NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
551071 | 2lwd | 18622 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
assign (segid " " and resid 116 and name HB) (segid " " and resid 116 and name HG21) 1.905 0.454 0.454 weight 1.000 ! spec=c13n...li-4, no=1, id=929, vol=6.025570e+02 assign (segid " " and resid 145 and name HB) (segid " " and resid 145 and name HG21) 1.992 0.496 4.008 weight 1.000 ! spec=c13n...li-4, no=8, id=933, vol=4.609849e+02 assign (segid " " and resid 112 and name HA) (segid " " and resid 116 and name HG21) 2.891 1.045 1.045 weight 1.000 ! spec=c13n...li-4, no=18, id=941, vol=4.934660e+01 assign (segid " " and resid 170 and name HB) (segid " " and resid 127 and name HD11) 2.931 1.074 3.069 weight 1.000 ! spec=c13n...li-4, no=19, id=942, vol=4.549770e+01 assign (segid " " and resid 168 and name HA) (segid " " and resid 167 and name HE3) 2.715 0.921 0.921 weight 1.000 ! spec=c13n...li-4, no=23, id=944, vol=7.203600e+01 assign (segid " " and resid 168 and name HA) (segid " " and resid 186 and name HZ2) 2.490 0.775 0.775 weight 1.000 ! spec=c13n...li-4, no=24, id=945, vol=1.209028e+02 assign (segid " " and resid 168 and name HA) (segid " " and resid 171 and name HB2) 3.007 1.130 1.130 weight 1.000 ! spec=c13n...li-4, no=26, id=946, vol=3.897930e+01 assign (segid " " and resid 168 and name HA) (segid " " and resid 168 and name HB2) 2.549 0.812 0.812 weight 1.000 ! spec=c13n...li-4, no=27, id=947, vol=1.051486e+02 assign (segid " " and resid 170 and name HB) (segid " " and resid 170 and name HA) 2.554 0.815 0.815 weight 1.000 ! spec=c13n...li-4, no=29, id=949, vol=1.039130e+02 assign (segid " " and resid 170 and name HA) (segid " " and resid 173 and name HB2) 2.552 0.814 0.814 weight 1.000 ! spec=c13n...li-4, no=32, id=950, vol=1.044807e+02 assign (segid " " and resid 170 and name HA) (segid " " and resid 173 and name HB1) 2.780 0.966 3.220 weight 1.000 ! spec=c13n...li-4, no=33, id=951, vol=6.241960e+01 assign (segid " " and resid 170 and name HA) (segid " " and resid 173 and name HD11) 2.428 0.737 0.737 weight 1.000 ! spec=c13n...li-4, no=35, id=953, vol=1.406551e+02 assign (segid " " and resid 156 and name HA) (segid " " and resid 107 and name HG) 2.887 1.042 1.042 weight 1.000 ! spec=c13n...li-4, no=38, id=955, vol=4.980670e+01 assign (segid " " and resid 156 and name HA) (segid " " and resid 159 and name HB2) 2.935 1.077 1.077 weight 1.000 ! spec=c13n...li-4, no=39, id=956, vol=4.510790e+01 assign (segid " " and resid 156 and name HA) (segid " " and resid 156 and name HG11) 2.403 0.722 0.722 weight 1.000 ! spec=c13n...li-4, no=41, id=958, vol=1.498633e+02 assign (segid " " and resid 156 and name HA) (segid " " and resid 156 and name HG21) 2.381 0.709 3.619 weight 1.000 ! spec=c13n...li-4, no=43, id=960, vol=1.580594e+02 assign (segid " " and resid 112 and name HA) (segid " " and resid 115 and name HE2) 2.703 0.913 3.297 weight 1.000 ! spec=c13n...li-4, no=44, id=961, vol=7.391950e+01 assign (segid " " and resid 112 and name HA) (segid " " and resid 112 and name HB2) 2.182 0.595 3.818 weight 1.000 ! spec=c13n...li-4, no=45, id=962, vol=2.671777e+02 assign (segid " " and resid 112 and name HA) (segid " " and resid 112 and name HG1) 2.620 0.858 0.858 weight 1.000 ! spec=c13n...li-4, no=47, id=964, vol=8.924490e+01 assign (segid " " and resid 112 and name HA) (segid " " and resid 112 and name HB1) 2.362 0.698 0.698 weight 1.000 ! spec=c13n...li-4, no=49, id=966, vol=1.658949e+02 assign (segid " " and resid 112 and name HA) (segid " " and resid 111 and name HB2) 2.759 0.952 3.241 weight 1.000 ! spec=c13n...li-4, no=50, id=967, vol=6.532720e+01 assign (segid " " and resid 112 and name HA) (segid " " and resid 115 and name HD1) 2.560 0.819 0.819 weight 1.000 ! spec=c13n...li-4, no=51, id=968, vol=1.024831e+02 assign (segid " " and resid 120 and name HA) (segid " " and resid 151 and name HA2) 3.026 1.144 2.974 weight 1.000 ! spec=c13n...li-4, no=52, id=969, vol=3.757540e+01 assign (segid " " and resid 120 and name HA) (segid " " and resid 120 and name HD1) 2.854 1.018 1.018 weight 1.000 ! spec=c13n...li-4, no=53, id=970, vol=5.340840e+01 assign (segid " " and resid 120 and name HA) (segid " " and resid 120 and name HD2) 2.958 1.094 1.094 weight 1.000 ! spec=c13n...li-4, no=54, id=971, vol=4.303250e+01 assign (segid " " and resid 120 and name HA) (segid " " and resid 120 and name HG2) 2.769 0.959 3.231 weight 1.000 ! spec=c13n...li-4, no=56, id=972, vol=6.394280e+01 assign (segid " " and resid 120 and name HA) (segid " " and resid 120 and name HB2) 2.178 0.593 3.822 weight 1.000 ! spec=c13n...li-4, no=57, id=973, vol=2.700042e+02 assign (segid " " and resid 120 and name HA) (segid " " and resid 124 and name HG11) 2.903 1.054 3.097 weight 1.000 ! spec=c13n...li-4, no=58, id=974, vol=4.812930e+01 assign (segid " " and resid 120 and name HA) (segid " " and resid 120 and name HG1) 2.712 0.919 0.919 weight 1.000 ! spec=c13n...li-4, no=59, id=975, vol=7.246160e+01 assign (segid " " and resid 120 and name HA) (segid " " and resid 155 and name HD11) 2.464 0.759 3.536 weight 1.000 ! spec=c13n...li-4, no=60, id=976, vol=1.288094e+02 assign (segid " " and resid 120 and name HA) (segid " " and resid 123 and name HG21) 2.333 0.680 0.680 weight 1.000 ! spec=c13n...li-4, no=61, id=977, vol=1.788584e+02 assign (segid " " and resid 120 and name HA) (segid " " and resid 119 and name HG21) 2.903 1.054 3.097 weight 1.000 ! spec=c13n...li-4, no=62, id=978, vol=4.812610e+01 assign (segid " " and resid 120 and name HA) (segid " " and resid 123 and name HD11) 2.862 1.024 1.024 weight 1.000 ! spec=c13n...li-4, no=63, id=979, vol=5.249710e+01 assign (segid " " and resid 120 and name HA) (segid " " and resid 118 and name HG21) 2.606 0.849 3.394 weight 1.000 ! spec=c13n...li-4, no=64, id=980, vol=9.214720e+01 assign (segid " " and resid 142 and name HA) (segid " " and resid 146 and name HB2) 2.263 0.640 0.640 weight 1.000 ! spec=c13n...li-4, no=65, id=981, vol=2.147640e+02 assign (segid " " and resid 142 and name HA) (segid " " and resid 142 and name HG11) 2.242 0.628 3.758 weight 1.000 ! spec=c13n...li-4, no=66, id=982, vol=2.272822e+02 assign (segid " " and resid 142 and name HA) (segid " " and resid 142 and name HG21) 1.960 0.480 4.040 weight 1.000 ! spec=c13n...li-4, no=67, id=983, vol=5.087789e+02 assign (segid " " and resid 139 and name HA) (segid " " and resid 154 and name HB2) 2.883 1.039 1.039 weight 1.000 ! spec=c13n...li-4, no=69, id=984, vol=5.022200e+01 assign (segid " " and resid 139 and name HA) (segid " " and resid 154 and name HG2) 3.023 1.142 1.142 weight 1.000 ! spec=c13n...li-4, no=71, id=986, vol=3.781740e+01 assign (segid " " and resid 139 and name HA) (segid " " and resid 139 and name HD11) 2.077 0.539 3.923 weight 1.000 ! spec=c13n...li-4, no=72, id=987, vol=3.595331e+02 assign (segid " " and resid 139 and name HA) (segid " " and resid 139 and name HG21) 2.087 0.544 0.544 weight 1.000 ! spec=c13n...li-4, no=73, id=988, vol=3.491730e+02 assign (segid " " and resid 145 and name HA) (segid " " and resid 144 and name HA) 2.590 0.839 3.410 weight 1.000 ! spec=c13n...li-4, no=75, id=989, vol=9.552080e+01 assign (segid " " and resid 145 and name HB) (segid " " and resid 145 and name HA) 1.871 0.437 0.437 weight 1.000 ! spec=c13n...li-4, no=78, id=991, vol=6.726315e+02 assign (segid " " and resid 145 and name HA) (segid " " and resid 144 and name HB2) 2.802 0.981 3.198 weight 1.000 ! spec=c13n...li-4, no=80, id=993, vol=5.958100e+01 assign (segid " " and resid 145 and name HA) (segid " " and resid 145 and name HG21) 1.778 0.395 4.222 weight 1.000 ! spec=c13n...li-4, no=81, id=994, vol=9.125192e+02 assign (segid " " and resid 143 and name HA) (segid " " and resid 151 and name HA1) 2.987 1.115 3.013 weight 1.000 ! spec=c13n...li-4, no=88, id=998, vol=4.063060e+01 assign (segid " " and resid 143 and name HA) (segid " " and resid 143 and name HB2) 2.419 0.731 0.731 weight 1.000 ! spec=c13n...li-4, no=89, id=999, vol=1.439187e+02 assign (segid " " and resid 143 and name HA) (segid " " and resid 143 and name HB1) 2.261 0.639 0.639 weight 1.000 ! spec=c13n...li-4, no=90, id=1000, vol=2.157315e+02 assign (segid " " and resid 143 and name HA) (segid " " and resid 142 and name HG21) 2.612 0.853 3.388 weight 1.000 ! spec=c13n...li-4, no=91, id=1001, vol=9.078080e+01 assign (segid " " and resid 183 and name HB2) (segid " " and resid 175 and name HB2) 2.486 0.773 0.773 weight 1.000 ! spec=c13n...li-4, no=96, id=1004, vol=1.220353e+02 assign (segid " " and resid 183 and name HB2) (segid " " and resid 175 and name HB1) 2.416 0.730 0.730 weight 1.000 ! spec=c13n...li-4, no=98, id=1006, vol=1.450149e+02 assign (segid " " and resid 183 and name HB2) (segid " " and resid 175 and name HD12) 2.556 0.816 0.816 weight 1.000 ! spec=c13n...li-4, no=100, id=1008, vol=1.035082e+02 or (segid " " and resid 183 and name HB2) (segid " " and resid 175 and name HD11) or (segid " " and resid 183 and name HB2) (segid " " and resid 175 and name HD13) assign (segid " " and resid 183 and name HB2) (segid " " and resid 175 and name HD22) 2.827 0.999 0.999 weight 1.000 ! spec=c13n...li-4, no=101, id=1009, vol=5.643700e+01 or (segid " " and resid 183 and name HB2) (segid " " and resid 175 and name HD21) or (segid " " and resid 183 and name HB2) (segid " " and resid 175 and name HD23) assign (segid " " and resid 162 and name HB2) (segid " " and resid 167 and name HD1) 2.951 1.088 1.088 weight 1.000 ! spec=c13n...li-4, no=106, id=1013, vol=4.366940e+01 assign (segid " " and resid 136 and name HA) (segid " " and resid 133 and name HA) 2.776 0.963 3.224 weight 1.000 ! spec=c13n...li-4, no=108, id=1015, vol=6.307020e+01 assign (segid " " and resid 136 and name HA) (segid " " and resid 135 and name HA) 2.291 0.656 3.709 weight 1.000 ! spec=c13n...li-4, no=109, id=1016, vol=1.996314e+02 assign (segid " " and resid 162 and name HB2) (segid " " and resid 162 and name HB1) 2.018 0.509 0.509 weight 1.000 ! spec=c13n...li-4, no=112, id=1018, vol=4.270663e+02 assign (segid " " and resid 162 and name HB2) (segid " " and resid 159 and name HA) 2.604 0.848 0.848 weight 1.000 ! spec=c13n...li-4, no=115, id=1020, vol=9.240630e+01 assign (segid " " and resid 136 and name HA) (segid " " and resid 136 and name HB1) 2.323 0.675 0.675 weight 1.000 ! spec=c13n...li-4, no=117, id=1022, vol=1.832532e+02 assign (segid " " and resid 158 and name HA) (segid " " and resid 158 and name HB2) 2.293 0.657 0.657 weight 1.000 ! spec=c13n...li-4, no=118, id=1023, vol=1.984446e+02 assign (segid " " and resid 158 and name HA) (segid " " and resid 158 and name HB1) 2.201 0.606 0.606 weight 1.000 ! spec=c13n...li-4, no=119, id=1024, vol=2.533647e+02 assign (segid " " and resid 136 and name HA) (segid " " and resid 139 and name HB) 2.379 0.708 0.708 weight 1.000 ! spec=c13n...li-4, no=120, id=1025, vol=1.589085e+02 assign (segid " " and resid 158 and name HA) (segid " " and resid 161 and name HB2) 2.653 0.880 0.880 weight 1.000 ! spec=c13n...li-4, no=121, id=1026, vol=8.277320e+01 assign (segid " " and resid 158 and name HA) (segid " " and resid 161 and name HG2) 2.459 0.756 0.756 weight 1.000 ! spec=c13n...li-4, no=122, id=1027, vol=1.303829e+02 assign (segid " " and resid 136 and name HA) (segid " " and resid 139 and name HG21) 2.566 0.823 3.434 weight 1.000 ! spec=c13n...li-4, no=124, id=1029, vol=1.009116e+02 assign (segid " " and resid 124 and name HA) (segid " " and resid 124 and name HG22) 2.913 1.061 1.061 weight 1.000 ! spec=c13n...li-4, no=126, id=1031, vol=4.718330e+01 or (segid " " and resid 124 and name HA) (segid " " and resid 124 and name HG21) or (segid " " and resid 124 and name HA) (segid " " and resid 124 and name HG23) assign (segid " " and resid 158 and name HA) (segid " " and resid 139 and name HD11) 3.006 1.130 2.994 weight 1.000 ! spec=c13n...li-4, no=127, id=1032, vol=3.907440e+01 assign (segid " " and resid 162 and name HB2) (segid " " and resid 159 and name HD11) 2.857 1.020 3.143 weight 1.000 ! spec=c13n...li-4, no=129, id=1034, vol=5.302670e+01 assign (segid " " and resid 124 and name HA) (segid " " and resid 127 and name HA) 2.389 0.713 3.611 weight 1.000 ! spec=c13n...li-4, no=130, id=1035, vol=1.550946e+02 assign (segid " " and resid 162 and name HB1) (segid " " and resid 162 and name HA) 1.965 0.482 4.035 weight 1.000 ! spec=c13n...li-4, no=132, id=1036, vol=5.013733e+02 assign (segid " " and resid 124 and name HA) (segid " " and resid 127 and name HB1) 2.579 0.831 0.831 weight 1.000 ! spec=c13n...li-4, no=139, id=1041, vol=9.805030e+01 assign (segid " " and resid 124 and name HA) (segid " " and resid 124 and name HB) 2.115 0.559 0.559 weight 1.000 ! spec=c13n...li-4, no=140, id=1042, vol=3.219492e+02 assign (segid " " and resid 124 and name HA) (segid " " and resid 127 and name HB2) 2.375 0.705 0.705 weight 1.000 ! spec=c13n...li-4, no=141, id=1043, vol=1.607573e+02 assign (segid " " and resid 124 and name HA) (segid " " and resid 124 and name HD11) 1.942 0.472 4.058 weight 1.000 ! spec=c13n...li-4, no=145, id=1046, vol=5.367072e+02 assign (segid " " and resid 162 and name HB1) (segid " " and resid 131 and name HD11) 2.646 0.875 0.875 weight 1.000 ! spec=c13n...li-4, no=146, id=1047, vol=8.405450e+01 assign (segid " " and resid 162 and name HB1) (segid " " and resid 167 and name HD1) 2.648 0.876 3.352 weight 1.000 ! spec=c13n...li-4, no=147, id=1048, vol=8.363670e+01 assign (segid " " and resid 123 and name HA) (segid " " and resid 122 and name HB2) 2.757 0.950 0.950 weight 1.000 ! spec=c13n...li-4, no=157, id=1052, vol=6.559650e+01 assign (segid " " and resid 123 and name HA) (segid " " and resid 124 and name HB) 2.990 1.117 3.010 weight 1.000 ! spec=c13n...li-4, no=158, id=1053, vol=4.036390e+01 assign (segid " " and resid 123 and name HA) (segid " " and resid 123 and name HB) 2.094 0.548 0.548 weight 1.000 ! spec=c13n...li-4, no=159, id=1054, vol=3.418620e+02 assign (segid " " and resid 123 and name HA) (segid " " and resid 123 and name HG11) 2.560 0.819 3.440 weight 1.000 ! spec=c13n...li-4, no=160, id=1055, vol=1.025509e+02 assign (segid " " and resid 123 and name HA) (segid " " and resid 123 and name HG12) 2.405 0.723 0.723 weight 1.000 ! spec=c13n...li-4, no=161, id=1056, vol=1.489324e+02 assign (segid " " and resid 123 and name HA) (segid " " and resid 124 and name HG21) 2.512 0.789 3.488 weight 1.000 ! spec=c13n...li-4, no=162, id=1057, vol=1.146557e+02 assign (segid " " and resid 123 and name HA) (segid " " and resid 123 and name HG21) 2.073 0.537 3.927 weight 1.000 ! spec=c13n...li-4, no=163, id=1058, vol=3.635994e+02 assign (segid " " and resid 123 and name HA) (segid " " and resid 123 and name HD11) 2.522 0.795 3.478 weight 1.000 ! spec=c13n...li-4, no=164, id=1059, vol=1.119529e+02 assign (segid " " and resid 167 and name HA) (segid " " and resid 127 and name HA) 3.031 1.148 1.148 weight 1.000 ! spec=c13n...li-4, no=166, id=1060, vol=3.718120e+01 assign (segid " " and resid 170 and name HB) (segid " " and resid 167 and name HA) 2.155 0.580 0.580 weight 1.000 ! spec=c13n...li-4, no=167, id=1061, vol=2.878891e+02 assign (segid " " and resid 167 and name HA) (segid " " and resid 167 and name HB1) 2.247 0.631 0.631 weight 1.000 ! spec=c13n...li-4, no=169, id=1063, vol=2.241409e+02 assign (segid " " and resid 167 and name HA) (segid " " and resid 167 and name HB2) 2.279 0.649 0.649 weight 1.000 ! spec=c13n...li-4, no=170, id=1064, vol=2.060569e+02 assign (segid " " and resid 167 and name HA) (segid " " and resid 130 and name HB2) 2.976 1.107 1.107 weight 1.000 ! spec=c13n...li-4, no=171, id=1065, vol=4.147700e+01 assign (segid " " and resid 167 and name HA) (segid " " and resid 168 and name HD2) 2.848 1.014 1.014 weight 1.000 ! spec=c13n...li-4, no=172, id=1066, vol=5.404900e+01 assign (segid " " and resid 167 and name HA) (segid " " and resid 170 and name HG21) 2.548 0.811 0.811 weight 1.000 ! spec=c13n...li-4, no=173, id=1067, vol=1.054832e+02 or (segid " " and resid 167 and name HA) (segid " " and resid 