2.180 weight 1.000 ! spec=Noesy, no=1388, id=1383, vol=2.152542e+05 assign (segid " A" and resid 47 and name HD2) (segid " A" and resid 47 and name HA) 3.952 1.952 1.952 weight 1.000 ! spec=Noesy, no=1390, id=1385, vol=3.130632e+05 assign (segid " A" and resid 48 and name HA1) (segid " A" and resid 47 and name HA) 3.878 1.880 1.880 weight 1.000 ! spec=Noesy, no=1391, id=1386, vol=2.658528e+05 assign (segid " A" and resid 13 and name HB2) (segid " A" and resid 20 and name HA) 3.489 1.521 1.521 weight 1.000 ! spec=Noesy, no=1392, id=1387, vol=6.438028e+05 assign (segid " A" and resid 13 and name HB1) (segid " A" and resid 20 and name HA) 3.639 1.655 1.655 weight 1.000 ! spec=Noesy, no=1393, id=1388, vol=4.388705e+05 assign (segid " A" and resid 47 and name HD1) (segid " A" and resid 47 and name HA) 3.861 1.864 1.864 weight 1.000 ! spec=Noesy, no=1395, id=1390, vol=3.292532e+05 assign (segid " A" and resid 23 and name HA) (segid " A" and resid 22 and name HA) 4.304 2.315 2.315 weight 1.000 ! spec=Noesy, no=1396, id=1391, vol=1.699398e+05 assign (segid " A" and resid 14 and name HB1) (segid " A" and resid 14 and name HA) 3.055 1.167 1.167 weight 1.000 ! spec=Noesy, no=1397, id=1392, vol=2.777773e+06 assign (segid " A" and resid 40 and name HA1) (segid " A" and resid 39 and name HA) 3.951 1.951 1.951 weight 1.000 ! spec=Noesy, no=1398, id=1393, vol=2.919955e+05 assign (segid " A" and resid 26 and name HB2) (segid " A" and resid 26 and name HA) 3.202 1.281 1.281 weight 1.000 ! spec=Noesy, no=1399, id=1394, vol=1.767600e+06 assign (segid " A" and resid 19 and name HA2) (segid " A" and resid 46 and name HA) 3.556 1.581 1.581 weight 1.000 ! spec=Noesy, no=1400, id=1395, vol=8.277580e+05 assign (segid " A" and resid 19 and name HA2) (segid " A" and resid 19 and name HA1) 2.386 0.712 0.712 weight 1.000 ! spec=Noesy, no=1401, id=1396, vol=9.890746e+06 assign (segid " A" and resid 26 and name HB2) (segid " A" and resid 25 and name HA) 4.438 2.462 2.462 weight 1.000 ! spec=Noesy, no=1402, id=1397, vol=2.036590e+05 assign (segid " A" and resid 14 and name HB1) (segid " A" and resid 44 and name HA) 4.233 2.240 2.240 weight 1.000 ! spec=Noesy, no=1403, id=1398, vol=1.565318e+05 assign (segid " A" and resid 18 and name HD1) (segid " A" and resid 18 and name HA) 3.293 1.356 1.356 weight 1.000 ! spec=Noesy, no=1404, id=1399, vol=9.759645e+05 assign (segid " A" and resid 21 and name HB1) (segid " A" and resid 20 and name HA) 3.983 1.983 1.983 weight 1.000 ! spec=Noesy, no=1405, id=1400, vol=2.388440e+05 assign (segid " A" and resid 21 and name HB1) (segid " A" and resid 11 and name HB1) 4.374 2.392 2.392 weight 1.000 ! spec=Noesy, no=1407, id=1402, vol=1.279562e+05 assign (segid " A" and resid 8 and name HB1) (segid " A" and resid 8 and name HA) 3.047 1.161 1.161 weight 1.000 ! spec=Noesy, no=1408, id=1403, vol=1.765174e+06 assign (segid " A" and resid 21 and name HB2) (segid " A" and resid 39 and name HA) 3.292 1.354 1.354 weight 1.000 ! spec=Noesy, no=1409, id=1404, vol=1.347004e+06 assign (segid " A" and resid 46 and name HD1) (segid " A" and resid 46 and name HA) 3.867 1.869 1.869 weight 1.000 ! spec=Noesy, no=1410, id=1405, vol=3.491718e+05 assign (segid " A" and resid 47 and name HG2) (segid " A" and resid 19 and name HA1) 4.448 2.473 2.473 weight 1.000 ! spec=Noesy, no=1411, id=1406, vol=1.679320e+05 assign (segid " A" and resid 32 and name HB1) (segid " A" and resid 32 and name HA) 3.248 1.318 1.318 weight 1.000 ! spec=Noesy, no=1413, id=1408, vol=1.386374e+06 assign (segid " A" and resid 46 and name HB2) (segid " A" and resid 19 and name HA1) 4.319 2.332 2.332 weight 1.000 ! spec=Noesy, no=1414, id=1409, vol=2.056642e+05 assign (segid " A" and resid 18 and name HG2) (segid " A" and resid 18 and name HA) 2.732 0.933 0.933 weight 1.000 ! spec=Noesy, no=1415, id=1410, vol=2.865478e+06 assign (segid " A" and resid 43 and name HG1) (segid " A" and resid 42 and name HA) 4.075 2.076 2.076 weight 1.000 ! spec=Noesy, no=1416, id=1411, vol=2.343388e+05 assign (segid " A" and resid 24 and name HG23) (segid " A" and resid 25 and name HA) 3.938 1.939 1.939 weight 1.000 ! spec=Noesy, no=1417, id=1412, vol=2.881170e+05 or (segid " A" and resid 24 and name HG21) (segid " A" and resid 25 and name HA) or (segid " A" and resid 24 and name HG22) (segid " A" and resid 25 and name HA) assign (segid " A" and resid 38 and name HG13) (segid " A" and resid 39 and name HA) 3.734 1.743 1.743 weight 1.000 ! spec=Noesy, no=1418, id=1413, vol=3.806018e+05 or (segid " A" and resid 38 and name HG12) (segid " A" and resid 39 and name HA) or (segid " A" and resid 38 and name HG11) (segid " A" and resid 39 and name HA) assign (segid " A" and resid 46 and name HB1) (segid " A" and resid 46 and name HA) 3.205 1.284 1.284 weight 1.000 ! spec=Noesy, no=1419, id=1414, vol=1.134073e+06 assign (segid " A" and resid 46 and name HB1) (segid " A" and resid 19 and name HA1) 4.665 2.721 2.721 weight 1.000 ! spec=Noesy, no=1420, id=1415, vol=1.384308e+05 assign (segid " A" and resid 31 and name HG22) (segid " A" and resid 32 and name HA) 3.260 1.329 1.329 weight 1.000 ! spec=Noesy, no=1421, id=1416, vol=8.747725e+05 or (segid " A" and resid 31 and name HG21) (segid " A" and resid 32 and name HA) or (segid " A" and resid 31 and name HG23) (segid " A" and resid 32 and name HA) assign (segid " A" and resid 31 and name HG22) (segid " A" and resid 44 and name HA) 4.416 2.438 2.438 weight 1.000 ! spec=Noesy, no=1422, id=1417, vol=1.424472e+05 or (segid " A" and resid 31 and name HG21) (segid " A" and resid 44 and name HA) or (segid " A" and resid 31 and name HG23) (segid " A" and resid 44 and name HA) assign (segid " A" and resid 31 and name HG22) (segid " A" and resid 43 and name HA) 3.181 1.265 1.265 weight 1.000 ! spec=Noesy, no=1423, id=1418, vol=9.876178e+05 or (segid " A" and resid 31 and name HG21) (segid " A" and resid 43 and name HA) or (segid " A" and resid 31 and name HG23) (segid " A" and resid 43 and name HA) assign (segid " A" and resid 36 and name HA) (segid " A" and resid 31 and name HG22) 3.901 1.902 1.902 weight 1.000 ! spec=Noesy, no=1424, id=1419, vol=2.970265e+05 or (segid " A" and resid 36 and name HA) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 36 and name HA) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 24 and name HA) (segid " A" and resid 31 and name HG22) 4.779 2.855 2.855 weight 1.000 ! spec=Noesy, no=1425, id=1420, vol=1.111028e+05 or (segid " A" and resid 24 and name HA) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 24 and name HA) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 4 and name HA) (segid " A" and resid 5 and name HG23) 4.590 2.633 2.633 weight 1.000 ! spec=Noesy, no=1427, id=1422, vol=1.238522e+05 or (segid " A" and resid 4 and name HA) (segid " A" and resid 5 and name HG21) or (segid " A" and resid 4 and name HA) (segid " A" and resid 5 and name HG22) assign (segid " A" and resid 36 and name HA) (segid " A" and resid 38 and name HG13) 3.831 1.834 1.834 weight 1.000 ! spec=Noesy, no=1428, id=1423, vol=3.797965e+05 or (segid " A" and resid 36 and name HA) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 36 and name HA) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 15 and name HA) (segid " A" and resid 38 and name HG23) 3.924 1.924 1.924 weight 1.000 ! spec=Noesy, no=1430, id=1425, vol=2.990598e+05 or (segid " A" and resid 15 and name HA) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 15 and name HA) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 14 and name HB1) (segid " A" and resid 38 and name HG13) 3.926 1.927 1.927 weight 1.000 ! spec=Noesy, no=1431, id=1426, vol=7.198505e+05 or (segid " A" and resid 14 and name HB1) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 14 and name HB1) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 14 and name HB1) (segid " A" and resid 38 and name HG23) 3.223 1.298 1.298 weight 1.000 ! spec=Noesy, no=1432, id=1427, vol=1.957067e+06 or (segid " A" and resid 14 and name HB1) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 14 and name HB1) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 14 and name HB1) (segid " A" and resid 15 and name HB3) 6.139 4.711 4.711 weight 1.000 ! spec=Noesy, no=1433, id=1428, vol=1.181530e+05 or (segid " A" and resid 14 and name HB1) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 14 and name HB1) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 4 and name HA) (segid " A" and resid 5 and name HG12) 4.319 2.332 2.332 weight 1.000 ! spec=Noesy, no=1435, id=1430, vol=1.518655e+05 assign (segid " A" and resid 31 and name HA) (segid " A" and resid 43 and name HG1) 4.354 2.369 2.369 weight 1.000 ! spec=Noesy, no=1436, id=1431, vol=1.465168e+05 assign (segid " A" and resid 11 and name HB2) (segid " A" and resid 10 and name HB2) 4.936 3.046 3.046 weight 1.000 ! spec=Noesy, no=1437, id=1432, vol=1.023735e+05 assign (segid " A" and resid 50 and name HA) (segid " A" and resid 50 and name HB1) 3.510 1.540 1.540 weight 1.000 ! spec=Noesy, no=1438, id=1433, vol=9.361792e+05 assign (segid " A" and resid 23 and name HA) (segid " A" and resid 43 and name HG1) 4.267 2.276 2.276 weight 1.000 ! spec=Noesy, no=1439, id=1434, vol=1.788092e+05 assign (segid " A" and resid 31 and name HB) (segid " A" and resid 43 and name HB2) 3.916 1.917 1.917 weight 1.000 ! spec=Noesy, no=1440, id=1435, vol=3.136022e+05 assign (segid " A" and resid 6 and name HA) (segid " A" and resid 6 and name HG2) 3.381 1.429 1.429 weight 1.000 ! spec=Noesy, no=1441, id=1436, vol=8.224450e+05 assign (segid " A" and resid 24 and name HA) (segid " A" and resid 23 and name HB2) 3.892 1.894 1.894 weight 1.000 ! spec=Noesy, no=1444, id=1439, vol=3.194682e+05 assign (segid " A" and resid 6 and name HA) (segid " A" and resid 6 and name HB1) 2.966 1.099 1.099 weight 1.000 ! spec=Noesy, no=1445, id=1440, vol=7.154695e+05 assign (segid " A" and resid 31 and name HA) (segid " A" and resid 32 and name HB1) 3.539 1.565 1.565 weight 1.000 ! spec=Noesy, no=1446, id=1441, vol=5.602558e+05 assign (segid " A" and resid 24 and name HA) (segid " A" and resid 23 and name HG1) 4.127 2.129 2.129 weight 1.000 ! spec=Noesy, no=1447, id=1442, vol=1.925998e+05 assign (segid " A" and resid 26 and name HB2) (segid " A" and resid 29 and name HG2) 4.259 2.268 2.268 weight 1.000 ! spec=Noesy, no=1448, id=1443, vol=3.625765e+05 assign (segid " A" and resid 47 and name HD1) (segid " A" and resid 47 and name HB1) 3.163 1.250 1.250 weight 1.000 ! spec=Noesy, no=1449, id=1444, vol=1.186926e+06 assign (segid " A" and resid 48 and name HA2) (segid " A" and resid 47 and name HB1) 4.333 2.347 2.347 weight 1.000 ! spec=Noesy, no=1451, id=1446, vol=2.068398e+05 assign (segid " A" and resid 14 and name HB1) (segid " A" and resid 38 and name HB) 5.080 3.225 3.225 weight 1.000 ! spec=Noesy, no=1452, id=1447, vol=1.280635e+05 assign (segid " A" and resid 15 and name HA) (segid " A" and resid 16 and name HB1) 3.915 1.916 1.916 weight 1.000 ! spec=Noesy, no=1453, id=1448, vol=2.982608e+05 assign (segid " A" and resid 40 and name HA2) (segid " A" and resid 10 and name HB1) 4.119 2.121 2.121 weight 1.000 ! spec=Noesy, no=1454, id=1449, vol=2.479878e+05 assign (segid " A" and resid 13 and name HB2) (segid " A" and resid 12 and name HB2) 3.743 1.751 1.751 weight 1.000 ! spec=Noesy, no=1455, id=1450, vol=3.865452e+05 assign (segid " A" and resid 13 and name HB1) (segid " A" and resid 12 and name HB2) 