170 and name HG22) or (segid " " and resid 167 and name HA) (segid " " and resid 170 and name HG23) assign (segid " " and resid 167 and name HA) (segid " " and resid 127 and name HD11) 3.083 1.188 1.188 weight 1.000 ! spec=c13n...li-4, no=174, id=1068, vol=3.355900e+01 assign (segid " " and resid 167 and name HA) (segid " " and resid 159 and name HD21) 2.782 0.967 3.218 weight 1.000 ! spec=c13n...li-4, no=175, id=1069, vol=6.221270e+01 assign (segid " " and resid 132 and name HA) (segid " " and resid 131 and name HA) 2.988 1.116 3.012 weight 1.000 ! spec=c13n...li-4, no=176, id=1070, vol=4.049010e+01 assign (segid " " and resid 132 and name HA) (segid " " and resid 133 and name HA) 2.745 0.942 3.255 weight 1.000 ! spec=c13n...li-4, no=178, id=1071, vol=6.737800e+01 assign (segid " " and resid 132 and name HA) (segid " " and resid 132 and name HB) 2.051 0.526 0.526 weight 1.000 ! spec=c13n...li-4, no=179, id=1072, vol=3.876016e+02 assign (segid " " and resid 132 and name HA) (segid " " and resid 132 and name HG12) 2.382 0.709 3.618 weight 1.000 ! spec=c13n...li-4, no=180, id=1073, vol=1.579048e+02 assign (segid " " and resid 132 and name HA) (segid " " and resid 132 and name HG21) 1.891 0.447 0.447 weight 1.000 ! spec=c13n...li-4, no=181, id=1074, vol=6.299916e+02 assign (segid " " and resid 132 and name HA) (segid " " and resid 132 and name HD11) 2.451 0.751 3.549 weight 1.000 ! spec=c13n...li-4, no=182, id=1075, vol=1.328345e+02 assign (segid " " and resid 103 and name HA) (segid " " and resid 186 and name HH2) 2.963 1.097 1.097 weight 1.000 ! spec=c13n...li-4, no=183, id=1076, vol=4.261420e+01 assign (segid " " and resid 103 and name HA) (segid " " and resid 103 and name HD1) 2.247 0.631 0.631 weight 1.000 ! spec=c13n...li-4, no=185, id=1078, vol=2.242097e+02 assign (segid " " and resid 103 and name HA) (segid " " and resid 103 and name HE1) 2.765 0.956 3.235 weight 1.000 ! spec=c13n...li-4, no=186, id=1079, vol=6.450930e+01 assign (segid " " and resid 103 and name HA) (segid " " and resid 103 and name HB2) 2.571 0.826 0.826 weight 1.000 ! spec=c13n...li-4, no=187, id=1080, vol=9.994150e+01 assign (segid " " and resid 103 and name HA) (segid " " and resid 106 and name HB2) 2.383 0.710 0.710 weight 1.000 ! spec=c13n...li-4, no=189, id=1082, vol=1.575496e+02 assign (segid " " and resid 103 and name HA) (segid " " and resid 102 and name HB2) 2.899 1.051 3.101 weight 1.000 ! spec=c13n...li-4, no=190, id=1083, vol=4.856730e+01 assign (segid " " and resid 103 and name HA) (segid " " and resid 106 and name HB1) 2.550 0.813 0.813 weight 1.000 ! spec=c13n...li-4, no=191, id=1084, vol=1.048463e+02 assign (segid " " and resid 103 and name HA) (segid " " and resid 168 and name HB2) 2.796 0.977 0.977 weight 1.000 ! spec=c13n...li-4, no=192, id=1085, vol=6.035950e+01 assign (segid " " and resid 103 and name HA) (segid " " and resid 106 and name HD11) 2.615 0.855 3.385 weight 1.000 ! spec=c13n...li-4, no=193, id=1086, vol=9.015750e+01 assign (segid " " and resid 104 and name HA) (segid " " and resid 167 and name HZ2) 2.534 0.802 0.802 weight 1.000 ! spec=c13n...li-4, no=194, id=1087, vol=1.090010e+02 assign (segid " " and resid 144 and name HB2) (segid " " and resid 144 and name HA) 1.820 0.414 4.180 weight 1.000 ! spec=c13n...li-4, no=197, id=1088, vol=7.938800e+02 assign (segid " " and resid 125 and name HB2) (segid " " and resid 125 and name HA) 2.896 1.450 1.450 weight 1.000 ! spec=c13n...li-4, no=198, id=1089, vol=6.199633e+02 assign (segid " " and resid 104 and name HA) (segid " " and resid 160 and name HA) 2.865 1.026 1.026 weight 1.000 ! spec=c13n...li-4, no=199, id=1090, vol=5.214250e+01 assign (segid " " and resid 144 and name HA) (segid " " and resid 143 and name HB2) 2.887 1.042 1.042 weight 1.000 ! spec=c13n...li-4, no=201, id=1092, vol=4.975520e+01 assign (segid " " and resid 104 and name HA) (segid " " and resid 104 and name HB1) 2.431 0.739 0.739 weight 1.000 ! spec=c13n...li-4, no=204, id=1094, vol=1.397794e+02 assign (segid " " and resid 104 and name HA) (segid " " and resid 160 and name HD11) 2.098 0.550 3.902 weight 1.000 ! spec=c13n...li-4, no=206, id=1096, vol=3.376955e+02 assign (segid " " and resid 125 and name HB2) (segid " " and resid 124 and name HG21) 2.807 0.985 0.985 weight 1.000 ! spec=c13n...li-4, no=207, id=1097, vol=5.897630e+01 assign (segid " " and resid 104 and name HA) (segid " " and resid 107 and name HD11) 3.032 1.149 1.149 weight 1.000 ! spec=c13n...li-4, no=209, id=1099, vol=3.713370e+01 assign (segid " " and resid 182 and name HA) (segid " " and resid 182 and name HD1) 2.404 0.722 0.722 weight 1.000 ! spec=c13n...li-4, no=210, id=1100, vol=1.495225e+02 assign (segid " " and resid 182 and name HA) (segid " " and resid 117 and name HD2) 2.625 0.861 0.861 weight 1.000 ! spec=c13n...li-4, no=213, id=1101, vol=8.821820e+01 assign (segid " " and resid 182 and name HA) (segid " " and resid 182 and name HB2) 2.428 0.737 0.737 weight 1.000 ! spec=c13n...li-4, no=214, id=1102, vol=1.405895e+02 assign (segid " " and resid 182 and name HA) (segid " " and resid 182 and name HB1) 2.542 0.807 0.807 weight 1.000 ! spec=c13n...li-4, no=215, id=1103, vol=1.069944e+02 assign (segid " " and resid 97 and name HA) (segid " " and resid 97 and name HB) 2.167 0.587 3.833 weight 1.000 ! spec=c13n...li-4, no=216, id=1104, vol=2.786369e+02 assign (segid " " and resid 97 and name HA) (segid " " and resid 100 and name HB1) 2.688 0.903 0.903 weight 1.000 ! spec=c13n...li-4, no=217, id=1105, vol=7.647090e+01 assign (segid " " and resid 97 and name HA) (segid " " and resid 97 and name HG22) 2.965 1.099 1.099 weight 1.000 ! spec=c13n...li-4, no=220, id=1108, vol=4.240780e+01 or (segid " " and resid 97 and name HA) (segid " " and resid 97 and name HG21) or (segid " " and resid 97 and name HA) (segid " " and resid 97 and name HG23) assign (segid " " and resid 97 and name HA) (segid " " and resid 97 and name HG12) 2.449 0.750 0.750 weight 1.000 ! spec=c13n...li-4, no=221, id=1109, vol=1.335947e+02 assign (segid " " and resid 97 and name HA) (segid " " and resid 97 and name HD11) 2.030 0.515 0.515 weight 1.000 ! spec=c13n...li-4, no=222, id=1110, vol=4.119942e+02 assign (segid " " and resid 125 and name HA) (segid " " and resid 124 and name HG22) 2.729 0.931 0.931 weight 1.000 ! spec=c13n...li-4, no=237, id=1115, vol=6.983850e+01 or (segid " " and resid 125 and name HA) (segid " " and resid 124 and name HG21) or (segid " " and resid 125 and name HA) (segid " " and resid 124 and name HG23) assign (segid " " and resid 114 and name HA) (segid " " and resid 182 and name HE1) 2.824 0.997 0.997 weight 1.000 ! spec=c13n...li-4, no=241, id=1117, vol=5.688940e+01 assign (segid " " and resid 114 and name HA) (segid " " and resid 182 and name HD1) 2.825 0.998 0.998 weight 1.000 ! spec=c13n...li-4, no=242, id=1118, vol=5.670850e+01 assign (segid " " and resid 114 and name HA) (segid " " and resid 114 and name HD1) 2.549 0.812 0.812 weight 1.000 ! spec=c13n...li-4, no=243, id=1119, vol=1.050122e+02 assign (segid " " and resid 114 and name HA) (segid " " and resid 115 and name HA) 2.938 1.079 3.062 weight 1.000 ! spec=c13n...li-4, no=244, id=1120, vol=4.484020e+01 assign (segid " " and resid 114 and name HA) (segid " " and resid 114 and name HB1) 2.377 0.706 0.706 weight 1.000 ! spec=c13n...li-4, no=247, id=1121, vol=1.599299e+02 assign (segid " " and resid 114 and name HA) (segid " " and resid 117 and name HG1) 2.931 1.074 3.069 weight 1.000 ! spec=c13n...li-4, no=248, id=1122, vol=4.544270e+01 assign (segid " " and resid 114 and name HA) (segid " " and resid 118 and name HG12) 2.874 1.033 1.033 weight 1.000 ! spec=c13n...li-4, no=249, id=1123, vol=5.113580e+01 assign (segid " " and resid 114 and name HA) (segid " " and resid 118 and name HD11) 2.676 0.895 3.324 weight 1.000 ! spec=c13n...li-4, no=250, id=1124, vol=7.843940e+01 assign (segid " " and resid 130 and name HA) (segid " " and resid 130 and name HB2) 2.208 0.609 0.609 weight 1.000 ! spec=c13n...li-4, no=253, id=1126, vol=2.490748e+02 assign (segid " " and resid 130 and name HA) (segid " " and resid 164 and name HB2) 2.530 0.800 0.800 weight 1.000 ! spec=c13n...li-4, no=255, id=1128, vol=1.098180e+02 assign (segid " " and resid 130 and name HA) (segid " " and resid 164 and name HD2) 2.431 0.738 0.738 weight 1.000 ! spec=c13n...li-4, no=256, id=1129, vol=1.398691e+02 assign (segid " " and resid 130 and name HA) (segid " " and resid 164 and name HG2) 2.511 0.788 0.788 weight 1.000 ! spec=c13n...li-4, no=257, id=1130, vol=1.149209e+02 assign (segid " " and resid 130 and name HA) (segid " " and resid 164 and name HG1) 2.666 0.888 0.888 weight 1.000 ! spec=c13n...li-4, no=258, id=1131, vol=8.038010e+01 assign (segid " " and resid 149 and name HA) (segid " " and resid 115 and name HA) 2.824 0.997 0.997 weight 1.000 ! spec=c13n...li-4, no=263, id=1133, vol=5.678850e+01 assign (segid " " and resid 149 and name HA) (segid " " and resid 149 and name HE1) 2.208 0.609 3.792 weight 1.000 ! spec=c13n...li-4, no=266, id=1136, vol=2.488383e+02 assign (segid " " and resid 107 and name HA) (segid " " and resid 107 and name HB2) 2.515 0.790 0.790 weight 1.000 ! spec=c13n...li-4, no=267, id=1137, vol=1.140700e+02 assign (segid " " and resid 107 and name HA) (segid " " and resid 107 and name HB1) 2.488 0.774 0.774 weight 1.000 ! spec=c13n...li-4, no=268, id=1138, vol=1.216072e+02 assign (segid " " and resid 149 and name HA) (segid " " and resid 149 and name HB1) 2.218 0.615 0.615 weight 1.000 ! spec=c13n...li-4, no=269, id=1139, vol=2.424426e+02 assign (segid " " and resid 149 and name HA) (segid " " and resid 115 and name HB1) 2.865 1.026 1.026 weight 1.000 ! spec=c13n...li-4, no=270, id=1140, vol=5.215090e+01 assign (segid " " and resid 149 and name HA) (segid " " and resid 148 and name HB1) 2.789 0.972 0.972 weight 1.000 ! spec=c13n...li-4, no=271, id=1141, vol=6.125570e+01 assign (segid " " and resid 149 and name HA) (segid " " and resid 152 and name HB1) 2.118 0.561 3.882 weight 1.000 ! spec=c13n...li-4, no=273, id=1143, vol=3.192805e+02 assign (segid " " and resid 107 and name HA) (segid " " and resid 110 and name HD11) 2.775 0.963 3.225 weight 1.000 ! spec=c13n...li-4, no=274, id=1144, vol=6.313390e+01 assign (segid " " and resid 107 and name HA) (segid " " and resid 107 and name HG) 2.654 0.880 0.880 weight 1.000 ! spec=c13n...li-4, no=275, id=1145, vol=8.258790e+01 assign (segid " " and resid 107 and name HA) (segid " " and resid 107 and name HD11) 2.668 0.890 3.332 weight 1.000 ! spec=c13n...li-4, no=276, id=1146, vol=7.998390e+01 assign (segid " " and resid 107 and name HA) (segid " " and resid 107 and name HD21) 2.129 0.566 0.566 weight 1.000 ! spec=c13n...li-4, no=277, id=1147, vol=3.098219e+02 assign (segid " " and resid 188 and name HA) (segid " " and resid 103 and name HD1) 3.004 1.128 1.128 weight 1.000 ! spec=c13n...li-4, no=278, id=1148, vol=3.920330e+01 assign (segid " " and resid 188 and name HA) (segid " " and resid 103 and name HE1) 2.176 0.592 0.592 weight 1.000 ! spec=c13n...li-4, no=279, id=1149, vol=2.712455e+02 assign (segid " " and resid 162 and name HB2) (segid " " and resid 162 and name HA) 2.234 0.624 0.624 weight 1.000 ! spec=c13n...li-4, no=283, id=1151, vol=2.320354e+02 assign (segid " " and resid 113 and name HA) (segid " " and resid 117 and name HD1) 2.997 1.123 1.123 weight 1.000 ! spec=c13n...li-4, no=286, id=1154, vol=3.976870e+01 assign (segid " " and resid 188 and name HA) (segid " " and resid 188 and name HB) 2.241 0.628 0.628 weight 1.000 ! spec=c13n...li-4, no=292, id=1160, vol=2.277573e+02 assign (segid " " and resid 113 and name HA) (segid " " and resid 116 and name HG21) 2.868 1.028 1.028 weight 1.000 ! spec=c13n...li-4, no=294, id=1162, vol=5.178300e+01 assign (segid " " and resid 188 and name HA) (segid " " and resid 188 and name HG11) 1.979 0.490 0.490 weight 1.000 ! spec=c13n...li-4, no=296, id=1164, vol=4.795815e+02 assign (segid " " and resid 106 and name HA) (segid " " and resid 106 and name HD11) 2.606 0.849 3.394 weight 1.000 ! spec=c13n...li-4, no=297, id=1165, vol=9.210180e+01 assign (segid " " and resid 172 and name HA) (segid " " and resid 186 and name HD1) 2.428 0.737 0.737 weight 1.000 ! spec=c13n...li-4, no=298, id=1166, vol=1.407031e+02 assign (segid " " and resid 101 and name HA) (segid " " and resid 104 and name HD2) 2.699 0.911 0.911 weight 1.000 ! spec=c13n...li-4, no=300, id=1167, vol=7.459060e+01 assign (segid " " and resid 172 and name HA) (segid " " and resid 186 and name HB2) 2.478 0.767 3.522 weight 1.000 ! spec=c13n...li-4, no=301, id=1168, vol=1.246612e+02 assign (segid " " and resid 113 and name HA) (segid " " and resid 113 and name HB2) 2.502 0.782 0.782 weight 1.000 ! spec=c13n...li-4, no=302, id=1169, vol=1.175744e+02 assign (segid " " and resid 101 and name HA) (segid " " and resid 100 and name HB2) 2.774 0.962 3.226 weight 1.000 ! spec=c13n...li-4, no=309, id=1176, vol=6.326350e+01 assign (segid " " and resid 99 and name HA) (segid " " and resid 102 and name HB1) 2.187 0.598 0.598 weight 1.000 ! spec=c13n...li-4, no=312, id=1179, vol=2.633716e+02 assign (segid " " and resid 172 and name HA) (segid " " and resid 175 and name HD12) 2.439 0.744 0.744 weight 1.000 ! spec=c13n...li-4, no=313, id=1180, vol=1.368795e+02 or (segid " " and resid 172 and name HA) (segid " " and resid 175 and name HD11) or (segid " " and resid 172 and name HA) (segid " " and resid 175 and name HD13) assign (segid " " and resid 177 and name HA) (segid " " and resid 177 and name HE2) 3.001 1.126 1.126 weight 1.000 ! spec=c13n...li-4, no=316, id=1181, vol=3.947640e+01 assign (segid " " and resid 169 and name HA) (segid " " and resid 172 and name HB2) 2.480 0.769 0.769 weight 1.000 ! spec=c13n...li-4, no=317, id=1182, vol=1.238034e+02 assign (segid " " and resid 173 and name HA) (segid " " and resid 176 and name HG1) 2.467 0.761 0.761 weight 1.000 ! spec=c13n...li-4, no=322, id=1187, vol=1.277541e+02 assign (segid " " and resid 177 and name HA) (segid " " and resid 177 and name HG2) 2.529 0.799 3.471 weight 1.000 ! spec=c13n...li-4, no=326, id=1191, vol=1.103177e+02 assign (segid " " and resid 169 and name HA) (segid " " and resid 169 and name HG2) 2.337 0.682 0.682 weight 1.000 ! spec=c13n...li-4, no=329, id=1194, vol=1.772056e+02 assign (segid " " and resid 169 and name HA) (segid " " and resid 172 and name HG2) 2.803 0.982 0.982 weight 1.000 ! spec=c13n...li-4, no=330, id=1195, vol=5.945690e+01 assign (segid " " and resid 141 and name HA) (segid " " and resid 145 and name HG21) 2.793 0.975 0.975 weight 1.000 ! spec=c13n...li-4, no=333, id=1198, vol=6.076220e+01 or (segid " " and resid 141 and name HA) (segid " " and resid 145 and name HG22) or (segid " " and resid 141 and name HA) (segid " " and resid 145 and name HG23) assign (segid " " and resid 171 and name HA) (segid " " and resid 171 and name HD22) 2.019 0.509 0.509 weight 1.000 ! spec=c13n...li-4, no=336, id=1201, vol=4.262150e+02 or (segid " " and resid 171 and name HA) (segid " " and resid 171 and name HD21) or (segid " " and resid 171 and name HA) (segid " " and resid 171 and name HD23) assign (segid " " and resid 169 and name HA) (segid " " and resid 188 and name HG21) 2.308 0.666 0.666 weight 1.000 ! spec=c13n...li-4, no=337, id=1202, vol=1.906722e+02 assign (segid " " and resid 171 and name HA) (segid " " and resid 123 and name HD11) 3.025 1.144 1.144 weight 1.000 ! spec=c13n...li-4, no=338, id=1203, vol=3.760360e+01 assign (segid " " and resid 171 and name HA) (segid " " and resid 171 and name HD12) 2.892 1.046 1.046 weight 1.000 ! spec=c13n...li-4, no=340, id=1205, vol=4.927320e+01 or (segid " " and resid 171 and name HA) (segid " " and resid 171 and name HD11) or (segid " " and resid 171 and name HA) (segid " " and resid 171 and name HD13) assign (segid " " and resid 115 and name HA) (segid " " and resid 114 and name HD1) 2.607 0.850 0.850 weight 1.000 ! spec=c13n...li-4, no=341, id=1206, vol=9.178930e+01 assign (segid " " and resid 155 and name