3.867 1.869 1.869 weight 1.000 ! spec=Noesy, no=1456, id=1451, vol=3.684720e+05 assign (segid " A" and resid 14 and name HB1) (segid " A" and resid 14 and name HB2) 2.519 0.793 0.793 weight 1.000 ! spec=Noesy, no=1458, id=1453, vol=8.590335e+06 assign (segid " A" and resid 14 and name HB1) (segid " A" and resid 44 and name HB2) 4.576 2.617 2.617 weight 1.000 ! spec=Noesy, no=1459, id=1454, vol=2.299062e+05 assign (segid " A" and resid 36 and name HA) (segid " A" and resid 35 and name HB2) 3.844 1.847 1.847 weight 1.000 ! spec=Noesy, no=1461, id=1456, vol=3.531538e+05 assign (segid " A" and resid 13 and name HB2) (segid " A" and resid 17 and name HB2) 3.865 1.867 1.867 weight 1.000 ! spec=Noesy, no=1463, id=1458, vol=3.090492e+05 assign (segid " A" and resid 14 and name HB1) (segid " A" and resid 35 and name HB2) 5.270 3.472 3.472 weight 1.000 ! spec=Noesy, no=1466, id=1461, vol=4.445725e+04 assign (segid " A" and resid 31 and name HB) (segid " A" and resid 30 and name HB2) 3.878 1.880 1.880 weight 1.000 ! spec=Noesy, no=1467, id=1462, vol=3.182132e+05 assign (segid " A" and resid 24 and name HA) (segid " A" and resid 23 and name HD1) 4.181 2.186 2.186 weight 1.000 ! spec=Noesy, no=1469, id=1464, vol=2.143692e+05 assign (segid " A" and resid 13 and name HB1) (segid " A" and resid 12 and name HB1) 4.554 2.592 2.592 weight 1.000 ! spec=Noesy, no=1470, id=1465, vol=1.480478e+05 assign (segid " A" and resid 48 and name HA1) (segid " A" and resid 48 and name HA2) 1.782 0.397 0.397 weight 1.000 ! spec=Noesy, no=1472, id=1467, vol=3.412434e+07 assign (segid " A" and resid 41 and name HB2) (segid " A" and resid 41 and name HA) 2.750 0.945 0.945 weight 1.000 ! spec=Noesy, no=1473, id=1468, vol=2.796729e+06 assign (segid " A" and resid 11 and name HA) (segid " A" and resid 11 and name HB1) 2.502 0.782 0.782 weight 1.000 ! spec=Noesy, no=1474, id=1469, vol=3.600012e+06 assign (segid " A" and resid 19 and name HA2) (segid " A" and resid 34 and name HB1) 4.780 2.856 2.856 weight 1.000 ! spec=Noesy, no=1475, id=1470, vol=1.854530e+05 assign (segid " A" and resid 12 and name HB1) (segid " A" and resid 12 and name HB2) 2.416 0.730 0.730 weight 1.000 ! spec=Noesy, no=1476, id=1471, vol=8.686706e+06 assign (segid " A" and resid 42 and name HB1) (segid " A" and resid 21 and name HB2) 2.955 1.092 1.092 weight 1.000 ! spec=Noesy, no=1477, id=1472, vol=1.926893e+06 assign (segid " A" and resid 19 and name HA2) (segid " A" and resid 46 and name HD1) 3.901 1.903 1.903 weight 1.000 ! spec=Noesy, no=1478, id=1473, vol=4.237855e+05 assign (segid " A" and resid 19 and name HA2) (segid " A" and resid 20 and name HB1) 4.601 2.646 2.646 weight 1.000 ! spec=Noesy, no=1479, id=1474, vol=1.887402e+05 assign (segid " A" and resid 42 and name HB1) (segid " A" and resid 39 and name HB1) 2.978 1.109 1.109 weight 1.000 ! spec=Noesy, no=1480, id=1475, vol=1.920388e+06 assign (segid " A" and resid 21 and name HB1) (segid " A" and resid 21 and name HB2) 2.315 0.670 0.670 weight 1.000 ! spec=Noesy, no=1481, id=1476, vol=7.212302e+06 assign (segid " A" and resid 25 and name HB1) (segid " A" and resid 45 and name HB1) 3.812 1.816 1.816 weight 1.000 ! spec=Noesy, no=1482, id=1477, vol=5.502012e+05 assign (segid " A" and resid 42 and name HB1) (segid " A" and resid 39 and name HB2) 3.512 1.542 1.542 weight 1.000 ! spec=Noesy, no=1483, id=1478, vol=6.617610e+05 assign (segid " A" and resid 8 and name HB1) (segid " A" and resid 8 and name HB2) 1.816 0.412 0.412 weight 1.000 ! spec=Noesy, no=1484, id=1479, vol=3.044107e+07 assign (segid " A" and resid 39 and name HB1) (segid " A" and resid 39 and name HB2) 1.990 0.495 0.495 weight 1.000 ! spec=Noesy, no=1485, id=1480, vol=1.549488e+07 assign (segid " A" and resid 26 and name HB2) (segid " A" and resid 26 and name HB1) 2.738 0.937 0.937 