HA) (segid " " and resid 158 and name HB1) 2.792 0.974 0.974 weight 1.000 ! spec=c13n...li-4, no=345, id=1207, vol=6.086510e+01 assign (segid " " and resid 115 and name HA) (segid " " and resid 153 and name HG2) 2.281 0.651 0.651 weight 1.000 ! spec=c13n...li-4, no=346, id=1208, vol=2.045494e+02 assign (segid " " and resid 165 and name HA) (segid " " and resid 165 and name HB2) 1.898 0.450 0.450 weight 1.000 ! spec=c13n...li-4, no=351, id=1212, vol=6.172337e+02 or (segid " " and resid 165 and name HA) (segid " " and resid 165 and name HB1) assign (segid " " and resid 184 and name HA) (segid " " and resid 184 and name HB2) 1.988 0.494 4.012 weight 1.000 ! spec=c13n...li-4, no=353, id=1214, vol=4.672298e+02 assign (segid " " and resid 108 and name HA) (segid " " and resid 108 and name HG2) 2.337 0.683 0.683 weight 1.000 ! spec=c13n...li-4, no=354, id=1215, vol=1.768550e+02 assign (segid " " and resid 115 and name HA) (segid " " and resid 152 and name HB2) 1.896 0.450 0.450 weight 1.000 ! spec=c13n...li-4, no=356, id=1217, vol=6.200052e+02 or (segid " " and resid 115 and name HA) (segid " " and resid 152 and name HB1) or (segid " " and resid 115 and name HA) (segid " " and resid 152 and name HB3) assign (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HG12) 2.505 0.784 0.784 weight 1.000 ! spec=c13n...li-4, no=357, id=1218, vol=1.166833e+02 assign (segid " " and resid 102 and name HA) (segid " " and resid 105 and name HD21) 2.204 0.607 0.607 weight 1.000 ! spec=c13n...li-4, no=361, id=1222, vol=2.513423e+02 assign (segid " " and resid 165 and name HA) (segid " " and resid 100 and name HD11) 2.230 0.622 3.770 weight 1.000 ! spec=c13n...li-4, no=362, id=1223, vol=2.344396e+02 assign (segid " " and resid 140 and name HA) (segid " " and resid 143 and name HB2) 2.491 0.776 0.776 weight 1.000 ! spec=c13n...li-4, no=369, id=1226, vol=1.206651e+02 assign (segid " " and resid 137 and name HA) (segid " " and resid 137 and name HG2) 3.422 1.733 1.733 weight 1.000 ! spec=c13n...li-4, no=371, id=1228, vol=1.429442e+02 assign (segid " " and resid 137 and name HA) (segid " " and resid 137 and name HB1) 2.305 0.664 0.664 weight 1.000 ! spec=c13n...li-4, no=372, id=1229, vol=1.923643e+02 assign (segid " " and resid 137 and name HA) (segid " " and resid 137 and name HB2) 1.997 0.498 0.498 weight 1.000 ! spec=c13n...li-4, no=373, id=1230, vol=4.549458e+02 assign (segid " " and resid 118 and name HA) (segid " " and resid 118 and name HB) 2.365 0.699 0.699 weight 1.000 ! spec=c13n...li-4, no=377, id=1234, vol=1.648735e+02 assign (segid " " and resid 140 and name HA) (segid " " and resid 121 and name HG21) 2.651 0.879 0.879 weight 1.000 ! spec=c13n...li-4, no=378, id=1235, vol=8.302170e+01 or (segid " " and resid 140 and name HA) (segid " " and resid 121 and name HG22) or (segid " " and resid 140 and name HA) (segid " " and resid 121 and name HG23) assign (segid " " and resid 140 and name HA) (segid " " and resid 140 and name HD11) 1.729 0.374 4.271 weight 1.000 ! spec=c13n...li-4, no=380, id=1237, vol=1.078898e+03 assign (segid " " and resid 140 and name HA) (segid " " and resid 139 and name HG21) 2.351 0.691 3.649 weight 1.000 ! spec=c13n...li-4, no=381, id=1238, vol=1.707505e+02 assign (segid " " and resid 118 and name HA) (segid " " and resid 118 and name HG12) 2.699 0.911 0.911 weight 1.000 ! spec=c13n...li-4, no=382, id=1239, vol=7.460060e+01 assign (segid " " and resid 118 and name HA) (segid " " and resid 118 and name HG21) 2.217 0.614 0.614 weight 1.000 ! spec=c13n...li-4, no=383, id=1240, vol=2.428151e+02 assign (segid " " and resid 118 and name HA) (segid " " and resid 118 and name HG11) 2.633 0.867 0.867 weight 1.000 ! spec=c13n...li-4, no=384, id=1241, vol=8.649290e+01 assign (segid " " and resid 118 and name HA) (segid " " and resid 118 and name HD11) 2.110 0.557 0.557 weight 1.000 ! spec=c13n...li-4, no=385, id=1242, vol=3.262803e+02 assign (segid " " and resid 153 and name HA) (segid " " and resid 153 and name HG2) 2.376 0.706 0.706 weight 1.000 ! spec=c13n...li-4, no=388, id=1244, vol=1.602337e+02 assign (segid " " and resid 153 and name HA) (segid " " and resid 153 and name HB2) 1.913 0.458 4.087 weight 1.000 ! spec=c13n...li-4, no=389, id=1245, vol=5.878237e+02 assign (segid " " and resid 153 and name HA) (segid " " and resid 152 and name HB2) 2.665 0.888 3.335 weight 1.000 ! spec=c13n...li-4, no=390, id=1246, vol=8.053640e+01 or (segid " " and resid 153 and name HA) (segid " " and resid 152 and name HB1) or (segid " " and resid 153 and name HA) (segid " " and resid 152 and name HB3) assign (segid " " and resid 153 and name HA) (segid " " and resid 156 and name HG22) 2.483 0.771 0.771 weight 1.000 ! spec=c13n...li-4, no=391, id=1247, vol=1.228999e+02 or (segid " " and resid 153 and name HA) (segid " " and resid 156 and name HG21) or (segid " " and resid 153 and name HA) (segid " " and resid 156 and name HG23) assign (segid " " and resid 153 and name HA) (segid " " and resid 156 and name HG12) 2.752 0.946 0.946 weight 1.000 ! spec=c13n...li-4, no=392, id=1248, vol=6.641560e+01 or (segid " " and resid 153 and name HA) (segid " " and resid 156 and name HG11) or (segid " " and resid 153 and name HA) (segid " " and resid 156 and name HG13) assign (segid " " and resid 157 and name HA) (segid " " and resid 157 and name HG2) 2.385 0.711 0.711 weight 1.000 ! spec=c13n...li-4, no=394, id=1249, vol=1.564684e+02 assign (segid " " and resid 157 and name HA) (segid " " and resid 157 and name HB2) 2.166 0.587 3.834 weight 1.000 ! spec=c13n...li-4, no=395, id=1250, vol=2.790219e+02 assign (segid " " and resid 157 and name HA) (segid " " and resid 157 and name HG1) 2.382 0.709 0.709 weight 1.000 ! spec=c13n...li-4, no=396, id=1251, vol=1.577179e+02 assign (segid " " and resid 157 and name HA) (segid " " and resid 160 and name HB2) 2.403 0.722 0.722 weight 1.000 ! spec=c13n...li-4, no=397, id=1252, vol=1.497375e+02 assign (segid " " and resid 157 and name HA) (segid " " and resid 160 and name HB1) 2.700 0.911 0.911 weight 1.000 ! spec=c13n...li-4, no=398, id=1253, vol=7.440660e+01 assign (segid " " and resid 157 and name HA) (segid " " and resid 160 and name HD21) 2.259 0.638 0.638 weight 1.000 ! spec=c13n...li-4, no=399, id=1254, vol=2.169628e+02 assign (segid " " and resid 93 and name HA) (segid " " and resid 93 and name HB1) 2.293 0.657 0.657 weight 1.000 ! spec=c13n...li-4, no=403, id=1257, vol=1.981511e+02 assign (segid " " and resid 93 and name HA) (segid " " and resid 93 and name HB2) 2.259 0.638 0.638 weight 1.000 ! spec=c13n...li-4, no=404, id=1258, vol=2.172099e+02 assign (segid " " and resid 126 and name HA) (segid " " and resid 126 and name HB1) 2.200 0.605 3.800 weight 1.000 ! spec=c13n...li-4, no=407, id=1260, vol=2.542460e+02 assign (segid " " and resid 93 and name HA) (segid " " and resid 95 and name HD2) 2.807 0.985 0.985 weight 1.000 ! spec=c13n...li-4, no=408, id=1261, vol=5.890640e+01 assign (segid " " and resid 126 and name HA) (segid " " and resid 174 and name HB1) 2.843 1.010 3.157 weight 1.000 ! spec=c13n...li-4, no=409, id=1262, vol=5.465480e+01 assign (segid " " and resid 122 and name HA) (segid " " and resid 122 and name HB2) 1.993 0.496 4.007 weight 1.000 ! spec=c13n...li-4, no=411, id=1263, vol=4.602713e+02 assign (segid " " and resid 146 and name HA) (segid " " and resid 145 and name HB) 2.992 1.119 3.008 weight 1.000 ! spec=c13n...li-4, no=413, id=1264, vol=4.016000e+01 assign (segid " " and resid 146 and name HA) (segid " " and resid 146 and name HE2) 3.005 1.128 1.128 weight 1.000 ! spec=c13n...li-4, no=414, id=1265, vol=3.919410e+01 assign (segid " " and resid 146 and name HA) (segid " " and resid 146 and name HB2) 2.029 0.515 3.971 weight 1.000 ! spec=c13n...li-4, no=415, id=1266, vol=4.126827e+02 assign (segid " " and resid 146 and name HA) (segid " " and resid 146 and name HB1) 2.148 0.577 0.577 weight 1.000 ! spec=c13n...li-4, no=416, id=1267, vol=2.935984e+02 assign (segid " " and resid 146 and name HA) (segid " " and resid 146 and name HD2) 2.317 0.671 3.683 weight 1.000 ! spec=c13n...li-4, no=417, id=1268, vol=1.861508e+02 assign (segid " " and resid 146 and name HA) (segid " " and resid 146 and name HD1) 2.321 0.674 0.674 weight 1.000 ! spec=c13n...li-4, no=418, id=1269, vol=1.842702e+02 assign (segid " " and resid 146 and name HA) (segid " " and resid 146 and name HG2) 2.177 0.592 0.592 weight 1.000 ! spec=c13n...li-4, no=419, id=1270, vol=2.709959e+02 assign (segid " " and resid 146 and name HA) (segid " " and resid 142 and name HG21) 2.751 0.946 3.249 weight 1.000 ! spec=c13n...li-4, no=421, id=1272, vol=6.657010e+01 assign (segid " " and resid 117 and name HA) (segid " " and resid 113 and name HA) 2.774 0.962 3.226 weight 1.000 ! spec=c13n...li-4, no=423, id=1274, vol=6.331500e+01 assign (segid " " and resid 119 and name HA) (segid " " and resid 118 and name HA) 2.936 1.078 3.064 weight 1.000 ! spec=c13n...li-4, no=424, id=1275, vol=4.500810e+01 assign (segid " " and resid 119 and name HA) (segid " " and resid 148 and name HG2) 2.992 1.119 3.008 weight 1.000 ! spec=c13n...li-4, no=426, id=1277, vol=4.016560e+01 assign (segid " " and resid 119 and name HA) (segid " " and resid 119 and name HB) 2.127 0.565 3.873 weight 1.000 ! spec=c13n...li-4, no=427, id=1278, vol=3.116322e+02 assign (segid " " and resid 117 and name HA) (segid " " and resid 117 and name HG2) 2.240 0.627 0.627 weight 1.000 ! spec=c13n...li-4, no=428, id=1279, vol=2.280264e+02 assign (segid " " and resid 119 and name HA) (segid " " and resid 148 and name HB1) 2.265 0.641 0.641 weight 1.000 ! spec=c13n...li-4, no=429, id=1280, vol=2.135808e+02 assign (segid " " and resid 117 and name HA) (segid " " and resid 117 and name HB1) 2.309 0.667 0.667 weight 1.000 ! spec=c13n...li-4, no=431, id=1282, vol=1.901017e+02 assign (segid " " and resid 119 and name HA) (segid " " and resid 118 and name HB) 2.751 0.946 3.249 weight 1.000 ! spec=c13n...li-4, no=432, id=1283, vol=6.651130e+01 assign (segid " " and resid 119 and name HA) (segid " " and resid 119 and name HG21) 2.284 0.652 0.652 weight 1.000 ! spec=c13n...li-4, no=433, id=1284, vol=2.032773e+02 assign (segid " " and resid 119 and name HA) (segid " " and resid 118 and name HG21) 2.923 1.068 3.077 weight 1.000 ! spec=c13n...li-4, no=435, id=1286, vol=4.626950e+01 assign (segid " " and resid 100 and name HA) (segid " " and resid 103 and name HD1) 2.285 0.653 3.715 weight 1.000 ! spec=c13n...li-4, no=436, id=1287, vol=2.025912e+02 assign (segid " " and resid 100 and name HA) (segid " " and resid 103 and name HE1) 2.939 1.079 3.061 weight 1.000 ! spec=c13n...li-4, no=437, id=1288, vol=4.477710e+01 assign (segid " " and resid 100 and name HA) (segid " " and resid 103 and name HB2) 2.840 1.008 1.008 weight 1.000 ! spec=c13n...li-4, no=439, id=1289, vol=5.498990e+01 assign (segid " " and resid 133 and name HA) (segid " " and resid 136 and name HB2) 2.424 0.735 0.735 weight 1.000 ! spec=c13n...li-4, no=440, id=1290, vol=1.419780e+02 assign (segid " " and resid 133 and name HA) (segid " " and resid 133 and name HB2) 2.038 0.519 3.962 weight 1.000 ! spec=c13n...li-4, no=441, id=1291, vol=4.020234e+02 assign (segid " " and resid 133 and name HA) (segid " " and resid 136 and name HB1) 2.576 0.829 0.829 weight 1.000 ! spec=c13n...li-4, no=443, id=1293, vol=9.870660e+01 assign (segid " " and resid 100 and name HA) (segid " " and resid 103 and name HB1) 2.846 1.012 1.012 weight 1.000 ! spec=c13n...li-4, no=444, id=1294, vol=5.431560e+01 assign (segid " " and resid 133 and name HA) (segid " " and resid 137 and name HG2) 2.206 0.608 0.608 weight 1.000 ! spec=c13n...li-4, no=446, id=1296, vol=2.499531e+02 assign (segid " " and resid 129 and name HA) (segid " " and resid 129 and name HB2) 2.010 0.505 0.505 weight 1.000 ! spec=c13n...li-4, no=447, id=1297, vol=4.374919e+02 assign (segid " " and resid 129 and name HA) (segid " " and resid 129 and name HB1) 2.052 0.527 3.948 weight 1.000 ! spec=c13n...li-4, no=449, id=1299, vol=3.856929e+02 assign (segid " " and resid 100 and name HA) (segid " " and resid 100 and name HB2) 2.209 0.610 0.610 weight 1.000 ! spec=c13n...li-4, no=450, id=1300, vol=2.478622e+02 assign (segid " " and resid 95 and name HA) (segid " " and resid 95 and name HG2) 2.328 0.677 0.677 weight 1.000 ! spec=c13n...li-4, no=453, id=1303, vol=1.812283e+02 assign (segid " " and resid 100 and name HA) (segid " " and resid 100 and name HD21) 1.994 0.497 0.497 weight 1.000 ! spec=c13n...li-4, no=455, id=1305, vol=4.591048e+02 assign (segid " " and resid 100 and name HA) (segid " " and resid 100 and name HD11) 3.154 1.580 1.580 weight 1.000 ! spec=c13n...li-4, no=456, id=1306, vol=2.889336e+02 assign (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HE1) 3.028 1.146 1.146 weight 1.000 ! spec=c13n...li-4, no=462, id=1309, vol=3.742210e+01 assign (segid " " and resid 98 and name HA) (segid " " and resid 98 and name HG2) 2.183 0.596 0.596 weight 1.000 ! spec=c13n...li-4, no=464, id=1311, vol=2.664073e+02 assign (segid " " and resid 154 and name HA) (segid " " and resid 157 and name HG2) 2.867 1.027 1.027 weight 1.000 ! spec=c13n...li-4, no=465, id=1312, vol=5.196480e+01 assign (segid " " and resid 98 and name HA) (segid " " and resid 97 and name HB) 2.433 0.740 3.567 weight 1.000 ! spec=c13n...li-4, no=468, id=1315, vol=1.389412e+02 assign (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HD2) 1.876 0.440 0.440 weight 1.000 ! spec=c13n...li-4, no=469, id=1316, vol=6.619921e+02 assign (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HB2) 2.326 0.676 0.676 weight 1.000 ! spec=c13n...li-4, no=473, id=1320, vol=1.822052e+02 assign (segid " " and resid 189 and name HA) (segid " " and resid 189 and name HB2) 2.087 0.545 3.913 weight 1.000 ! spec=c13n...li-4, no=474, id=1321, vol=3.487334e+02 assign (segid " " and resid 96 and name HA) (segid " " and resid 96 and name HD1) 2.511 0.788 0.788 weight 1.000 ! spec=c13n...li-4, no=476, id=1323, vol=1.149471e+02 assign (segid " " and resid 96 and name HA) (segid " " and resid 96 and name HG2) 2.339 0.684 0.684 weight 1.000 ! spec=c13n...li-4, no=477, id=1324, vol=1.759045e+02 assign (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HD1) 2.319 0.672 3.681 weight 1.000 ! spec=c13n...li-4, no=479, id=1326, vol=1.852582e+02 assign (segid " " and resid 106 and name HA) (segid " " and resid 105 and name HD11) 1.912 0.457 0.457 weight 1.000 ! spec=c13n...li-4, no=480, id=1327, vol=5.897529e+02 assign (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HG2) 2.696 0.909 0.909 weight 1.000 ! spec=c13n...li-4, no=481, id=1328, vol=7.506090e+01 assign (segid " " and resid 189 and name HA) (segid " " and resid 187 and name HG21) 2.710 0.918 3.290 weight 1.000 ! spec=c13n...li-4, no=484, id=1331, vol=7.283780e+01 assign (segid " " and resid 99 and name HA) (segid " " and resid 99 and name HG2) 2.319 0.672 3.681 weight 1.000 ! spec=c13n...li-4, no=488, id=1335, vol=1.853511e+02 assign (segid " " and resid 99 and name HA) (segid " " and resid 100 and name HD21) 2.867 1.027 3.133 weight 1.000 ! spec=c13n...li-4, no=489, id=1336, vol=5.192840e+01 assign (segid " " and resid 105 and name HA) (segid " " and resid 108 and name HE2) 2.742 0.940 0.940 weight 1.000 ! spec=c13n...li-4, no=491, id=1337, vol=6.778450e+01 assign (segid " " and resid 173 and name HA) (segid " " and resid 176 and name HG2) 2.814 0.990 0.990 weight 1.000 ! spec=c13n...li-4, no=492, id=1338, vol=5.802810e+01 assign (segid " " and resid 105 and name HA) (segid " " and resid 108 and name HD2) 2.215 0.613 0.613 weight 1.000 ! spec=c13n...li-4, no=494, id=1340, vol=2.441768e+02 assign (segid " " and resid 175 and name HA) (segid " " and resid 123 and name HG12) 2.464 0.759 3.536 weight 1.000 ! spec=c13n...li-4, no=496, id=1342, vol=1.288752e+02 assign (segid " " and resid 175 and name HA) (segid " " and resid 178 and name HG2) 2.748 0.944 0.944 weight 1.000 ! spec=c13n...li-4, no=498, id=1344, vol=6.701790e+01 assign (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HG) 2.672 0.893 0.893 weight 1.000 ! spec=c13n...li-4, no=500, id=1346, vol=7.919270e+01 assign (segid " " and resid 175 and name HA) (segid " " and resid 123 and name HB) 2.884 1.040 1.040 weight 1.000 ! spec=c13n...li-4, no=501, id=1347, vol=5.007690e+01 assign (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HB1) 2.566 0.823 0.823 weight 1.000 ! spec=c13n...li-4, no=502, id=1348, vol=1.009684e+02 assign (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HD12) 2.733 0.934 0.934 weight 1.000 ! spec=c13n...li-4, no=503, id=1349, vol=6.920440e+01 or (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HD11) or (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HD13) assign (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HD22) 2.057 0.529 0.529 weight 1.000 ! spec=c13n...li-4, no=504, id=1350, vol=3.807940e+02 or (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HD21) or (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HD23) assign (segid " " and resid 179 and name HA) (segid " " and resid 176 and name HA) 2.667 0.889 0.889 weight 1.000 ! spec=c13n...li-4, no=506, id=1352, vol=8.011620e+01 assign (segid " " and resid 179 and name HA) (segid " " and resid 179 and name HB2) 2.306 0.665 0.665 weight 1.000 ! spec=c13n...li-4, no=509, id=1354, vol=1.919299e+02 assign (segid " " and resid 179 and name HA) (segid " " and resid 179 and name HB1) 2.163 0.585 3.837 weight 1.000 ! spec=c13n...li-4, no=510, id=1355, vol=2.813825e+02 assign (segid " " and resid 179 and name HA) (segid " " and resid 179 and name HG2) 2.157 0.582 0.582 weight 1.000 ! spec=c13n...li-4, no=511, id=1356, vol=2.859356e+02 assign (segid " " and resid 160 and name HA) (segid " " and resid 104 and name HB1) 2.994 1.120 3.006 weight 1.000 ! spec=c13n...li-4, no=516, id=1359, vol=4.006910e+01 assign (segid " " and resid 160 and name HA) (segid " " and resid 160 and name HB1) 2.323 0.675 0.675 weight 1.000 ! spec=c13n...li-4, no=518, id=1361, vol=1.833639e+02 assign (segid " " and resid 160 and name HA) (segid " " and resid 160 and name HD11) 1.993 0.497 4.007 weight 1.000 ! spec=c13n...li-4, no=519, id=1362, vol=4.599658e+02 assign (segid " " and resid 160 and name HA) (segid " " and resid 160 and name HD21) 2.553 0.815 3.447 weight 1.000 ! spec=c13n...li-4, no=521, id=1363, vol=1.040135e+02 assign (segid " " and resid 160 and name HA) (segid " " and resid 107 and name HD11) 2.887 1.042 3.113 weight 1.000 ! spec=c13n...li-4, no=522, id=1364, vol=4.978250e+01 assign (segid " " and resid 162 and name HB1) (segid " " and resid 159 and name HA) 2.645 0.875 0.875 weight 1.000 ! spec=c13n...li-4, no=524, id=1366, vol=8.416120e+01 assign (segid " " and resid 159 and name HA) (segid " " and resid 159 and name HG) 2.528 0.799 0.799 weight 1.000 ! spec=c13n...li-4, no=526, id=1367, vol=1.104666e+02 assign (segid " " and resid 159 and name HA) (segid " " and resid 159 and name HB2) 2.460 0.756 0.756 weight 1.000 ! spec=c13n...li-4, no=527, id=1368, vol=1.302415e+02 assign (segid " " and resid 159 and name HA) (segid " " and resid 127 and name HD11) 2.960 1.095 3.040 weight 1.000 ! spec=c13n...li-4, no=528, id=1369, vol=4.287120e+01 assign (segid " " and resid 159 and name HA) (segid " " and resid 131 and name HD11) 2.632 0.866 0.866 weight 1.000 ! spec=c13n...li-4, no=529, id=1370, vol=8.679680e+01 assign (segid " " and resid 159 and name HA) (segid " " and resid 159 and name HD11) 2.011 0.505 0.505 weight 1.000 ! spec=c13n...li-4, no=530, id=1371, vol=4.365404e+02 assign (segid " " and resid 159 and name HA) (segid " " and resid 159 and name HB1) 2.395 0.717 0.717 weight 1.000 ! spec=c13n...li-4, no=532, id=1372, vol=1.528643e+02 assign (segid " " and resid 110 and name HA) (segid " " and resid 109 and name HA) 3.069 1.178 2.931 weight 1.000 ! spec=c13n...li-4, no=536, id=1373, vol=3.448460e+01 assign (segid " " and resid 110 and name HA) (segid " " and resid 112 and name HD2) 2.593 0.841 0.841 weight 1.000 ! spec=c13n...li-4, no=537, id=1374, vol=9.475840e+01 assign (segid " " and resid 110 and name HA) (segid " " and resid 113 and name HG2) 2.987 1.116 1.116 weight 1.000 ! spec=c13n...li-4, no=538, id=1375, vol=4.056680e+01 assign (segid " " and resid 110 and name HA) (segid " " and resid 110 and name HB2) 2.320 0.673 0.673 weight 1.000 ! spec=c13n...li-4, no=539, id=1376, vol=1.851111e+02 assign (segid " " and resid 110 and name HA) (segid " " and resid 110 and name HD11) 2.573 0.828 3.427 weight 1.000 ! spec=c13n...li-4, no=541, id=1378, vol=9.936040e+01 assign (segid " " and resid 110 and name HA) (segid " " and resid 110 and name HD21) 1.923 0.462 4.077 weight 1.000 ! spec=c13n...li-4, no=542, id=1379, vol=5.707119e+02 assign (segid " " and resid 186 and name HA) (segid " " and resid 186 and name HH2) 2.176 0.592 3.824 weight 1.000 ! spec=c13n...li-4, no=543, id=1380, vol=2.719049e+02 assign (segid " " and resid 186 and name HA) (segid " " and resid 186 and name HB2) 2.508 0.786 0.786 weight 1.000 ! spec=c13n...li-4, no=545, id=1381, vol=1.159149e+02 assign (segid " " and resid 180 and name HA) (segid " " and resid 180 and name HB2) 2.219 0.615 0.615 weight 1.000 ! spec=c13n...li-4, no=546, id=1382, vol=2.416146e+02 assign (segid " " and resid 186 and name HA) (segid " " and resid 185 and name HB1) 2.633 0.866 3.367 weight 1.000 ! spec=c13n...li-4, no=548, id=1384, vol=8.662310e+01 assign (segid " " and resid 186 and name HA) (segid " " and resid 110 and name HD21) 2.819 0.993 3.181 weight 1.000 ! spec=c13n...li-4, no=549, id=1385, vol=5.743590e+01 assign (segid " " and resid 186 and name HA) (segid " " and resid 106 and name HD12) 2.596 0.842 0.842 weight 1.000 ! spec=c13n...li-4, no=550, id=1386, vol=9.428370e+01 or (segid " " and resid 186 and name HA) (segid " " and resid 106 and name HD11) or (segid " " and resid 186 and name HA) (segid " " and resid 106 and name HD13) assign (segid " " and resid 164 and name HA) (segid " " and resid 164 and name HB2) 2.034 0.517 3.966 weight 1.000 ! spec=c13n...li-4, no=555, id=1388, vol=4.073647e+02 assign (segid " " and resid 94 and name HA) (segid " " and resid 94 and name HB2) 2.137 0.571 0.571 weight 1.000 ! spec=c13n...li-4, no=556, id=1389, vol=3.027328e+02 assign (segid " " and resid 161 and name HA) (segid " " and resid 161 and name HG1) 2.486 0.773 0.773 weight 1.000 ! spec=c13n...li-4, no=558, id=1391, vol=1.220995e+02 assign (segid " " and resid 164 and name HA) (segid " " and resid 164 and name HG1) 2.420 0.732 0.732 weight 1.000 ! spec=c13n...li-4, no=559, id=1392, vol=1.435692e+02 assign (segid " " and resid 127 and name HA) (segid " " and resid 127 and name HB2) 2.229 0.621 0.621 weight 1.000 ! spec=c13n...li-4, no=560, id=1393, vol=2.347993e+02 assign (segid " " and resid 127 and name HA) (segid " " and resid 127 and name HD11) 1.925 0.463 4.075 weight 1.000 ! spec=c13n...li-4, no=563, id=1396, vol=5.665801e+02 assign (segid " " and resid 178 and name HA) (segid " " and resid 178 and name HG2) 2.375 0.705 3.625 weight 1.000 ! spec=c13n...li-4, no=566, id=1398, vol=1.607847e+02 assign (segid " " and resid 178 and name HA) (segid " " and resid 178 and name HG1) 2.496 0.779 3.504 weight 1.000 ! spec=c13n...li-4, no=567, id=1399, vol=1.191563e+02 assign (segid " " and resid 178 and name HA) (segid " " and resid 178 and name HB2) 2.269 0.643 0.643 weight 1.000 ! spec=c13n...li-4, no=568, id=1400, vol=2.115665e+02 assign (segid " " and resid 185 and name HA) (segid " " and resid 185 and name HB2) 2.082 0.542 0.542 weight 1.000 ! spec=c13n...li-4, no=574, id=1406, vol=3.538733e+02 assign (segid " " and resid 185 and name HA) (segid " " and resid 185 and name HB1) 2.319 0.672 0.672 weight 1.000 ! spec=c13n...li-4, no=575, id=1407, vol=1.855640e+02 assign (segid " " and resid 185 and name HA) (segid " " and resid 185 and name HD21) 2.885 1.444 1.444 weight 1.000 ! spec=c13n...li-4, no=576, id=1408, vol=6.434879e+02 assign (segid " " and resid 185 and name HA) (segid " " and resid 187 and name HD11) 2.792 0.974 3.208 weight 1.000 ! spec=c13n...li-4, no=577, id=1409, vol=6.086760e+01 assign (segid " " and resid 174 and name HA) (segid " " and resid 177 and name HE2) 2.989 1.117 1.117 weight 1.000 ! spec=c13n...li-4, no=580, id=1410, vol=4.044020e+01 assign (segid " " and resid 174 and name HA) (segid " " and resid 126 and name HB2) 2.879 1.036 1.036 weight 1.000 ! spec=c13n...li-4, no=581, id=1411, vol=5.066470e+01 assign (segid " " and resid 174 and name HA) (segid " " and resid 174 and name HB1) 1.893 0.448 4.107 weight 1.000 ! spec=c13n...li-4, no=586, id=1415, vol=6.273069e+02 assign (segid " " and resid 174 and name HA) (segid " " and resid 177 and name HG2) 2.870 1.029 1.029 weight 1.000 ! spec=c13n...li-4, no=588, id=1417, vol=5.164160e+01 assign (segid " " and resid 150 and name HA) (segid " " and resid 150 and name HB2) 1.768 0.391 4.232 weight 1.000 ! spec=c13n...li-4, no=590, id=1419, vol=9.426314e+02 assign (segid " " and resid 152 and name HA) (segid " " and resid 114 and name HE1) 2.715 0.921 0.921 weight 1.000 ! spec=c13n...li-4, no=592, id=1420, vol=7.205080e+01 assign (segid " " and resid 152 and name HA) (segid " " and resid 151 and name HA2) 2.807 0.985 3.193 weight 1.000 ! spec=c13n...li-4, no=593, id=1421, vol=5.889930e+01 assign (segid " " and resid 152 and name HA) (segid " " and resid 120 and name HG2) 2.600 0.845 0.845 weight 1.000 ! spec=c13n...li-4, no=596, id=1422, vol=9.323450e+01 assign (segid " " and resid 152 and name HA) (segid " " and resid 120 and name HB2) 2.760 0.952 3.240 weight 1.000 ! spec=c13n...li-4, no=597, id=1423, vol=6.528170e+01 assign (segid " " and resid 152 and name HA) (segid " " and resid 152 and name HB1) 2.032 0.516 0.516 weight 1.000 ! spec=c13n...li-4, no=598, id=1424, vol=4.093061e+02 assign (segid " " and resid 152 and name HA) (segid " " and resid 120 and name HG1) 2.422 0.733 0.733 weight 1.000 ! spec=c13n...li-4, no=599, id=1425, vol=1.429629e+02 assign (segid " " and resid 152 and name HA) (segid " " and resid 155 and name HB2) 2.584 0.835 0.835 weight 1.000 ! spec=c13n...li-4, no=601, id=1427, vol=9.680760e+01 assign (segid " " and resid 152 and name HA) (segid " " and resid 155 and name HD11) 2.452 0.752 0.752 weight 1.000 ! spec=c13n...li-4, no=602, id=1428, vol=1.325494e+02 assign (segid " " and resid 166 and name HA) (segid " " and resid 166 and name HB2) 1.977 0.488 4.023 weight 1.000 ! spec=c13n...li-4, no=607, id=1429, vol=4.833837e+02 assign (segid " " and resid 166 and name HA) (segid " " and resid 166 and name HB1) 2.044 0.522 3.956 weight 1.000 ! spec=c13n...li-4, no=608, id=1430, vol=3.954673e+02 assign (segid " " and resid 166 and name HA) (segid " " and resid 168 and name HD1) 2.853 1.017 1.017 weight 1.000 ! spec=c13n...li-4, no=609, id=1431, vol=5.351860e+01 assign (segid " " and resid 166 and name HA) (segid " " and resid 165 and name HB2) 2.975 1.106 1.106 weight 1.000 ! spec=c13n...li-4, no=610, id=1432, vol=4.159820e+01 or (segid " " and resid 166 and name HA) (segid " " and resid 165 and name HB1) assign (segid " " and resid 166 and name HA) (segid " " and resid 169 and name HB2) 2.738 0.937 0.937 weight 1.000 ! spec=c13n...li-4, no=611, id=1433, vol=6.839010e+01 assign (segid " " and resid 163 and name HA) (segid " " and resid 163 and name HB2) 2.143 0.574 0.574 weight 1.000 ! spec=c13n...li-4, no=613, id=1434, vol=2.973760e+02 assign (segid " " and resid 163 and name HA) (segid " " and resid 163 and name HB1) 2.137 0.571 0.571 weight 1.000 ! spec=c13n...li-4, no=614, id=1435, vol=3.029460e+02 assign (segid " " and resid 131 and name HA) (segid " " and resid 131 and name HB1) 2.390 0.714 0.714 weight 1.000 ! spec=c13n...li-4, no=619, id=1438, vol=1.546898e+02 assign (segid " " and resid 131 and name HA) (segid " " and resid 132 and name HG12) 2.864 1.025 1.025 weight 1.000 ! spec=c13n...li-4, no=620, id=1439, vol=5.223300e+01 assign (segid " " and resid 131 and name HA) (segid " " and resid 131 and name HD11) 1.951 0.476 4.049 weight 1.000 ! spec=c13n...li-4, no=621, id=1440, vol=5.226146e+02 assign (segid " " and resid 131 and name HA) (segid " " and resid 127 and name HD12) 2.890 1.044 1.044 weight 1.000 ! spec=c13n...li-4, no=622, id=1441, vol=4.953520e+01 or (segid " " and resid 131 and name HA) (segid " " and resid 127 and name HD11) or (segid " " and resid 131 and name HA) (segid " " and resid 127 and name HD13) assign (segid " " and resid 120 and name HD1) (segid " " and resid 152 and name HB1) 2.709 0.917 0.917 weight 1.000 ! spec=c13n...li-4, no=623, id=1442, vol=7.300410e+01 assign (segid " " and resid 120 and name HD1) (segid " " and resid 120 and name HG2) 2.444 0.747 0.747 weight 1.000 ! spec=c13n...li-4, no=627, id=1444, vol=1.352420e+02 assign (segid " " and resid 120 and name HD1) (segid " " and resid 120 and name HB2) 2.706 0.916 0.916 weight 1.000 ! spec=c13n...li-4, no=628, id=1445, vol=7.338600e+01 assign (segid " " and resid 120 and name HD1) (segid " " and resid 120 and name HG1) 2.560 0.819 0.819 weight 1.000 ! spec=c13n...li-4, no=629, id=1446, vol=1.024164e+02 assign (segid " " and resid 120 and name HD1) (segid " " and resid 119 and name HG21) 2.993 1.120 1.120 weight 1.000 ! spec=c13n...li-4, no=630, id=1447, vol=4.012520e+01 assign (segid " " and resid 120 and name HD1) (segid " " and resid 119 and name HD11) 2.817 0.992 0.992 weight 1.000 ! spec=c13n...li-4, no=631, id=1448, vol=5.773290e+01 assign (segid " " and resid 120 and name HD1) (segid " " and resid 118 and name HG21) 2.844 1.011 3.156 weight 1.000 ! spec=c13n...li-4, no=632, id=1449, vol=5.446260e+01 assign (segid " " and resid 119 and name HA) (segid " " and resid 120 and name HD2) 2.303 0.663 0.663 weight 1.000 ! spec=c13n...li-4, no=633, id=1450, vol=1.931437e+02 assign (segid " " and resid 120 and name HD1) (segid " " and resid 120 and name HD2) 2.134 0.569 0.569 weight 1.000 ! spec=c13n...li-4, no=634, id=1451, vol=3.055686e+02 assign (segid " " and resid 120 and name HD2) (segid " " and resid 120 and name HG2) 2.394 0.716 0.716 weight 1.000 ! spec=c13n...li-4, no=636, id=1452, vol=1.531171e+02 assign (segid " " and resid 120 and name HD2) (segid " " and resid 120 and name HB2) 2.642 0.873 3.358 weight 1.000 ! spec=c13n...li-4, no=637, id=1453, vol=8.473220e+01 assign (segid " " and resid 120 and name HD2) (segid " " and resid 120 and name HG1) 2.538 0.805 0.805 weight 1.000 ! spec=c13n...li-4, no=639, id=1455, vol=1.079822e+02 assign (segid " " and resid 120 and name HD2) (segid " " and resid 119 and name HG21) 2.780 0.966 3.220 weight 1.000 ! spec=c13n...li-4, no=640, id=1456, vol=6.248040e+01 assign (segid " " and resid 120 and name HD2) (segid " " and resid 118 and name HG21) 2.966 1.099 1.099 weight 1.000 ! spec=c13n...li-4, no=642, id=1458, vol=4.238080e+01 assign (segid " " and resid 112 and name HA) (segid " " and resid 112 and name HD2) 2.545 0.810 3.455 weight 1.000 ! spec=c13n...li-4, no=644, id=1460, vol=1.061316e+02 assign (segid " " and resid 112 and name HD2) (segid " " and resid 112 and name HB2) 2.061 0.531 0.531 weight 1.000 ! spec=c13n...li-4, no=647, id=1462, vol=3.757633e+02 assign (segid " " and resid 112 and name HD2) (segid " " and resid 112 and name HG1) 2.140 0.572 3.860 weight 1.000 ! spec=c13n...li-4, no=648, id=1463, vol=3.006138e+02 assign (segid " " and resid 112 and name HD2) (segid " " and resid 112 and name HG2) 2.152 0.579 0.579 weight 1.000 ! spec=c13n...li-4, no=650, id=1465, vol=2.900128e+02 assign (segid " " and resid 112 and name HD2) (segid " " and resid 112 and name HB1) 2.373 0.704 3.627 weight 1.000 ! spec=c13n...li-4, no=651, id=1466, vol=1.616812e+02 assign (segid " " and resid 168 and name HD2) (segid " " and resid 166 and name HA) 2.796 0.977 3.204 weight 1.000 ! spec=c13n...li-4, no=652, id=1467, vol=6.029710e+01 assign (segid " " and resid 168 and name HD2) (segid " " and resid 168 and name HB1) 2.403 0.722 3.597 weight 1.000 ! spec=c13n...li-4, no=655, id=1469, vol=1.498835e+02 assign (segid " " and resid 168 and name