weight 1.000 ! spec=Noesy, no=1486, id=1481, vol=5.736794e+06 assign (segid " A" and resid 44 and name HB2) (segid " A" and resid 35 and name HB1) 3.508 1.538 1.538 weight 1.000 ! spec=Noesy, no=1487, id=1482, vol=6.433260e+05 assign (segid " A" and resid 45 and name HB2) (segid " A" and resid 29 and name HB1) 3.497 1.529 1.529 weight 1.000 ! spec=Noesy, no=1488, id=1483, vol=6.767438e+05 assign (segid " A" and resid 45 and name HB1) (segid " A" and resid 29 and name HB1) 3.685 1.697 1.697 weight 1.000 ! spec=Noesy, no=1489, id=1484, vol=6.338528e+05 assign (segid " A" and resid 44 and name HB1) (segid " A" and resid 35 and name HB1) 3.408 1.452 1.452 weight 1.000 ! spec=Noesy, no=1490, id=1485, vol=6.443038e+05 assign (segid " A" and resid 23 and name HD1) (segid " A" and resid 23 and name HB1) 3.490 1.522 1.522 weight 1.000 ! spec=Noesy, no=1491, id=1486, vol=6.699710e+05 assign (segid " A" and resid 26 and name HB2) (segid " A" and resid 29 and name HG1) 4.797 2.876 2.876 weight 1.000 ! spec=Noesy, no=1492, id=1487, vol=1.554208e+05 assign (segid " A" and resid 16 and name HB2) (segid " A" and resid 18 and name HG2) 5.000 3.125 3.125 weight 1.000 ! spec=Noesy, no=1494, id=1489, vol=1.419392e+05 assign (segid " A" and resid 45 and name HB1) (segid " A" and resid 29 and name HG1) 4.247 2.255 2.255 weight 1.000 ! spec=Noesy, no=1495, id=1490, vol=2.586928e+05 assign (segid " A" and resid 45 and name HB2) (segid " A" and resid 29 and name HG1) 4.108 2.110 2.110 weight 1.000 ! spec=Noesy, no=1496, id=1491, vol=2.475288e+05 assign (segid " A" and resid 30 and name HB1) (segid " A" and resid 29 and name HB2) 4.452 2.477 2.477 weight 1.000 ! spec=Noesy, no=1497, id=1492, vol=2.015530e+05 assign (segid " A" and resid 45 and name HB1) (segid " A" and resid 29 and name HB2) 3.259 1.328 1.328 weight 1.000 ! spec=Noesy, no=1498, id=1493, vol=1.284050e+06 assign (segid " A" and resid 19 and name HA2) (segid " A" and resid 15 and name HB3) 3.147 1.238 1.238 weight 1.000 ! spec=Noesy, no=1502, id=1497, vol=1.915636e+06 or (segid " A" and resid 19 and name HA2) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 19 and name HA2) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 18 and name HD2) (segid " A" and resid 15 and name HB3) 3.964 1.964 1.964 weight 1.000 ! spec=Noesy, no=1503, id=1498, vol=2.752082e+05 or (segid " A" and resid 18 and name HD2) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 18 and name HD2) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 16 and name HB2) (segid " A" and resid 15 and name HB3) 4.970 3.088 3.088 weight 1.000 ! spec=Noesy, no=1504, id=1499, vol=1.251890e+05 or (segid " A" and resid 16 and name HB2) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 16 and name HB2) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 43 and name HD2) (segid " A" and resid 24 and name HG23) 3.817 1.821 1.821 weight 1.000 ! spec=Noesy, no=1505, id=1500, vol=3.521640e+05 or (segid " A" and resid 43 and name HD2) (segid " A" and resid 24 and name HG21) or (segid " A" and resid 43 and name HD2) (segid " A" and resid 24 and name HG22) assign (segid " A" and resid 35 and name HB2) (segid " A" and resid 38 and name HG23) 4.130 2.132 2.132 weight 1.000 ! spec=Noesy, no=1506, id=1501, vol=4.625692e+05 or (segid " A" and resid 35 and name HB2) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 35 and name HB2) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 35 and name HB2) (segid " A" and resid 38 and name HG13) 4.233 2.240 2.240 weight 1.000 ! spec=Noesy, no=1507, id=1502, vol=3.086238e+05 or (segid " A" and resid 35 and name HB2) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 35 and name HB2) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 37 and name HB2) (segid " A" and resid 38 and name HG13) 3.565 1.589 