HD2) (segid " " and resid 168 and name HG2) 2.773 0.961 0.961 weight 1.000 ! spec=c13n...li-4, no=657, id=1471, vol=6.341510e+01 assign (segid " " and resid 168 and name HD2) (segid " " and resid 168 and name HD1) 2.155 0.580 0.580 weight 1.000 ! spec=c13n...li-4, no=658, id=1472, vol=2.881491e+02 assign (segid " " and resid 168 and name HD1) (segid " " and resid 168 and name HB2) 2.376 0.706 3.624 weight 1.000 ! spec=c13n...li-4, no=660, id=1473, vol=1.600909e+02 assign (segid " " and resid 168 and name HD1) (segid " " and resid 168 and name HB1) 2.455 0.754 0.754 weight 1.000 ! spec=c13n...li-4, no=661, id=1474, vol=1.315961e+02 assign (segid " " and resid 168 and name HD1) (segid " " and resid 168 and name HG2) 2.726 0.929 0.929 weight 1.000 ! spec=c13n...li-4, no=662, id=1475, vol=7.025160e+01 assign (segid " " and resid 151 and name HA2) (segid " " and resid 151 and name HA1) 1.908 0.455 0.455 weight 1.000 ! spec=c13n...li-4, no=664, id=1476, vol=5.969672e+02 assign (segid " " and resid 151 and name HA2) (segid " " and resid 142 and name HB) 2.786 0.970 0.970 weight 1.000 ! spec=c13n...li-4, no=666, id=1478, vol=6.172310e+01 assign (segid " " and resid 151 and name HA2) (segid " " and resid 142 and name HG21) 2.193 0.601 3.807 weight 1.000 ! spec=c13n...li-4, no=667, id=1479, vol=2.589113e+02 assign (segid " " and resid 151 and name HA2) (segid " " and resid 139 and name HG21) 2.589 0.838 0.838 weight 1.000 ! spec=c13n...li-4, no=668, id=1480, vol=9.575990e+01 assign (segid " " and resid 151 and name HA1) (segid " " and resid 142 and name HB) 2.718 0.923 0.923 weight 1.000 ! spec=c13n...li-4, no=671, id=1482, vol=7.150370e+01 assign (segid " " and resid 151 and name HA1) (segid " " and resid 142 and name HG21) 2.174 0.591 0.591 weight 1.000 ! spec=c13n...li-4, no=672, id=1483, vol=2.728915e+02 assign (segid " " and resid 151 and name HA1) (segid " " and resid 139 and name HG22) 2.712 0.920 0.920 weight 1.000 ! spec=c13n...li-4, no=673, id=1484, vol=7.243440e+01 or (segid " " and resid 151 and name HA1) (segid " " and resid 139 and name HG21) or (segid " " and resid 151 and name HA1) (segid " " and resid 139 and name HG23) assign (segid " " and resid 147 and name HA2) (segid " " and resid 147 and name HA1) 1.913 0.458 0.458 weight 1.000 ! spec=c13n...li-4, no=677, id=1486, vol=5.875144e+02 assign (segid " " and resid 109 and name HD1) (segid " " and resid 109 and name HD2) 1.991 0.496 0.496 weight 1.000 ! spec=c13n...li-4, no=683, id=1489, vol=4.626281e+02 assign (segid " " and resid 109 and name HD1) (segid " " and resid 109 and name HB1) 2.474 0.765 3.526 weight 1.000 ! spec=c13n...li-4, no=684, id=1490, vol=1.258988e+02 assign (segid " " and resid 109 and name HD1) (segid " " and resid 109 and name HB2) 2.544 0.809 0.809 weight 1.000 ! spec=c13n...li-4, no=685, id=1491, vol=1.062919e+02 assign (segid " " and resid 109 and name HD1) (segid " " and resid 109 and name HG2) 2.505 0.785 0.785 weight 1.000 ! spec=c13n...li-4, no=686, id=1492, vol=1.166322e+02 assign (segid " " and resid 109 and name HD1) (segid " " and resid 108 and name HB2) 2.532 0.801 0.801 weight 1.000 ! spec=c13n...li-4, no=687, id=1493, vol=1.094660e+02 assign (segid " " and resid 109 and name HD1) (segid " " and resid 105 and name HD11) 2.781 0.966 0.966 weight 1.000 ! spec=c13n...li-4, no=689, id=1495, vol=6.238580e+01 assign (segid " " and resid 109 and name HA) (segid " " and resid 109 and name HD2) 2.671 0.892 0.892 weight 1.000 ! spec=c13n...li-4, no=691, id=1497, vol=7.935080e+01 assign (segid " " and resid 109 and name HD2) (segid " " and resid 109 and name HB1) 2.554 0.815 3.446 weight 1.000 ! spec=c13n...li-4, no=693, id=1499, vol=1.039035e+02 assign (segid " " and resid 109 and name HD2) (segid " " and resid 109 and name HB2) 2.215 0.613 0.613 weight 1.000 ! spec=c13n...li-4, no=694, id=1500, vol=2.442239e+02 assign (segid " " and resid 109 and name HD2) (segid " " and resid 108 and name HB2) 2.490 0.775 0.775 weight 1.000 ! spec=c13n...li-4, no=695, id=1501, vol=1.208761e+02 assign (segid " " and resid 109 and name HD2) (segid " " and resid 109 and name HG2) 2.077 0.539 0.539 weight 1.000 ! spec=c13n...li-4, no=696, id=1502, vol=3.596592e+02 assign (segid " " and resid 109 and name HD2) (segid " " and resid 105 and name HD11) 2.602 0.846 0.846 weight 1.000 ! spec=c13n...li-4, no=697, id=1503, vol=9.297930e+01 assign (segid " " and resid 179 and name HA) (segid " " and resid 179 and name HD2) 2.481 0.769 3.519 weight 1.000 ! spec=c13n...li-4, no=699, id=1505, vol=1.237257e+02 assign (segid " " and resid 179 and name HD2) (segid " " and resid 179 and name HB2) 2.314 0.670 3.686 weight 1.000 ! spec=c13n...li-4, no=701, id=1506, vol=1.876220e+02 assign (segid " " and resid 179 and name HD2) (segid " " and resid 179 and name HB1) 2.319 0.672 0.672 weight 1.000 ! spec=c13n...li-4, no=702, id=1507, vol=1.852800e+02 assign (segid " " and resid 179 and name HD2) (segid " " and resid 179 and name HG2) 1.860 0.432 4.140 weight 1.000 ! spec=c13n...li-4, no=703, id=1508, vol=6.961089e+02 assign (segid " " and resid 117 and name HA) (segid " " and resid 117 and name HD2) 2.638 0.870 0.870 weight 1.000 ! spec=c13n...li-4, no=704, id=1509, vol=8.559260e+01 assign (segid " " and resid 117 and name HA) (segid " " and resid 117 and name HD1) 2.672 0.892 3.328 weight 1.000 ! spec=c13n...li-4, no=705, id=1510, vol=7.931550e+01 assign (segid " " and resid 161 and name HA) (segid " " and resid 161 and name HD2) 2.618 0.857 3.382 weight 1.000 ! spec=c13n...li-4, no=706, id=1511, vol=8.948510e+01 assign (segid " " and resid 158 and name HA) (segid " " and resid 161 and name HD2) 2.696 0.908 3.304 weight 1.000 ! spec=c13n...li-4, no=708, id=1513, vol=7.514330e+01 assign (segid " " and resid 117 and name HD2) (segid " " and resid 117 and name HB2) 2.421 0.733 0.733 weight 1.000 ! spec=c13n...li-4, no=711, id=1514, vol=1.430327e+02 assign (segid " " and resid 117 and name HD2) (segid " " and resid 117 and name HG1) 2.419 0.731 0.731 weight 1.000 ! spec=c13n...li-4, no=717, id=1519, vol=1.438937e+02 assign (segid " " and resid 117 and name HD1) (segid " " and resid 184 and name HB2) 2.373 0.704 3.627 weight 1.000 ! spec=c13n...li-4, no=724, id=1524, vol=1.615932e+02 assign (segid " " and resid 117 and name HD1) (segid " " and resid 185 and name HD11) 3.058 1.169 1.169 weight 1.000 ! spec=c13n...li-4, no=726, id=1526, vol=3.525780e+01 assign (segid " " and resid 110 and name HB2) (segid " " and resid 182 and name HE1) 2.775 0.963 0.963 weight 1.000 ! spec=c13n...li-4, no=727, id=1527, vol=6.309260e+01 assign (segid " " and resid 110 and name HB2) (segid " " and resid 111 and name HA) 2.750 0.946 3.250 weight 1.000 ! spec=c13n...li-4, no=728, id=1528, vol=6.661930e+01 assign (segid " " and resid 110 and name HB2) (segid " " and resid 110 and name HG) 2.492 0.776 0.776 weight 1.000 ! spec=c13n...li-4, no=729, id=1529, vol=1.203006e+02 assign (segid " " and resid 100 and name HB2) (segid " " and resid 100 and name HD21) 2.309 0.667 3.691 weight 1.000 ! spec=c13n...li-4, no=734, id=1533, vol=1.900771e+02 assign (segid " " and resid 131 and name HA) (segid " " and resid 131 and name HB2) 2.466 0.760 0.760 weight 1.000 ! spec=c13n...li-4, no=735, id=1534, vol=1.282004e+02 assign (segid " " and resid 131 and name HB2) (segid " " and resid 131 and name HD11) 2.252 0.634 0.634 weight 1.000 ! spec=c13n...li-4, no=738, id=1536, vol=2.208116e+02 assign (segid " " and resid 131 and name HB2) (segid " " and resid 131 and name HB1) 2.041 0.521 0.521 weight 1.000 ! spec=c13n...li-4, no=741, id=1539, vol=3.990939e+02 assign (segid " " and resid 131 and name HB1) (segid " " and resid 127 and name HD21) 3.101 1.202 1.202 weight 1.000 ! spec=c13n...li-4, no=743, id=1540, vol=3.241160e+01 assign (segid " " and resid 131 and name HB1) (segid " " and resid 131 and name HD11) 2.201 0.606 3.799 weight 1.000 ! spec=c13n...li-4, no=744, id=1541, vol=2.534496e+02 assign (segid " " and resid 95 and name HE2) (segid " " and resid 93 and name HA) 2.983 1.113 1.113 weight 1.000 ! spec=c13n...li-4, no=747, id=1542, vol=4.089450e+01 assign (segid " " and resid 177 and name HE1) (segid " " and resid 177 and name HE2) 1.881 0.442 0.442 weight 1.000 ! spec=c13n...li-4, no=748, id=1543, vol=6.504707e+02 assign (segid " " and resid 177 and name HE1) (segid " " and resid 176 and name HG2) 2.820 0.994 0.994 weight 1.000 ! spec=c13n...li-4, no=750, id=1544, vol=5.734590e+01 assign (segid " " and resid 177 and name HE1) (segid " " and resid 176 and name HB2) 2.613 0.854 3.387 weight 1.000 ! spec=c13n...li-4, no=752, id=1545, vol=9.049480e+01 assign (segid " " and resid 177 and name HE1) (segid " " and resid 177 and name HB2) 2.495 0.778 0.778 weight 1.000 ! spec=c13n...li-4, no=753, id=1546, vol=1.193928e+02 assign (segid " " and resid 177 and name HE1) (segid " " and resid 177 and name HD2) 2.496 0.778 0.778 weight 1.000 ! spec=c13n...li-4, no=755, id=1548, vol=1.193746e+02 assign (segid " " and resid 177 and name HE1) (segid " " and resid 177 and name HG2) 2.562 0.820 0.820 weight 1.000 ! spec=c13n...li-4, no=756, id=1549, vol=1.020466e+02 assign (segid " " and resid 181 and name HE2) (segid " " and resid 181 and name HG2) 2.596 0.842 0.842 weight 1.000 ! spec=c13n...li-4, no=758, id=1551, vol=9.422020e+01 assign (segid " " and resid 96 and name HE2) (segid " " and resid 96 and name HD2) 2.386 0.712 0.712 weight 1.000 ! spec=c13n...li-4, no=763, id=1555, vol=1.560970e+02 assign (segid " " and resid 169 and name HE2) (segid " " and resid 103 and name HE1) 2.907 1.056 3.093 weight 1.000 ! spec=c13n...li-4, no=770, id=1562, vol=4.777990e+01 assign (segid " " and resid 99 and name HA) (segid " " and resid 99 and name HE2) 2.619 0.858 0.858 weight 1.000 ! spec=c13n...li-4, no=773, id=1564, vol=8.927670e+01 assign (segid " " and resid 169 and name HE2) (segid " " and resid 165 and name HB1) 2.315 0.670 3.685 weight 1.000 ! spec=c13n...li-4, no=780, id=1568, vol=1.874348e+02 assign (segid " " and resid 99 and name HE2) (segid " " and resid 99 and name HB2) 2.190 0.599 0.599 weight 1.000 ! spec=c13n...li-4, no=783, id=1570, vol=2.615482e+02 assign (segid " " and resid 169 and name HE2) (segid " " and resid 169 and name HG2) 2.029 0.514 0.514 weight 1.000 ! spec=c13n...li-4, no=787, id=1574, vol=4.135518e+02 assign (segid " " and resid 146 and name HE2) (segid " " and resid 146 and name HG1) 2.488 0.774 0.774 weight 1.000 ! spec=c13n...li-4, no=788, id=1575, vol=1.214527e+02 assign (segid " " and resid 108 and name HE2) (segid " " and resid 160 and name HD21) 2.347 0.688 3.653 weight 1.000 ! spec=c13n...li-4, no=789, id=1576, vol=1.725574e+02 assign (segid " " and resid 169 and name HE2) (segid " " and resid 100 and name HD21) 2.119 0.561 3.881 weight 1.000 ! spec=c13n...li-4, no=790, id=1577, vol=3.187784e+02 assign (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HE2) 2.843 1.010 1.010 weight 1.000 ! spec=c13n...li-4, no=794, id=1581, vol=5.461520e+01 assign (segid " " and resid 126 and name HB2) (segid " " and resid 170 and name HA) 2.906 1.056 3.094 weight 1.000 ! spec=c13n...li-4, no=795, id=1582, vol=4.787950e+01 assign (segid " " and resid 163 and name HB2) (segid " " and resid 163 and name HB1) 1.847 0.427 0.427 weight 1.000 ! spec=c13n...li-4, no=796, id=1583, vol=7.258929e+02 assign (segid " " and resid 122 and name HB2) (segid " " and resid 119 and name HB) 2.487 0.773 0.773 weight 1.000 ! spec=c13n...li-4, no=800, id=1585, vol=1.217383e+02 assign (segid " " and resid 154 and name HE2) (segid " " and resid 157 and name HG2) 2.613 0.853 3.387 weight 1.000 ! spec=c13n...li-4, no=801, id=1586, vol=9.065070e+01 assign (segid " " and resid 154 and name HE2) (segid " " and resid 154 and name HD2) 2.415 0.729 0.729 weight 1.000 ! spec=c13n...li-4, no=803, id=1588, vol=1.451810e+02 assign (segid " " and resid 154 and name HE2) (segid " " and resid 139 and name HD11) 2.409 0.725 3.591 weight 1.000 ! spec=c13n...li-4, no=807, id=1592, vol=1.476669e+02 assign (segid " " and resid 122 and name HB2) (segid " " and resid 119 and name HG21) 2.654 0.880 3.346 weight 1.000 ! spec=c13n...li-4, no=809, id=1594, vol=8.256420e+01 assign (segid " " and resid 126 and name HB1) (segid " " and resid 174 and name HB1) 2.337 0.683 0.683 weight 1.000 ! spec=c13n...li-4, no=811, id=1596, vol=1.770846e+02 assign (segid " " and resid 154 and name HE2) (segid " " and resid 154 and name HE1) 1.727 0.373 0.373 weight 1.000 ! spec=c13n...li-4, no=815, id=1598, vol=1.087459e+03 assign (segid " " and resid 154 and name HE1) (segid " " and resid 154 and name HB2) 2.706 0.916 3.294 weight 1.000 ! spec=c13n...li-4, no=817, id=1599, vol=7.337380e+01 assign (segid " " and resid 154 and name HE1) (segid " " and resid 154 and name HD2) 2.353 0.692 0.692 weight 1.000 ! spec=c13n...li-4, no=819, id=1601, vol=1.698390e+02 assign (segid " " and resid 154 and name HE1) (segid " " and resid 154 and name HD1) 2.474 0.765 0.765 weight 1.000 ! spec=c13n...li-4, no=820, id=1602, vol=1.256112e+02 assign (segid " " and resid 154 and name HE1) (segid " " and resid 154 and name HG2) 2.567 0.824 0.824 weight 1.000 ! spec=c13n...li-4, no=821, id=1603, vol=1.007448e+02 assign (segid " " and resid 154 and name HE1) (segid " " and resid 139 and name HD11) 3.351 1.691 1.691 weight 1.000 ! spec=c13n...li-4, no=822, id=1604, vol=1.708848e+02 assign (segid " " and resid 155 and name HA) (segid " " and resid 155 and name HB1) 2.321 0.673 0.673 weight 1.000 ! spec=c13n...li-4, no=825, id=1606, vol=1.845132e+02 assign (segid " " and resid 175 and name HB2) (segid " " and resid 175 and name HG) 2.660 0.885 0.885 weight 1.000 ! spec=c13n...li-4, no=828, id=1608, vol=8.131390e+01 assign (segid " " and resid 175 and name HB2) (segid " " and resid 172 and name HB1) 3.048 1.161 1.161 weight 1.000 ! spec=c13n...li-4, no=830, id=1609, vol=3.599410e+01 assign (segid " " and resid 155 and name HB1) (segid " " and resid 155 and name HG) 2.550 0.813 0.813 weight 1.000 ! spec=c13n...li-4, no=832, id=1611, vol=1.047663e+02 assign (segid " " and resid 175 and name HB2) (segid " " and resid 175 and name HD11) 2.497 0.779 0.779 weight 1.000 ! spec=c13n...li-4, no=835, id=1613, vol=1.189862e+02 assign (segid " " and resid 175 and name HB2) (segid " " and resid 175 and name HD21) 2.725 0.928 0.928 weight 1.000 ! spec=c13n...li-4, no=836, id=1614, vol=7.039000e+01 assign (segid " " and resid 155 and name HB1) (segid " " and resid 155 and name HD11) 2.200 0.605 0.605 weight 1.000 ! spec=c13n...li-4, no=838, id=1615, vol=2.544179e+02 assign (segid " " and resid 107 and name HB2) (segid " " and resid 186 and name HH2) 3.008 1.131 1.131 weight 1.000 ! spec=c13n...li-4, no=839, id=1616, vol=3.894170e+01 assign (segid " " and resid 155 and name HB1) (segid " " and resid 114 and name HE1) 2.876 1.034 1.034 weight 1.000 ! spec=c13n...li-4, no=840, id=1617, vol=5.098220e+01 assign (segid " " and resid 106 and name HA) (segid " " and resid 106 and name HB2) 2.587 0.837 0.837 weight 1.000 ! spec=c13n...li-4, no=844, id=1621, vol=9.611830e+01 assign (segid " " and resid 171 and name HB2) (segid " " and resid 171 and name HA) 2.625 0.861 0.861 weight 1.000 ! spec=c13n...li-4, no=845, id=1622, vol=8.812570e+01 assign (segid " " and resid 106 and name HB2) (segid " " and resid 102 and name HB2) 2.541 0.807 3.459 weight 1.000 ! spec=c13n...li-4, no=849, id=1623, vol=1.070064e+02 assign (segid " " and resid 171 and name HB2) (segid " " and resid 171 and name HB1) 2.274 0.646 0.646 weight 1.000 ! spec=c13n...li-4, no=851, id=1625, vol=2.085756e+02 assign (segid " " and resid 106 and name HB2) (segid " " and resid 106 and name HD21) 2.524 0.796 0.796 weight 1.000 ! spec=c13n...li-4, no=852, id=1626, vol=1.115327e+02 assign (segid " " and resid 171 and name HB2) (segid " " and resid 171 and name HG) 2.771 0.960 0.960 weight 1.000 ! spec=c13n...li-4, no=853, id=1627, vol=6.374010e+01 assign (segid " " and resid 107 and name HB2) (segid " " and resid 107 and name HG) 2.738 0.937 0.937 weight 1.000 ! spec=c13n...li-4, no=854, id=1628, vol=6.850060e+01 assign (segid " " and resid 171 and name HB2) (segid " " and resid 171 and name HD11) 2.573 0.828 0.828 weight 1.000 ! spec=c13n...li-4, no=859, id=1633, vol=9.926760e+01 assign (segid " " and resid 107 and name HB1) (segid " " and resid 186 and name HZ3) 3.008 1.131 1.131 weight 1.000 ! spec=c13n...li-4, no=860, id=1634, vol=3.891370e+01 assign (segid " " and resid 107 and name HB2) (segid " " and resid 107 and name HB1) 2.366 0.699 0.699 weight 1.000 ! spec=c13n...li-4, no=862, id=1636, vol=1.645397e+02 assign (segid " " and resid 107 and name HB1) (segid " " and resid 107 and name HG) 2.866 1.026 1.026 weight 1.000 ! spec=c13n...li-4, no=864, id=1637, vol=5.207010e+01 assign (segid " " and resid 140 and name HB2) (segid " " and resid 137 and name HA) 2.228 0.620 0.620 weight 1.000 ! spec=c13n...li-4, no=871, id=1644, vol=2.358282e+02 assign (segid " " and resid 100 and name HB2) (segid " " and resid 100 and name HB1) 1.832 0.420 0.420 weight 1.000 ! spec=c13n...li-4, no=874, id=1646, vol=7.627815e+02 assign (segid " " and resid 105 and name HB2) (segid " " and resid 104 and name HB1) 2.371 0.703 0.703 weight 1.000 ! spec=c13n...li-4, no=876, id=1648, vol=1.622014e+02 assign (segid " " and resid 140 and name HB2) (segid " " and resid 140 and name HB1) 1.847 0.426 0.426 weight 1.000 ! spec=c13n...li-4, no=879, id=1650, vol=7.265950e+02 assign (segid " " and resid 100 and name HB2) (segid " " and resid 100 and name HD11) 2.270 0.644 0.644 weight 1.000 ! spec=c13n...li-4, no=881, id=1652, vol=2.107198e+02 assign (segid " " and resid 140 and name HB2) (segid " " and resid 140 and name HD12) 2.004 0.502 0.502 weight 1.000 ! spec=c13n...li-4, no=883, id=1654, vol=4.456899e+02 or (segid " " and resid 140 and name HB2) (segid " " and resid 140 and name HD11) or (segid " " and resid 140 and name HB2) (segid " " and resid 140 and name HD13) assign (segid " " and resid 100 and name HA) (segid " " and resid 100 and name HB1) 2.585 0.835 0.835 weight 1.000 ! spec=c13n...li-4, no=885, id=1656, vol=9.670120e+01 assign (segid " " and resid 160 and name HA) (segid " " and resid 160 and name HB2) 2.580 0.832 0.832 weight 1.000 ! spec=c13n...li-4, no=887, id=1658, vol=9.781470e+01 assign (segid " " and resid 160 and name HB2) (segid " " and resid 160 and name HB1) 2.042 0.521 0.521 weight 1.000 ! spec=c13n...li-4, no=891, id=1660, vol=3.979654e+02 assign (segid " " and resid 100 and name HB1) (segid " " and resid 100 and name HD11) 2.290 0.656 3.710 weight 1.000 ! spec=c13n...li-4, no=892, id=1661, vol=1.998174e+02 assign (segid " " and resid 100 and name HB1) (segid " " and resid 100 and name HD21) 2.244 0.630 3.756 weight 1.000 ! spec=c13n...li-4, no=893, id=1662, vol=2.255949e+02 assign (segid " " and resid 106 and name HB1) (segid " " and resid 103 and name HB2) 2.931 1.074 3.069 weight 1.000 ! spec=c13n...li-4, no=899, id=1668, vol=4.549420e+01 assign (segid " " and resid 127 and name HB2) (segid " " and resid 127 and name HD21) 2.242 0.628 3.758 weight 1.000 ! spec=c13n...li-4, no=900, id=1669, vol=2.269166e+02 assign (segid " " and resid 127 and name HB2) (segid " " and resid 123 and name HD11) 2.849 1.015 3.151 weight 1.000 ! spec=c13n...li-4, no=901, id=1670, vol=5.386530e+01 assign (segid " " and resid 106 and name HA) (segid " " and resid 106 and name HB1) 2.510 0.787 0.787 weight 1.000 ! spec=c13n...li-4, no=903, id=1672, vol=1.153538e+02 assign (segid " " and resid 173 and name HA) (segid " " and resid 173 and name HB1) 2.282 0.651 0.651 weight 1.000 ! spec=c13n...li-4, no=904, id=1673, vol=2.042224e+02 assign (segid " " and resid 106 and name HB2) (segid " " and resid 106 and name HB1) 2.154 0.580 0.580 weight 1.000 ! spec=c13n...li-4, no=908, id=1676, vol=2.887319e+02 assign (segid " " and resid 127 and name HG) (segid " " and resid 127 and name HD11) 2.223 0.618 0.618 weight 1.000 ! spec=c13n...li-4, no=915, id=1682, vol=2.391449e+02 assign (segid " " and resid 106 and name HB1) (segid " " and resid 106 and name HD11) 2.370 0.702 0.702 weight 1.000 ! spec=c13n...li-4, no=918, id=1684, vol=1.626734e+02 assign (segid " " and resid 171 and name HB1) (segid " " and resid 167 and name HE3) 3.076 1.182 1.182 weight 1.000 ! spec=c13n...li-4, no=919, id=1685, vol=3.406280e+01 assign (segid " " and resid 171 and name HA) (segid " " and resid 171 and name HB1) 2.502 0.782 0.782 weight 1.000 ! spec=c13n...li-4, no=921, id=1687, vol=1.176701e+02 assign (segid " " and resid 105 and name HB1) (segid " " and resid 102 and name HA) 2.813 0.989 3.187 weight 1.000 ! spec=c13n...li-4, no=922, id=1688, vol=5.824110e+01 assign (segid " " and resid 140 and name HA) (segid " " and resid 140 and name HB1) 2.335 0.682 0.682 weight 1.000 ! spec=c13n...li-4, no=923, id=1689, vol=1.777141e+02 assign (segid " " and resid 175 and name HB1) (segid " " and resid 175 and name HG) 2.276 0.647 0.647 weight 1.000 ! spec=c13n...li-4, no=924, id=1690, vol=2.074538e+02 assign (segid " " and resid 105 and name HB1) (segid " " and resid 108 and name HB2) 2.588 0.837 3.412 weight 1.000 ! spec=c13n...li-4, no=925, id=1691, vol=9.587540e+01 assign (segid " " and resid 105 and name HB2) (segid " " and resid 105 and name HB1) 1.827 0.417 0.417 weight 1.000 ! spec=c13n...li-4, no=926, id=1692, vol=7.757940e+02 assign (segid " " and resid 105 and name HB1) (segid " " and resid 108 and name HD2) 2.462 0.758 3.538 weight 1.000 ! spec=c13n...li-4, no=927, id=1693, vol=1.295292e+02 assign (segid " " and resid 140 and name HB1) (segid " " and resid 140 and name HG) 2.472 0.764 0.764 weight 1.000 ! spec=c13n...li-4, no=929, id=1695, vol=1.263178e+02 assign (segid " " and resid 171 and name HB1) (segid " " and resid 171 and name HG) 2.749 0.944 0.944 weight 1.000 ! spec=c13n...li-4, no=932, id=1696, vol=6.688270e+01 assign (segid " " and resid 140 and name HB1) (segid " " and resid 140 and name HD11) 2.074 0.538 3.926 weight 1.000 ! spec=c13n...li-4, no=934, id=1698, vol=3.620818e+02 assign (segid " " and resid 171 and name HB1) (segid " " and resid 171 and name HD11) 2.540 0.807 0.807 weight 1.000 ! spec=c13n...li-4, no=935, id=1699, vol=1.073394e+02 assign (segid " " and resid 175 and name HB2) (segid " " and resid 175 and name HB1) 2.402 0.721 0.721 weight 1.000 ! spec=c13n...li-4, no=941, id=1705, vol=1.501310e+02 assign (segid " " and resid 185 and name HB2) (segid " " and resid 185 and name HD11) 2.313 0.669 0.669 weight 1.000 ! spec=c13n...li-4, no=945, id=1708, vol=1.885037e+02 assign (segid " " and resid 175 and name HB1) (segid " " and resid 175 and name HD22) 2.575 0.829 0.829 weight 1.000 ! spec=c13n...li-4, no=947, id=1710, vol=9.887890e+01 or (segid " " and resid 175 and name HB1) (segid " " and resid 175 and name HD21) or (segid " " and resid 175 and name HB1) (segid " " and resid 175 and name HD23) assign (segid " " and resid 155 and name HA) (segid " " and resid 155 and name HB2) 2.382 0.709 0.709 weight 1.000 ! spec=c13n...li-4, no=949, id=1712, vol=1.578697e+02 assign (segid " " and resid 155 and name HB1) (segid " " and resid 155 and name HB2) 2.021 0.510 0.510 weight 1.000 ! spec=c13n...li-4, no=952, id=1714, vol=4.236275e+02 assign (segid " " and resid 155 and name HB2) (segid " " and resid 155 and name HG) 2.551 0.813 0.813 weight 1.000 ! spec=c13n...li-4, no=954, id=1715, vol=1.047338e+02 assign (segid " " and resid 160 and name HB1) (segid " " and resid 160 and name HD12) 2.481 0.769 0.769 weight 1.000 ! spec=c13n...li-4, no=956, id=1716, vol=1.236122e+02 or (segid " " and resid 160 and name HB1) (segid " " and resid 160 and name HD11) or (segid " " and resid 160 and name HB1) (segid " " and resid 160 and name HD13) assign (segid " " and resid 155 and name HB2) (segid " " and resid 155 and name HD11) 2.113 0.558 0.558 weight 1.000 ! spec=c13n...li-4, no=957, id=1717, vol=3.237284e+02 assign (segid " " and resid 155 and name HB2) (segid " " and resid 139 and name HG22) 2.774 0.962 0.962 weight 1.000 ! spec=c13n...li-4, no=958, id=1718, vol=6.330910e+01 or (segid " " and resid 155 and name HB2) (segid " " and resid 139 and name HG21) or (segid " " and resid 155 and name HB2) (segid " " and resid 139 and name HG23) assign (segid " " and resid 185 and name HB2) (segid " " and resid 185 and name HB1) 2.121 0.562 0.562 weight 1.000 ! spec=c13n...li-4, no=960, id=1720, vol=3.168377e+02 assign (segid " " and resid 185 and name HB1) (segid " " and resid 185 and name HD11) 2.309 0.667 0.667 weight 1.000 ! spec=c13n...li-4, no=962, id=1721, vol=1.901284e+02 assign (segid " " and resid 114 and name HB2) (segid " " and resid 114 and name HD1) 2.481 0.769 0.769 weight 1.000 ! spec=c13n...li-4, no=963, id=1722, vol=1.237368e+02 assign (segid " " and resid 114 and name HB2) (segid " " and resid 115 and name HA) 2.563 0.821 3.437 weight 1.000 ! spec=c13n...li-4, no=964, id=1723, vol=1.016963e+02 assign (segid " " and resid 182 and name HB2) (segid " " and resid 182 and name HD1) 2.441 0.745 0.745 weight 1.000 ! spec=c13n...li-4, no=969, id=1726, vol=1.363967e+02 assign (segid " " and resid 182 and name HB2) (segid " " and resid 182 and name HB1) 2.283 0.651 0.651 weight 1.000 ! spec=c13n...li-4, no=972, id=1728, vol=2.038734e+02 assign (segid " " and resid 182 and name HB2) (segid " " and resid 117 and name HB2) 3.012 1.134 1.134 weight 1.000 ! spec=c13n...li-4, no=973, id=1729, vol=3.861470e+01 assign (segid " " and resid 182 and name HB2) (segid " " and resid 118 and name HD11) 2.707 0.916 3.293 weight 1.000 ! spec=c13n...li-4, no=975, id=1731, vol=7.324320e+01 assign (segid " " and resid 182 and name HB1) (segid " " and resid 182 and name HD1) 2.512 0.789 3.488 weight 1.000 ! spec=c13n...li-4, no=976, id=1732, vol=1.146290e+02 assign (segid " " and resid 182 and name HB1) (segid " " and resid 117 and name HB2) 3.053 1.165 1.165 weight 1.000 ! spec=c13n...li-4, no=980, id=1735, vol=3.562420e+01 assign (segid " " and resid 182 and name HB1) (segid " " and resid 118 and name HD12) 2.730 0.932 0.932 weight 1.000 ! spec=c13n...li-4, no=982, id=1737, vol=6.967150e+01 or (segid " " and resid 182 and name HB1) (segid " " and resid 118 and name HD11) or (segid " " and resid 182 and name HB1) (segid " " and resid 118 and name HD13) assign (segid " " and resid 114 and name HB1) (segid " " and resid 114 and name HD1) 2.413 0.728 3.587 weight 1.000 ! spec=c13n...li-4, no=983, id=1738, vol=1.460283e+02 assign (segid " " and resid 114 and name HB1) (segid " " and resid 115 and name HA) 2.600 0.845 3.400 weight 1.000 ! spec=c13n...li-4, no=984, id=1739, vol=9.330310e+01 assign (segid " " and resid 114 and name HB2) (segid " " and resid 114 and name HB1) 2.197 0.604 0.604 weight 1.000 ! spec=c13n...li-4, no=986, id=1741, vol=2.561860e+02 assign (segid " " and resid 132 and name HB) (segid " " and resid 132 and name HG12) 2.264 0.641 0.641 weight 1.000 ! spec=c13n...li-4, no=990, id=1743, vol=2.138311e+02 assign (segid " " and resid 139 and name HB) (segid " " and resid 139 and name HG21) 2.042 0.521 0.521 weight 1.000 ! spec=c13n...li-4, no=995, id=1748, vol=3.978174e+02 assign (segid " " and resid 159 and name HB2) (segid " " and resid 159 and name HG) 2.678 0.897 0.897 weight 1.000 ! spec=c13n...li-4, no=997, id=1750, vol=7.812110e+01 assign (segid " " and resid 159 and name HB2) (segid " " and resid 159 and name HD11) 2.385 0.711 3.615 weight 1.000 ! spec=c13n...li-4, no=999, id=1751, vol=1.566032e+02 assign (segid " " and resid 159 and name HB2) (segid " " and resid 159 and name HB1) 2.347 0.689 0.689 weight 1.000 ! spec=c13n...li-4, no=1001, id=1753, vol=1.723106e+02 assign (segid " " and resid 159 and name HB1) (segid " " and resid 159 and name HG) 2.860 1.023 1.023 weight 1.000 ! spec=c13n...li-4, no=1003, id=1755, vol=5.263600e+01 assign (segid " " and resid 159 and name HB1) (segid " " and resid 159 and name HD11) 2.441 0.745 3.559 weight 1.000 ! spec=c13n...li-4, no=1006, id=1758, vol=1.363331e+02 assign (segid " " and resid 103 and name HB2) (segid " " and resid 103 and name HD1) 2.555 0.816 0.816 weight 1.000 ! spec=c13n...li-4, no=1008, id=1759, vol=1.035980e+02 assign (segid " " and resid 166 and name HB2) (segid " " and resid 130 and name HB2) 2.674 0.894 0.894 weight 1.000 ! spec=c13n...li-4, no=1012, id=1763, vol=7.881800e+01 assign (segid " " and resid 166 and name HB2) (segid " " and resid 166 and name HB1) 1.829 0.418 0.418 weight 1.000 ! spec=c13n...li-4, no=1015, id=1764, vol=7.693803e+02 assign (segid " " and resid 133 and name HB2) (segid " " and resid 136 and name HB1) 2.499 0.781 3.501 weight 1.000 ! spec=c13n...li-4, no=1018, id=1767, vol=1.184112e+02 assign (segid " " and resid 133 and name HB2) (segid " " and resid 134 and name HG2) 3.011 1.133 2.989 weight 1.000 ! spec=c13n...li-4, no=1021, id=1769, vol=3.871230e+01 assign (segid " " and resid 103 and name HB2) (segid " " and resid 100 and name HB2) 2.870 1.029 3.130 weight 1.000 ! spec=c13n...li-4, no=1022, id=1770, vol=5.163540e+01 assign (segid " " and resid 103 and name HB2) (segid " " and resid 168 and name HB2) 2.744 0.941 0.941 weight 1.000 ! spec=c13n...li-4, no=1024, id=1772, vol=6.756690e+01 assign (segid " " and resid 133 and name HA) (segid " " and resid 133 and name HB1) 2.191 0.600 3.809 weight 1.000 ! spec=c13n...li-4, no=1026, id=1774, vol=2.607621e+02 assign (segid " " and resid 166 and name HB1) (segid " " and resid 130 and name HB2) 2.779 0.965 0.965 weight 1.000 ! spec=c13n...li-4, no=1027, id=1775, vol=6.260430e+01 assign (segid " " and resid 133 and name HB1) (segid " " and resid 134 and name HG2) 3.072 1.180 1.180 weight 1.000 ! spec=c13n...li-4, no=1032, id=1776, vol=3.428970e+01 assign (segid " " and resid 133 and name HB1) (segid " " and resid 137 and name HG2) 3.092 1.195 1.195 weight 1.000 ! spec=c13n...li-4, no=1033, id=1777, vol=3.302690e+01 assign (segid " " and resid 166 and name HB1) (segid " " and resid 169 and name HB2) 2.926 1.070 1.070 weight 1.000 ! spec=c13n...li-4, no=1034, id=1778, vol=4.596890e+01 assign (segid " " and resid 133 and name HB1) (segid " " and resid 132 and name HB) 3.101 1.202 1.202 weight 1.000 ! spec=c13n...li-4, no=1035, id=1779, vol=3.244180e+01 assign (segid " " and resid 103 and name HB1) (segid " " and resid 103 and name HD1) 2.491 0.776 3.509 weight 1.000 ! spec=c13n...li-4, no=1036, id=1780, vol=1.207299e+02 assign (segid " " and resid 103 and name HA) (segid " " and resid 103 and name HB1) 2.667 0.889 0.889 weight 1.000 ! spec=c13n...li-4, no=1037, id=1781, vol=8.018490e+01 assign (segid " " and resid 103 and name HB2) (segid " " and resid 103 and name HB1) 2.333 0.680 0.680 weight 1.000 ! spec=c13n...li-4, no=1038, id=1782, vol=1.790413e+02 assign (segid " " and resid 113 and name HA) (segid " " and resid 113 and name HG2) 2.505 0.785 3.495 weight 1.000 ! spec=c13n...li-4, no=1041, id=1784, vol=1.165606e+02 assign (segid " " and resid 176 and name HG2) (segid " " and resid 177 and name HE2) 2.923 1.068 1.068 weight 1.000 ! spec=c13n...li-4, no=1042, id=1785, vol=4.621070e+01 assign (segid " " and resid 176 and name HG2) (segid " " and resid 176 and name HG1) 2.277 0.648 0.648 weight 1.000 ! spec=c13n...li-4, no=1047, id=1789, vol=2.067073e+02 assign (segid " " and resid 176 and name HG2) (segid " " and resid 173 and name HD12) 3.051 1.163 2.949 weight 1.000 ! spec=c13n...li-4, no=1051, id=1792, vol=3.577420e+01 or (segid " " and resid 176 and name HG2) (segid " " and resid 173 and name HD11) or (segid " " and resid 176 and name HG2) (segid " " and resid 173 and name HD13) assign (segid " " and resid 150 and name HA) (segid " " and resid 153 and name HG2) 2.775 0.963 0.963 weight 1.000 ! spec=c13n...li-4, no=1052, id=1793, vol=6.308830e+01 assign (segid " " and resid 153 and name HG2) (segid " " and resid 153 and name HG1) 1.737 0.377 0.377 weight 1.000 ! spec=c13n...li-4, no=1059, id=1798, vol=1.051260e+03 assign (segid " " and resid 113 and name HG2) (segid " " and resid 110 and name HB2) 2.653 0.880 3.347 weight 