1.589 weight 1.000 ! spec=Noesy, no=1509, id=1504, vol=8.800280e+05 or (segid " A" and resid 37 and name HB2) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 37 and name HB2) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 8 and name HB2) (segid " A" and resid 5 and name HG23) 5.650 3.991 3.991 weight 1.000 ! spec=Noesy, no=1510, id=1505, vol=5.762900e+04 or (segid " A" and resid 8 and name HB2) (segid " A" and resid 5 and name HG21) or (segid " A" and resid 8 and name HB2) (segid " A" and resid 5 and name HG22) assign (segid " A" and resid 19 and name HA2) (segid " A" and resid 46 and name HB1) 4.744 2.814 2.814 weight 1.000 ! spec=Noesy, no=1511, id=1506, vol=1.517838e+05 assign (segid " A" and resid 32 and name HB2) (segid " A" and resid 31 and name HG22) 4.021 2.021 2.021 weight 1.000 ! spec=Noesy, no=1512, id=1507, vol=2.465870e+05 or (segid " A" and resid 32 and name HB2) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 32 and name HB2) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 32 and name HB1) (segid " A" and resid 31 and name HG22) 5.849 4.276 4.276 weight 1.000 ! spec=Noesy, no=1513, id=1508, vol=8.118100e+04 or (segid " A" and resid 32 and name HB1) (segid " A" and resid 31 and name HG21) or (segid " A" and resid 32 and name HB1) (segid " A" and resid 31 and name HG23) assign (segid " A" and resid 32 and name HB2) (segid " A" and resid 46 and name HB1) 4.671 2.728 2.728 weight 1.000 ! spec=Noesy, no=1514, id=1509, vol=1.363575e+05 assign (segid " A" and resid 32 and name HB1) (segid " A" and resid 46 and name HB1) 5.179 3.353 3.353 weight 1.000 ! spec=Noesy, no=1515, id=1510, vol=1.730258e+05 assign (segid " A" and resid 5 and name HB) (segid " A" and resid 5 and name HD13) 3.402 1.446 1.446 weight 1.000 ! spec=Noesy, no=1516, id=1511, vol=8.490448e+05 or (segid " A" and resid 5 and name HB) (segid " A" and resid 5 and name HD11) or (segid " A" and resid 5 and name HB) (segid " A" and resid 5 and name HD12) assign (segid " A" and resid 23 and name HB1) (segid " A" and resid 24 and name HG23) 3.870 1.872 1.872 weight 1.000 ! spec=Noesy, no=1517, id=1512, vol=3.205515e+05 or (segid " A" and resid 23 and name HB1) (segid " A" and resid 24 and name HG21) or (segid " A" and resid 23 and name HB1) (segid " A" and resid 24 and name HG22) assign (segid " A" and resid 38 and name HB) (segid " A" and resid 38 and name HG23) 2.411 0.727 0.727 weight 1.000 ! spec=Noesy, no=1518, id=1513, vol=6.419141e+06 or (segid " A" and resid 38 and name HB) (segid " A" and resid 38 and name HG22) or (segid " A" and resid 38 and name HB) (segid " A" and resid 38 and name HG21) assign (segid " A" and resid 18 and name HG2) (segid " A" and resid 15 and name HB3) 3.739 1.747 1.747 weight 1.000 ! spec=Noesy, no=1519, id=1514, vol=3.902152e+05 or (segid " A" and resid 18 and name HG2) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 18 and name HG2) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 32 and name HB1) (segid " A" and resid 46 and name HG2) 3.705 1.716 1.716 weight 1.000 ! spec=Noesy, no=1520, id=1515, vol=6.216538e+05 assign (segid " A" and resid 32 and name HB1) (segid " A" and resid 46 and name HG1) 3.782 1.788 1.788 weight 1.000 ! spec=Noesy, no=1521, id=1516, vol=5.861420e+05 assign (segid " A" and resid 23 and name HG1) (segid " A" and resid 22 and name HB2) 3.886 1.888 1.888 weight 1.000 ! spec=Noesy, no=1522, id=1517, vol=3.335760e+05 assign (segid " A" and resid 16 and name HB1) (segid " A" and resid 15 and name HB3) 4.454 2.480 2.480 weight 1.000 ! spec=Noesy, no=1523, id=1518, vol=1.515785e+05 or (segid " A" and resid 16 and name HB1) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 16 and name HB1) (segid " A" and resid 15 and name HB1) assign (segid " A" and resid 6 and name HB2) (segid " A" and resid 