1.000 ! spec=c13n...li-4, no=1060, id=1799, vol=8.267640e+01 assign (segid " " and resid 113 and name HG2) (segid " " and resid 113 and name HG1) 1.854 0.430 0.430 weight 1.000 ! spec=c13n...li-4, no=1062, id=1800, vol=7.094294e+02 assign (segid " " and resid 113 and name HG2) (segid " " and resid 113 and name HB1) 2.291 0.656 0.656 weight 1.000 ! spec=c13n...li-4, no=1063, id=1801, vol=1.992336e+02 assign (segid " " and resid 153 and name HG2) (segid " " and resid 152 and name HB2) 2.583 0.834 0.834 weight 1.000 ! spec=c13n...li-4, no=1064, id=1802, vol=9.701030e+01 or (segid " " and resid 153 and name HG2) (segid " " and resid 152 and name HB1) or (segid " " and resid 153 and name HG2) (segid " " and resid 152 and name HB3) assign (segid " " and resid 113 and name HG2) (segid " " and resid 110 and name HD22) 2.741 0.939 0.939 weight 1.000 ! spec=c13n...li-4, no=1066, id=1804, vol=6.792320e+01 or (segid " " and resid 113 and name HG2) (segid " " and resid 110 and name HD21) or (segid " " and resid 113 and name HG2) (segid " " and resid 110 and name HD23) assign (segid " " and resid 113 and name HG2) (segid " " and resid 185 and name HD11) 2.473 0.764 0.764 weight 1.000 ! spec=c13n...li-4, no=1067, id=1805, vol=1.260892e+02 assign (segid " " and resid 129 and name HA) (segid " " and resid 129 and name HG2) 2.490 0.775 3.510 weight 1.000 ! spec=c13n...li-4, no=1068, id=1806, vol=1.209799e+02 assign (segid " " and resid 135 and name HA) (segid " " and resid 135 and name HG2) 2.521 0.795 3.479 weight 1.000 ! spec=c13n...li-4, no=1069, id=1807, vol=1.122573e+02 assign (segid " " and resid 113 and name HA) (segid " " and resid 113 and name HG1) 2.359 0.696 0.696 weight 1.000 ! spec=c13n...li-4, no=1070, id=1808, vol=1.671844e+02 assign (segid " " and resid 165 and name HA) (segid " " and resid 165 and name HG2) 2.394 0.716 0.716 weight 1.000 ! spec=c13n...li-4, no=1072, id=1810, vol=1.531329e+02 assign (segid " " and resid 157 and name HG2) (segid " " and resid 154 and name HD2) 2.787 0.971 3.213 weight 1.000 ! spec=c13n...li-4, no=1078, id=1814, vol=6.146340e+01 assign (segid " " and resid 135 and name HA) (segid " " and resid 135 and name HG1) 2.521 0.795 0.795 weight 1.000 ! spec=c13n...li-4, no=1083, id=1819, vol=1.122489e+02 assign (segid " " and resid 183 and name HB2) (segid " " and resid 184 and name HG2) 2.828 0.999 3.172 weight 1.000 ! spec=c13n...li-4, no=1086, id=1822, vol=5.641690e+01 assign (segid " " and resid 137 and name HG2) (segid " " and resid 137 and name HB2) 1.735 0.376 4.265 weight 1.000 ! spec=c13n...li-4, no=1092, id=1825, vol=1.056973e+03 assign (segid " " and resid 135 and name HG1) (segid " " and resid 132 and name HG12) 2.801 0.981 0.981 weight 1.000 ! spec=c13n...li-4, no=1094, id=1827, vol=5.971840e+01 assign (segid " " and resid 138 and name HA) (segid " " and resid 138 and name HG1) 2.508 0.787 0.787 weight 1.000 ! spec=c13n...li-4, no=1095, id=1828, vol=1.157307e+02 assign (segid " " and resid 189 and name HG2) (segid " " and resid 189 and name HB2) 1.817 0.413 4.183 weight 1.000 ! spec=c13n...li-4, no=1098, id=1830, vol=8.000035e+02 assign (segid " " and resid 189 and name HG2) (segid " " and resid 187 and name HG22) 3.079 1.185 1.185 weight 1.000 ! spec=c13n...li-4, no=1099, id=1831, vol=3.384730e+01 or (segid " " and resid 189 and name HG2) (segid " " and resid 187 and name HG21) or (segid " " and resid 189 and name HG2) (segid " " and resid 187 and name HG23) assign (segid " " and resid 153 and name HG1) (segid " " and resid 153 and name HA) 2.421 0.733 0.733 weight 1.000 ! spec=c13n...li-4, no=1102, id=1834, vol=1.432178e+02 assign (segid " " and resid 176 and name HG1) (segid " " and resid 173 and name HB1) 2.764 0.955 0.955 weight 1.000 ! spec=c13n...li-4, no=1108, id=1838, vol=6.463750e+01 assign (segid " " and resid 119 and name HB) (segid " " and resid 119 and name HG12) 2.379 0.708 0.708 weight 1.000 ! spec=c13n...li-4, no=1109, id=1839, vol=1.590178e+02 assign (segid " " and resid 119 and name HB) (segid " " and resid 119 and name HD11) 2.433 0.740 3.567 weight 1.000 ! spec=c13n...li-4, no=1111, id=1841, vol=1.390559e+02 assign (segid " " and resid 119 and name HB) (segid " " and resid 119 and name HG21) 2.152 0.579 3.848 weight 1.000 ! spec=c13n...li-4, no=1112, id=1842, vol=2.903761e+02 assign (segid " " and resid 124 and name HB) (segid " " and resid 136 and name HA) 2.834 1.004 3.166 weight 1.000 ! spec=c13n...li-4, no=1115, id=1845, vol=5.568430e+01 assign (segid " " and resid 139 and name HA) (segid " " and resid 139 and name HB) 2.514 0.790 0.790 weight 1.000 ! spec=c13n...li-4, no=1118, id=1848, vol=1.142747e+02 assign (segid " " and resid 97 and name HB) (segid " " and resid 97 and name HG11) 2.310 0.667 0.667 weight 1.000 ! spec=c13n...li-4, no=1120, id=1849, vol=1.898797e+02 assign (segid " " and resid 124 and name HB) (segid " " and resid 124 and name HG11) 2.375 0.705 0.705 weight 1.000 ! spec=c13n...li-4, no=1121, id=1850, vol=1.608240e+02 assign (segid " " and resid 124 and name HB) (segid " " and resid 124 and name HG12) 2.257 0.637 0.637 weight 1.000 ! spec=c13n...li-4, no=1123, id=1852, vol=2.182759e+02 assign (segid " " and resid 142 and name HB) (segid " " and resid 142 and name HG21) 1.802 0.406 4.198 weight 1.000 ! spec=c13n...li-4, no=1125, id=1854, vol=8.432511e+02 assign (segid " " and resid 187 and name HB) (segid " " and resid 187 and name HA) 2.566 0.823 0.823 weight 1.000 ! spec=c13n...li-4, no=1126, id=1855, vol=1.010917e+02 assign (segid " " and resid 187 and name HB) (segid " " and resid 187 and name HG11) 2.412 0.727 0.727 weight 1.000 ! spec=c13n...li-4, no=1129, id=1857, vol=1.463568e+02 assign (segid " " and resid 118 and name HB) (segid " " and resid 152 and name HB1) 2.588 0.837 0.837 weight 1.000 ! spec=c13n...li-4, no=1132, id=1860, vol=9.599970e+01 assign (segid " " and resid 118 and name HB) (segid " " and resid 118 and name HG12) 2.541 0.807 0.807 weight 1.000 ! spec=c13n...li-4, no=1134, id=1861, vol=1.072142e+02 assign (segid " " and resid 118 and name HB) (segid " " and resid 118 and name HG11) 2.585 0.835 0.835 weight 1.000 ! spec=c13n...li-4, no=1137, id=1864, vol=9.673150e+01 assign (segid " " and resid 178 and name HG2) (segid " " and resid 177 and name HB2) 2.927 1.071 1.071 weight 1.000 ! spec=c13n...li-4, no=1143, id=1867, vol=4.585200e+01 assign (segid " " and resid 178 and name HG2) (segid " " and resid 178 and name HB1) 2.510 0.788 0.788 weight 1.000 ! spec=c13n...li-4, no=1144, id=1868, vol=1.152586e+02 assign (segid " " and resid 178 and name HG2) (segid " " and resid 175 and name HD22) 2.980 1.110 1.110 weight 1.000 ! spec=c13n...li-4, no=1145, id=1869, vol=4.114340e+01 or (segid " " and resid 178 and name HG2) (segid " " and resid 175 and name HD21) or (segid " " and resid 178 and name HG2) (segid " " and resid 175 and name HD23) assign (segid " " and resid 178 and name HG1) (segid " " and resid 175 and name HD21) 3.010 1.133 1.133 weight 1.000 ! spec=c13n...li-4, no=1151, id=1874, vol=3.875220e+01 assign (segid " " and resid 101 and name HA) (segid " " and resid 101 and name HG2) 2.346 0.688 0.688 weight 1.000 ! spec=c13n...li-4, no=1152, id=1875, vol=1.729249e+02 assign (segid " " and resid 138 and name HG2) (segid " " and resid 138 and name HG1) 1.832 0.419 0.419 weight 1.000 ! spec=c13n...li-4, no=1157, id=1877, vol=7.637147e+02 assign (segid " " and resid 178 and name HG1) (segid " " and resid 178 and name HB1) 2.423 0.734 0.734 weight 1.000 ! spec=c13n...li-4, no=1160, id=1880, vol=1.425962e+02 assign (segid " " and resid 138 and name HG2) (segid " " and resid 139 and name HD11) 2.688 0.903 0.903 weight 1.000 ! spec=c13n...li-4, no=1163, id=1881, vol=7.639310e+01 assign (segid " " and resid 101 and name HG2) (segid " " and resid 97 and name HG21) 2.234 0.624 0.624 weight 1.000 ! spec=c13n...li-4, no=1164, id=1882, vol=2.319351e+02 assign (segid " " and resid 134 and name HG2) (segid " " and resid 132 and name HD11) 2.787 0.971 0.971 weight 1.000 ! spec=c13n...li-4, no=1165, id=1883, vol=6.147770e+01 assign (segid " " and resid 184 and name HA) (segid " " and resid 184 and name HG2) 2.143 0.574 3.857 weight 1.000 ! spec=c13n...li-4, no=1168, id=1886, vol=2.976460e+02 assign (segid " " and resid 189 and name HA) (segid " " and resid 189 and name HG2) 2.473 0.764 0.764 weight 1.000 ! spec=c13n...li-4, no=1170, id=1888, vol=1.261567e+02 assign (segid " " and resid 102 and name HG2) (segid " " and resid 98 and name HA) 3.042 1.156 2.958 weight 1.000 ! spec=c13n...li-4, no=1173, id=1890, vol=3.641350e+01 assign (segid " " and resid 102 and name HA) (segid " " and resid 102 and name HG2) 2.613 0.853 0.853 weight 1.000 ! spec=c13n...li-4, no=1178, id=1894, vol=9.065240e+01 assign (segid " " and resid 102 and name HG2) (segid " " and resid 101 and name HB1) 2.488 0.774 3.512 weight 1.000 ! spec=c13n...li-4, no=1179, id=1895, vol=1.214279e+02 assign (segid " " and resid 102 and name HG2) (segid " " and resid 101 and name HB2) 2.623 0.860 3.377 weight 1.000 ! spec=c13n...li-4, no=1180, id=1896, vol=8.862670e+01 assign (segid " " and resid 102 and name HG2) (segid " " and resid 102 and name HG1) 1.747 0.382 0.382 weight 1.000 ! spec=c13n...li-4, no=1181, id=1897, vol=1.012531e+03 assign (segid " " and resid 102 and name HG2) (segid " " and resid 102 and name HB1) 2.273 0.646 0.646 weight 1.000 ! spec=c13n...li-4, no=1183, id=1898, vol=2.091627e+02 assign (segid " " and resid 102 and name HA) (segid " " and resid 102 and name HG1) 2.471 0.763 3.529 weight 1.000 ! spec=c13n...li-4, no=1185, id=1900, vol=1.265978e+02 assign (segid " " and resid 102 and name HG1) (segid " " and resid 101 and name HB1) 2.693 0.906 3.307 weight 1.000 ! spec=c13n...li-4, no=1187, id=1902, vol=7.566020e+01 assign (segid " " and resid 102 and name HG1) (segid " " and resid 102 and name HB1) 1.995 0.498 0.498 weight 1.000 ! spec=c13n...li-4, no=1192, id=1904, vol=4.569798e+02 assign (segid " " and resid 146 and name HB2) (segid " " and resid 146 and name HD2) 2.451 0.751 0.751 weight 1.000 ! spec=c13n...li-4, no=1193, id=1905, vol=1.330662e+02 assign (segid " " and resid 146 and name HB2) (segid " " and resid 146 and name HD1) 2.402 0.721 0.721 weight 1.000 ! spec=c13n...li-4, no=1194, id=1906, vol=1.502132e+02 assign (segid " " and resid 146 and name HB2) (segid " " and resid 146 and name HG2) 2.394 0.716 0.716 weight 1.000 ! spec=c13n...li-4, no=1195, id=1907, vol=1.531394e+02 assign (segid " " and resid 146 and name HB2) (segid " " and resid 146 and name HG1) 2.195 0.602 0.602 weight 1.000 ! spec=c13n...li-4, no=1196, id=1908, vol=2.578139e+02 assign (segid " " and resid 146 and name HB2) (segid " " and resid 142 and name HG21) 2.470 0.763 0.763 weight 1.000 ! spec=c13n...li-4, no=1197, id=1909, vol=1.270149e+02 assign (segid " " and resid 146 and name HB1) (segid " " and resid 146 and name HD1) 2.437 0.742 3.563 weight 1.000 ! spec=c13n...li-4, no=1200, id=1911, vol=1.377132e+02 assign (segid " " and resid 146 and name HB1) (segid " " and resid 146 and name HG2) 2.533 0.802 0.802 weight 1.000 ! spec=c13n...li-4, no=1201, id=1912, vol=1.090651e+02 assign (segid " " and resid 146 and name HB1) (segid " " and resid 146 and name HG1) 2.254 0.635 0.635 weight 1.000 ! spec=c13n...li-4, no=1203, id=1913, vol=2.198997e+02 assign (segid " " and resid 146 and name HB1) (segid " " and resid 142 and name HG22) 2.391 0.715 0.715 weight 1.000 ! spec=c13n...li-4, no=1204, id=1914, vol=1.542631e+02 or (segid " " and resid 146 and name HB1) (segid " " and resid 142 and name HG21) or (segid " " and resid 146 and name HB1) (segid " " and resid 142 and name HG23) assign (segid " " and resid 148 and name HG2) (segid " " and resid 148 and name HA) 2.675 0.894 0.894 weight 1.000 ! spec=c13n...li-4, no=1205, id=1915, vol=7.869400e+01 assign (segid " " and resid 148 and name HG1) (segid " " and resid 148 and name HB2) 2.539 0.806 0.806 weight 1.000 ! spec=c13n...li-4, no=1207, id=1916, vol=1.075394e+02 assign (segid " " and resid 149 and name HA) (segid " " and resid 149 and name HG2) 2.489 0.774 3.511 weight 1.000 ! spec=c13n...li-4, no=1217, id=1925, vol=1.213419e+02 assign (segid " " and resid 149 and name HG2) (segid " " and resid 149 and name HB2) 2.310 0.667 0.667 weight 1.000 ! spec=c13n...li-4, no=1220, id=1926, vol=1.895799e+02 assign (segid " " and resid 172 and name HB2) (segid " " and resid 186 and name HD1) 2.874 1.032 1.032 weight 1.000 ! spec=c13n...li-4, no=1224, id=1930, vol=5.120020e+01 assign (segid " " and resid 94 and name HA) (segid " " and resid 94 and name HG2) 2.819 0.993 0.993 weight 1.000 ! spec=c13n...li-4, no=1225, id=1931, vol=5.751610e+01 assign (segid " " and resid 172 and name HB2) (segid " " and resid 172 and name HA) 2.884 1.040 1.040 weight 1.000 ! spec=c13n...li-4, no=1226, id=1932, vol=5.006990e+01 assign (segid " " and resid 149 and name HA) (segid " " and resid 149 and name HG1) 2.443 0.746 0.746 weight 1.000 ! spec=c13n...li-4, no=1228, id=1934, vol=1.356721e+02 assign (segid " " and resid 172 and name HB2) (segid " " and resid 171 and name HB2) 3.002 1.127 1.127 weight 1.000 ! spec=c13n...li-4, no=1231, id=1935, vol=3.936850e+01 assign (segid " " and resid 149 and name HG1) (segid " " and resid 149 and name HB1) 2.468 0.761 0.761 weight 1.000 ! spec=c13n...li-4, no=1236, id=1938, vol=1.276896e+02 assign (segid " " and resid 149 and name HG1) (segid " " and resid 115 and name HB1) 2.935 1.077 3.065 weight 1.000 ! spec=c13n...li-4, no=1237, id=1939, vol=4.506780e+01 assign (segid " " and resid 149 and name HG1) (segid " " and resid 152 and name HB1) 2.974 1.105 3.026 weight 1.000 ! spec=c13n...li-4, no=1240, id=1942, vol=4.171270e+01 assign (segid " " and resid 172 and name HB2) (segid " " and resid 188 and name HG12) 2.745 0.942 0.942 weight 1.000 ! spec=c13n...li-4, no=1241, id=1943, vol=6.739010e+01 or (segid " " and resid 172 and name HB2) (segid " " and resid 188 and name HG11) or (segid " " and resid 172 and name HB2) (segid " " and resid 188 and name HG13) assign (segid " " and resid 94 and name HA) (segid " " and resid 94 and name HG1) 2.695 0.908 0.908 weight 1.000 ! spec=c13n...li-4, no=1242, id=1944, vol=7.518330e+01 assign (segid " " and resid 141 and name HA) (segid " " and resid 141 and name HG2) 2.405 0.723 0.723 weight 1.000 ! spec=c13n...li-4, no=1243, id=1945, vol=1.490703e+02 assign (segid " " and resid 141 and name HG2) (segid " " and resid 141 and name HB2) 1.962 0.481 0.481 weight 1.000 ! spec=c13n...li-4, no=1247, id=1946, vol=5.056496e+02 assign (segid " " and resid 94 and name HG1) (segid " " and resid 94 and name HB2) 2.629 0.864 0.864 weight 1.000 ! spec=c13n...li-4, no=1252, id=1948, vol=8.736250e+01 assign (segid " " and resid 141 and name HG2) (segid " " and resid 145 and name HG21) 2.694 0.907 0.907 weight 1.000 ! spec=c13n...li-4, no=1253, id=1949, vol=7.546160e+01 or (segid " " and resid 141 and name HG2) (segid " " and resid 145 and name HG22) or (segid " " and resid 141 and name HG2) (segid " " and resid 145 and name HG23) assign (segid " " and resid 141 and name HA) (segid " " and resid 141 and name HG1) 2.390 0.714 0.714 weight 1.000 ! spec=c13n...li-4, no=1255, id=1951, vol=1.545301e+02 assign (segid " " and resid 141 and name HG1) (segid " " and resid 141 and name HB2) 1.881 0.442 0.442 weight 1.000 ! spec=c13n...li-4, no=1258, id=1952, vol=6.511994e+02 assign (segid " " and resid 134 and name HG2) (segid " " and resid 134 and name HB2) 1.798 0.404 4.202 weight 1.000 ! spec=c13n...li-4, no=1259, id=1953, vol=8.533768e+02 assign (segid " " and resid 141 and name HG1) (segid " " and resid 145 and name HG21) 3.661 1.885 0.885 weight 1.000 ! spec=c13n...li-4, no=1260, id=1954, vol=8.127870e+01 or (segid " " and resid 141 and name HG1) (segid " " and resid 145 and name HG22) or (segid " " and resid 141 and name HG1) (segid " " and resid 145 and name HG23) assign (segid " " and resid 148 and name HA) (segid " " and resid 148 and name HB2) 2.577 0.830 0.830 weight 