6 and name HG1) 2.375 0.705 0.705 weight 1.000 ! spec=Noesy, no=1525, id=1520, vol=6.316173e+06 assign (segid " A" and resid 6 and name HB1) (segid " A" and resid 6 and name HG1) 1.890 1.890 4.110 weight 1.000 ! spec=Noesy, no=1527, id=1522, vol=2.630245e+07 assign (segid " A" and resid 50 and name HB2) (segid " A" and resid 50 and name HB1) 2.021 0.511 0.511 weight 1.000 ! spec=Noesy, no=1528, id=1523, vol=1.857376e+07 assign (segid " A" and resid 16 and name HB1) (segid " A" and resid 18 and name HG1) 4.596 2.641 2.641 weight 1.000 ! spec=Noesy, no=1529, id=1524, vol=1.415705e+05 assign (segid " A" and resid 16 and name HB1) (segid " A" and resid 18 and name HG2) 4.430 2.454 2.454 weight 1.000 ! spec=Noesy, no=1530, id=1525, vol=1.763938e+05 assign (segid " A" and resid 39 and name HB2) (segid " A" and resid 10 and name HB1) 4.238 2.245 2.245 weight 1.000 ! spec=Noesy, no=1531, id=1526, vol=2.342322e+05 assign (segid " A" and resid 47 and name HG2) (segid " A" and resid 47 and name HG1) 2.025 0.513 0.513 weight 1.000 ! spec=Noesy, no=1532, id=1527, vol=1.555908e+07 assign (segid " A" and resid 47 and name HG1) (segid " A" and resid 47 and name HB1) 2.379 0.708 0.708 weight 1.000 ! spec=Noesy, no=1533, id=1528, vol=5.938200e+06 assign (segid " A" and resid 3 and name HB1) (segid " A" and resid 3 and name HB2) 1.779 0.396 0.396 weight 1.000 ! spec=Noesy, no=1534, id=1529, vol=3.615090e+07 assign (segid " A" and resid 5 and name HG11) (segid " A" and resid 5 and name HG23) 3.033 1.150 1.150 weight 1.000 ! spec=Noesy, no=1535, id=1530, vol=1.680196e+06 or (segid " A" and resid 5 and name HG11) (segid " A" and resid 5 and name HG21) or (segid " A" and resid 5 and name HG11) (segid " A" and resid 5 and name HG22) assign (segid " A" and resid 5 and name HG12) (segid " A" and resid 5 and name HD13) 3.619 1.637 1.637 weight 1.000 ! spec=Noesy, no=1536, id=1531, vol=8.791335e+05 or (segid " A" and resid 5 and name HG12) (segid " A" and resid 5 and name HD11) or (segid " A" and resid 5 and name HG12) (segid " A" and resid 5 and name HD12) assign (segid " A" and resid 5 and name HG12) (segid " A" and resid 5 and name HG23) 3.098 1.199 1.199 weight 1.000 ! spec=Noesy, no=1537, id=1532, vol=1.374329e+06 or (segid " A" and resid 5 and name HG12) (segid " A" and resid 5 and name HG21) or (segid " A" and resid 5 and name HG12) (segid " A" and resid 5 and name HG22) assign (segid " A" and resid 2 and name HN) (segid " A" and resid 39 and name HN) 4.117 2.119 2.119 weight 1.000 ! spec=Noesy, no=1538, id=1533, vol=2.402590e+05 assign (segid " A" and resid 26 and name HN) (segid " A" and resid 24 and name HN) 4.694 2.754 2.754 weight 1.000 ! spec=Noesy, no=1544, id=1536, vol=1.043358e+05 assign (segid " A" and resid 16 and name HN) (segid " A" and resid 17 and name HD21) 3.700 3.700 2.300 weight 1.000 ! spec=Noesy, no=1545, id=1537, vol=4.338450e+05 assign (segid " A" and resid 30 and name HN) (segid " A" and resid 48 and name HA1) 3.940 1.940 1.940 weight 1.000 ! spec=Noesy, no=1554, id=1541, vol=2.779018e+05 assign (segid " A" and resid 20 and name HZ2) (segid " A" and resid 20 and name HA) 2.687 2.687 3.313 weight 1.000 ! spec=Noesy, no=1567, id=1546, vol=3.052155e+06 assign (segid " A" and resid 36 and name HD22) (segid " A" and resid 37 and name HA) 4.325 2.338 2.338 weight 1.000 ! spec=Noesy, no=1568, id=1547, vol=1.331192e+05 assign (segid " A" and resid 39 and name HN) (segid " A" and resid 36 and name HA) 3.352 1.405 1.405 weight 1.000 ! spec=Noesy, no=1569, id=1548, vol=8.036102e+05 assign (segid " A" and resid 36 and name HD22) (segid " A" and resid 36 and name HB2) 2.615 0.854 0.854 weight 1.000 ! spec=Noesy, no=1576, id=1552, vol=3.184744e+06 assign (segid " A" and resid 18 and name HN) (segid " A" and resid 46 and name HD1) 4.536 2.572 2.572 weight 1.000 ! spec=Noesy, no=1577, id=1553, vol=1.182742e+05 assign (segid " A" and resid 42 and name HD1) (segid " A" and resid 10 and name HB1) 2.682 0.899 0.899 weight 1.000 ! spec=Noesy, no=1578, id=1554, vol=2.976554e+06 or (segid " A" and resid 42 and name HD2) (segid " A" and resid 10 and name HB1) assign (segid " A" and resid 50 and name HN) (segid " A" and resid 49 and name HB2) 3.031 3.031 2.969 weight 1.000 ! spec=Noesy, no=1582, id=1557, vol=1.432981e+06 assign (segid " A" and resid 35 and name HN) (segid " A" and resid 38 and name HG13) 4.007 2.007 2.007 weight 1.000 ! spec=Noesy, no=1585, id=1559, vol=2.692430e+05 or (segid " A" and resid 35 and name HN) (segid " A" and resid 38 and name HG12) or (segid " A" and resid 35 and name HN) (segid " A" and resid 38 and name HG11) assign (segid " A" and resid 9 and name HB2) (segid " A" and resid 8 and name HA) 4.073 2.073 2.073 weight 1.000 ! spec=Noesy, no=1588, id=1560, vol=2.384312e+05 assign (segid " A" and resid 40 and name HA1) (segid " A" and resid 41 and name HA) 4.151 2.154 2.154 weight 1.000 ! spec=Noesy, no=1589, id=1561, vol=2.149032e+05 assign (segid " A" and resid 33 and name HB1) (segid " A" and resid 34 and name HA) 3.975 1.975 1.975 weight 1.000 ! spec=Noesy, no=1590, id=1562, vol=2.545888e+05 assign (segid " A" and resid 14 and name HB2) (segid " A" and resid 14 and name HA) 2.418 0.731 0.731 weight 1.000 ! spec=Noesy, no=1591, id=1563, vol=4.594562e+06 assign (segid " A" and resid 29 and name HG1) (segid " A" and resid 46 and name HA) 4.370 2.388 2.388 weight 1.000 ! spec=Noesy, no=1593, id=1565, vol=1.587090e+05 assign (segid " A" and resid 49 and name HA) (segid " A" and resid 49 and name HB2) 2.709 0.917 0.917 weight 1.000 ! spec=Noesy, no=1601, id=1572, vol=2.853648e+06 assign (segid " A" and resid 13 and name HB1) (segid " A" and resid 13 and name HA) 2.038 0.519 0.519 weight 1.000 ! spec=Noesy, no=1616, id=1587, vol=1.365060e+07 assign (segid " A" and resid 42 and name HB1) (segid " A" and resid 10 and name HB1) 3.440 1.479 1.479 weight 1.000 ! spec=Noesy, no=1618, id=1589, vol=6.755515e+05 assign (segid " A" and resid 44 and name HB2) (segid " A" and resid 32 and name HB2) 2.991 1.119 1.119 weight 1.000 ! spec=Noesy, no=1620, id=1591, vol=1.471910e+06 assign (segid " A" and resid 46 and name HD1) (segid " A" and resid 32 and name HB2) 3.169 1.255 1.255 weight 1.000 ! spec=Noesy, no=1621, id=1592, vol=1.124638e+06 assign (segid " A" and resid 44 and name HB1) (segid " A" and resid 32 and name HB2) 2.999 1.124 1.124 weight 1.000 ! spec=Noesy, no=1624, id=1595, vol=1.422266e+06 assign (segid " A" and resid 44 and name HB2) (segid " A" and resid 32 and name HB1) 3.371 1.420 1.420 weight 1.000 ! spec=Noesy, no=1626, id=1597, vol=7.232440e+05 assign (segid " A" and resid 45 and name HB1) (segid " A" and resid 29 and name HG2) 4.032 2.032 2.032 weight 1.000 ! spec=Noesy, no=1627, id=1598, vol=2.515308e+05 assign (segid " A" and resid 44 and name HB1) (segid " A" and resid 32 and name HB1) 3.274 1.340 1.340 weight 1.000 ! spec=Noesy, no=1628, id=1599, vol=8.430100e+05 assign (segid " A" and resid 36 and name HB1) (segid " A" and resid 35 and name HB1) 4.186 2.191 2.191 weight 1.000 ! spec=Noesy, no=1630, id=1601, vol=1.999282e+05 assign (segid " A" and resid 26 and name HB1) (segid " A" and resid 29 and name HB1) 3.899 1.900 1.900 weight 1.000 ! spec=Noesy, no=1631, id=1602, vol=2.581612e+05 assign (segid " A" and resid 14 and name HB2) (segid " A" and resid 15 and name HB3) 3.327 1.383 1.383 weight 1.000 ! spec=Noesy, no=1633, id=1603, vol=7.441890e+05 or (segid " A" and resid 14 and name HB2) (segid " A" and resid 15 and name HB2) or (segid " A" and resid 14 and name HB2) (segid " A" and resid 15 and name HB1)
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