1.000 ! spec=c13n...li-4, no=1261, id=1955, vol=9.837420e+01 assign (segid " " and resid 149 and name HB2) (segid " " and resid 149 and name HA) 2.466 0.760 0.760 weight 1.000 ! spec=c13n...li-4, no=1266, id=1958, vol=1.281804e+02 assign (segid " " and resid 149 and name HB2) (segid " " and resid 149 and name HB1) 1.979 0.489 0.489 weight 1.000 ! spec=c13n...li-4, no=1268, id=1959, vol=4.802144e+02 assign (segid " " and resid 172 and name HB2) (segid " " and resid 172 and name HB1) 2.317 0.671 0.671 weight 1.000 ! spec=c13n...li-4, no=1274, id=1965, vol=1.861427e+02 assign (segid " " and resid 148 and name HB2) (segid " " and resid 148 and name HB1) 2.157 0.582 0.582 weight 1.000 ! spec=c13n...li-4, no=1275, id=1966, vol=2.859877e+02 assign (segid " " and resid 148 and name HA) (segid " " and resid 148 and name HB1) 2.419 0.731 0.731 weight 1.000 ! spec=c13n...li-4, no=1282, id=1972, vol=1.440038e+02 assign (segid " " and resid 174 and name HA) (segid " " and resid 177 and name HB2) 2.235 0.624 0.624 weight 1.000 ! spec=c13n...li-4, no=1283, id=1973, vol=2.314458e+02 assign (segid " " and resid 115 and name HB2) (segid " " and resid 114 and name HB1) 2.569 0.825 3.431 weight 1.000 ! spec=c13n...li-4, no=1286, id=1976, vol=1.001967e+02 assign (segid " " and resid 115 and name HB2) (segid " " and resid 153 and name HG2) 2.482 0.770 0.770 weight 1.000 ! spec=c13n...li-4, no=1287, id=1977, vol=1.232511e+02 assign (segid " " and resid 177 and name HB2) (segid " " and resid 177 and name HG2) 2.127 0.565 0.565 weight 1.000 ! spec=c13n...li-4, no=1291, id=1980, vol=3.115376e+02 assign (segid " " and resid 108 and name HB2) (segid " " and resid 160 and name HD21) 2.787 0.971 3.213 weight 1.000 ! spec=c13n...li-4, no=1294, id=1983, vol=6.157320e+01 assign (segid " " and resid 181 and name HA) (segid " " and resid 181 and name HB2) 1.992 0.496 4.008 weight 1.000 ! spec=c13n...li-4, no=1297, id=1985, vol=4.613864e+02 assign (segid " " and resid 169 and name HA) (segid " " and resid 169 and name HB2) 2.220 0.616 0.616 weight 1.000 ! spec=c13n...li-4, no=1298, id=1986, vol=2.408667e+02 assign (segid " " and resid 169 and name HB2) (segid " " and resid 168 and name HD1) 2.669 0.890 0.890 weight 1.000 ! spec=c13n...li-4, no=1303, id=1991, vol=7.983610e+01 assign (segid " " and resid 115 and name HA) (segid " " and resid 115 and name HB1) 2.352 0.692 0.692 weight 1.000 ! spec=c13n...li-4, no=1312, id=1999, vol=1.703106e+02 assign (segid " " and resid 96 and name HE2) (segid " " and resid 96 and name HB2) 2.531 0.801 0.801 weight 1.000 ! spec=c13n...li-4, no=1313, id=2000, vol=1.097290e+02 assign (segid " " and resid 115 and name HB1) (segid " " and resid 153 and name HG2) 2.737 0.936 0.936 weight 1.000 ! spec=c13n...li-4, no=1314, id=2001, vol=6.856810e+01 assign (segid " " and resid 115 and name HB2) (segid " " and resid 115 and name HB1) 1.856 0.431 0.431 weight 1.000 ! spec=c13n...li-4, no=1316, id=2002, vol=7.044264e+02 assign (segid " " and resid 120 and name HB2) (segid " " and resid 124 and name HG12) 2.767 0.957 3.233 weight 1.000 ! spec=c13n...li-4, no=1320, id=2006, vol=6.426840e+01 assign (segid " " and resid 96 and name HB2) (segid " " and resid 97 and name HD11) 2.746 0.943 0.943 weight 1.000 ! spec=c13n...li-4, no=1322, id=2008, vol=6.723070e+01 assign (segid " " and resid 120 and name HB2) (segid " " and resid 124 and name HD11) 2.316 0.671 0.671 weight 1.000 ! spec=c13n...li-4, no=1323, id=2009, vol=1.866091e+02 assign (segid " " and resid 120 and name HB2) (segid " " and resid 139 and name HG21) 2.350 0.690 0.690 weight 1.000 ! spec=c13n...li-4, no=1324, id=2010, vol=1.713860e+02 assign (segid " " and resid 169 and name HB2) (segid " " and resid 188 and name HG21) 2.901 1.052 1.052 weight 1.000 ! spec=c13n...li-4, no=1325, id=2011, vol=4.834940e+01 assign (segid " " and resid 169 and name HA) (segid " " and resid 188 and name HB) 2.476 0.766 0.766 weight 1.000 ! spec=c13n...li-4, no=1327, id=2013, vol=1.251669e+02 assign (segid " " and resid 188 and name HB) (segid " " and resid 169 and name HG2) 3.043 1.157 2.957 weight 1.000 ! spec=c13n...li-4, no=1332, id=2017, vol=3.633970e+01 assign (segid " " and resid 188 and name HB) (segid " " and resid 172 and name HG2) 4.745 2.942 0.942 weight 1.000 ! spec=c13n...li-4, no=1334, id=2018, vol=6.740330e+01 assign (segid " " and resid 190 and name HB1) (segid " " and resid 190 and name HG2) 2.623 0.860 0.860 weight 1.000 ! spec=c13n...li-4, no=1337, id=2019, vol=8.860700e+01 assign (segid " " and resid 190 and name HB2) (segid " " and resid 190 and name HG2) 2.637 0.869 0.869 weight 1.000 ! spec=c13n...li-4, no=1338, id=2020, vol=8.579870e+01 assign (segid " " and resid 117 and name HD2) (segid " " and resid 117 and name HB1) 2.716 0.922 0.922 weight 1.000 ! spec=c13n...li-4, no=1341, id=2023, vol=7.179970e+01 assign (segid " " and resid 117 and name HB2) (segid " " and resid 117 and name HB1) 2.335 0.682 0.682 weight 1.000 ! spec=c13n...li-4, no=1343, id=2024, vol=1.777864e+02 assign (segid " " and resid 117 and name HB1) (segid " " and resid 117 and name HG2) 2.592 0.840 0.840 weight 1.000 ! spec=c13n...li-4, no=1344, id=2025, vol=9.508150e+01 assign (segid " " and resid 186 and name HB2) (segid " " and resid 186 and name HD1) 2.840 1.008 1.008 weight 1.000 ! spec=c13n...li-4, no=1347, id=2027, vol=5.493810e+01 assign (segid " " and resid 93 and name HB1) (segid " " and resid 93 and name HD2) 3.101 1.202 1.202 weight 1.000 ! spec=c13n...li-4, no=1350, id=2030, vol=3.245070e+01 assign (segid " " and resid 93 and name HB1) (segid " " and resid 95 and name HE2) 2.530 0.800 0.800 weight 1.000 ! spec=c13n...li-4, no=1354, id=2033, vol=1.100368e+02 assign (segid " " and resid 93 and name HB2) (segid " " and resid 95 and name HE2) 2.898 1.050 1.050 weight 1.000 ! spec=c13n...li-4, no=1362, id=2037, vol=4.871300e+01 assign (segid " " and resid 186 and name HB1) (segid " " and resid 186 and name HA) 2.564 0.822 0.822 weight 1.000 ! spec=c13n...li-4, no=1364, id=2039, vol=1.013835e+02 assign (segid " " and resid 186 and name HB1) (segid " " and resid 183 and name HA) 2.933 1.076 1.076 weight 1.000 ! spec=c13n...li-4, no=1365, id=2040, vol=4.524810e+01 assign (segid " " and resid 186 and name HB1) (segid " " and resid 175 and name HD11) 2.727 0.930 3.273 weight 1.000 ! spec=c13n...li-4, no=1366, id=2041, vol=7.010090e+01 assign (segid " " and resid 112 and name HB2) (segid " " and resid 112 and name HG1) 2.369 0.701 0.701 weight 1.000 ! spec=c13n...li-4, no=1370, id=2045, vol=1.633107e+02 assign (segid " " and resid 112 and name HB2) (segid " " and resid 112 and name HG2) 2.322 0.674 0.674 weight 1.000 ! spec=c13n...li-4, no=1371, id=2046, vol=1.839674e+02 assign (segid " " and resid 112 and name HB2) (segid " " and resid 112 and name HB1) 1.983 0.491 0.491 weight 1.000 ! spec=c13n...li-4, no=1372, id=2047, vol=4.748569e+02 assign (segid " " and resid 135 and name HA) (segid " " and resid 135 and name HB2) 2.656 0.882 0.882 weight 1.000 ! spec=c13n...li-4, no=1373, id=2048, vol=8.207010e+01 assign (segid " " and resid 135 and name HB2) (segid " " and resid 138 and name HB1) 2.189 0.599 3.811 weight 1.000 ! spec=c13n...li-4, no=1376, id=2049, vol=2.618657e+02 assign (segid " " and resid 176 and name HG1) (segid " " and resid 176 and name HB1) 2.404 0.722 0.722 weight 1.000 ! spec=c13n...li-4, no=1377, id=2050, vol=1.495322e+02 assign (segid " " and resid 135 and name HB2) (segid " " and resid 131 and name HG) 2.988 1.116 1.116 weight 1.000 ! spec=c13n...li-4, no=1378, id=2051, vol=4.050680e+01 assign (segid " " and resid 135 and name HB2) (segid " " and resid 131 and name HD22) 3.026 1.144 1.144 weight 1.000 ! spec=c13n...li-4, no=1379, id=2052, vol=3.758390e+01 or (segid " " and resid 135 and name HB2) (segid " " and resid 131 and name HD21) or (segid " " and resid 135 and name HB2) (segid " " and resid 131 and name HD23) assign (segid " " and resid 104 and name HB2) (segid " " and resid 104 and name HB1) 2.418 0.731 0.731 weight 1.000 ! spec=c13n...li-4, no=1381, id=2053, vol=1.442744e+02 assign (segid " " and resid 104 and name HB2) (segid " " and resid 105 and name HD21) 2.921 1.067 3.079 weight 1.000 ! spec=c13n...li-4, no=1384, id=2056, vol=4.641200e+01 assign (segid " " and resid 154 and name HB2) (segid " " and resid 154 and name HB1) 2.085 0.543 0.543 weight 1.000 ! spec=c13n...li-4, no=1393, id=2063, vol=3.512900e+02 assign (segid " " and resid 101 and name HB1) (segid " " and resid 102 and name HB1) 2.653 0.880 3.347 weight 1.000 ! spec=c13n...li-4, no=1395, id=2065, vol=8.261600e+01 assign (segid " " and resid 138 and name HB2) (segid " " and resid 154 and name HG2) 2.789 0.972 3.211 weight 1.000 ! spec=c13n...li-4, no=1397, id=2067, vol=6.132880e+01 assign (segid " " and resid 104 and name HB1) (segid " " and resid 101 and name HA) 2.884 1.039 1.039 weight 1.000 ! spec=c13n...li-4, no=1400, id=2070, vol=5.014270e+01 assign (segid " " and resid 135 and name HA) (segid " " and resid 135 and name HB1) 2.230 0.622 0.622 weight 1.000 ! spec=c13n...li-4, no=1401, id=2071, vol=2.342413e+02 assign (segid " " and resid 156 and name HA) (segid " " and resid 156 and name HB) 2.667 0.889 0.889 weight 1.000 ! spec=c13n...li-4, no=1407, id=2077, vol=8.004790e+01 assign (segid " " and resid 164 and name HB2) (segid " " and resid 164 and name HD2) 2.447 0.748 0.748 weight 1.000 ! spec=c13n...li-4, no=1413, id=2079, vol=1.343770e+02 assign (segid " " and resid 165 and name HB1) (segid " " and resid 169 and name HD2) 2.752 0.947 0.947 weight 1.000 ! spec=c13n...li-4, no=1416, id=2082, vol=6.633190e+01 assign (segid " " and resid 135 and name HB1) (segid " " and resid 131 and name HG) 2.702 0.913 0.913 weight 1.000 ! spec=c13n...li-4, no=1417, id=2083, vol=7.411950e+01 assign (segid " " and resid 113 and name HB1) (segid " " and resid 185 and name HD11) 2.424 0.734 0.734 weight 1.000 ! spec=c13n...li-4, no=1420, id=2086, vol=1.421425e+02 assign (segid " " and resid 135 and name HB1) (segid " " and resid 131 and name HD22) 2.819 0.993 0.993 weight 1.000 ! spec=c13n...li-4, no=1421, id=2087, vol=5.751440e+01 or (segid " " and resid 135 and name HB1) (segid " " and resid 131 and name HD21) or (segid " " and resid 135 and name HB1) (segid " " and resid 131 and name HD23) assign (segid " " and resid 156 and name HB) (segid " " and resid 156 and name HG12) 2.147 0.576 0.576 weight 1.000 ! spec=c13n...li-4, no=1423, id=2089, vol=2.947444e+02 or (segid " " and resid 156 and name HB) (segid " " and resid 156 and name HG11) or (segid " " and resid 156 and name HB) (segid " " and resid 156 and name HG13) assign (segid " " and resid 102 and name HA) (segid " " and resid 104 and name HB1) 3.000 1.125 3.000 weight 1.000 ! spec=c13n...li-4, no=1426, id=2091, vol=3.951570e+01 assign (segid " " and resid 189 and name HB2) (segid " " and resid 189 and name HB1) 1.674 0.350 0.350 weight 1.000 ! spec=c13n...li-4, no=1429, id=2093, vol=1.309939e+03 assign (segid " " and resid 156 and name HB) (segid " " and resid 156 and name HG22) 2.250 0.633 0.633 weight 1.000 ! spec=c13n...li-4, no=1430, id=2094, vol=2.220682e+02 or (segid " " and resid 156 and name HB) (segid " " and resid 156 and name HG21) or (segid " " and resid 156 and name HB) (segid " " and resid 156 and name HG23) assign (segid " " and resid 161 and name HA) (segid " " and resid 161 and name HB2) 2.364 0.698 0.698 weight 1.000 ! spec=c13n...li-4, no=1431, id=2095, vol=1.653686e+02 assign (segid " " and resid 161 and name HB2) (segid " " and resid 161 and name HD2) 2.368 0.701 0.701 weight 1.000 ! spec=c13n...li-4, no=1437, id=2100, vol=1.634259e+02 assign (segid " " and resid 154 and name HB1) (segid " " and resid 154 and name HE1) 3.049 1.162 1.162 weight 1.000 ! spec=c13n...li-4, no=1438, id=2101, vol=3.585760e+01 assign (segid " " and resid 112 and name HB1) (segid " " and resid 112 and name HG1) 2.366 0.700 0.700 weight 1.000 ! spec=c13n...li-4, no=1440, id=2103, vol=1.644009e+02 assign (segid " " and resid 189 and name HG2) (segid " " and resid 189 and name HB1) 2.140 0.572 3.860 weight 1.000 ! spec=c13n...li-4, no=1442, id=2104, vol=3.003382e+02 assign (segid " " and resid 161 and name HB2) (segid " " and resid 161 and name HG1) 2.251 0.633 0.633 weight 1.000 ! spec=c13n...li-4, no=1447, id=2107, vol=2.215304e+02 assign (segid " " and resid 154 and name HB1) (segid " " and resid 154 and name HD1) 2.783 0.968 3.217 weight 1.000 ! spec=c13n...li-4, no=1448, id=2108, vol=6.208380e+01 assign (segid " " and resid 161 and name HA) (segid " " and resid 161 and name HB1) 2.334 0.681 0.681 weight 1.000 ! spec=c13n...li-4, no=1449, id=2109, vol=1.783788e+02 assign (segid " " and resid 139 and name HA) (segid " " and resid 154 and name HB1) 2.736 0.936 0.936 weight 1.000 ! spec=c13n...li-4, no=1450, id=2110, vol=6.878090e+01 assign (segid " " and resid 154 and name HB1) (segid " " and resid 151 and name HA1) 3.046 1.160 1.160 weight 1.000 ! spec=c13n...li-4, no=1451, id=2111, vol=3.610340e+01 assign (segid " " and resid 161 and name HD2) (segid " " and resid 161 and name HB1) 2.290 0.655 1.655 weight 1.000 ! spec=c13n...li-4, no=1452, id=2112, vol=1.999836e+02 assign (segid " " and resid 161 and name HB1) (segid " " and resid 158 and name HB1) 2.959 1.094 1.094 weight 1.000 ! spec=c13n...li-4, no=1453, id=2113, vol=4.298230e+01 assign (segid " " and resid 161 and name HB1) (segid " " and resid 161 and name HG1) 2.158 0.582 3.842 weight 1.000 ! spec=c13n...li-4, no=1458, id=2114, vol=2.851711e+02 assign (segid " " and resid 154 and name HB1) (segid " " and resid 154 and name HG2) 2.565 0.823 0.823 weight 1.000 ! spec=c13n...li-4, no=1459, id=2115, vol=1.011689e+02 assign (segid " " and resid 154 and name HB1) (segid " " and resid 139 and name HD11) 2.120 0.562 0.562 weight 1.000 ! spec=c13n...li-4, no=1460, id=2116, vol=3.175488e+02 assign (segid " " and resid 154 and name HB1) (segid " " and resid 139 and name HG22) 2.157 0.582 0.582 weight 1.000 ! spec=c13n...li-4, no=1461, id=2117, vol=2.860565e+02 or (segid " " and resid 154 and name HB1) (segid " " and resid 139 and name HG21) or (segid " " and resid 154 and name HB1) (segid " " and resid 139 and name HG23) assign (segid " " and resid 168 and name HB2) (segid " " and resid 168 and name HD2) 2.965 1.099 1.099 weight 1.000 ! spec=c13n...li-4, no=1468, id=2119, vol=4.247370e+01 assign (segid " " and resid 168 and name HB1) (segid " " and resid 169 and name HE2) 2.986 1.114 1.114 weight 1.000 ! spec=c13n...li-4, no=1472, id=2121, vol=4.070930e+01 assign (segid " " and resid 167 and name HB1) (segid " " and resid 167 and name HD1) 2.924 1.069 1.069 weight 1.000 ! spec=c13n...li-4, no=1479, id=2122, vol=4.615420e+01 assign (segid " " and resid 167 and name HB2) (segid " " and resid 167 and name HD1) 2.887 1.042 1.042 weight 1.000 ! spec=c13n...li-4, no=1484, id=2126, vol=4.978550e+01 assign (segid " " and resid 167 and name HB2) (segid " " and resid 169 and name HN) 2.889 1.043 3.111 weight 1.000 ! spec=c13n...li-4, no=1485, id=2127, vol=4.960150e+01 assign (segid " " and resid 186 and name HB2) (segid " " and resid 185 and name HN) 3.031 1.149 2.969 weight 1.000 ! spec=c13n...li-4, no=1486, id=2128, vol=3.716380e+01 assign (segid " " and resid 186 and name HB2) (segid " " and resid 183 and name HA) 2.746 0.943 0.943 weight 1.000 ! spec=c13n...li-4, no=1488, id=2130, vol=6.721260e+01 assign (segid " " and resid 167 and name HB1) (segid " " and resid 167 and name HB2) 2.267 0.642 0.642 weight 1.000 ! spec=c13n...li-4, no=1489, id=2131, vol=2.126162e+02 assign (segid " " and resid 167 and name HB2) (segid " " and resid 159 and name HD21) 2.894 1.047 1.047 weight 1.000 ! spec=c13n...li-4, no=1494, id=2135, vol=4.905010e+01 assign (segid " " and resid 130 and name HB2) (segid " " and resid 167 and name HB1) 2.957 1.093 1.093 weight 1.000 ! spec=c13n...li-4, no=1496, id=2137, vol=4.313650e+01 assign (segid " " and resid 130 and name HB2) (segid " " and resid 167 and name HB2) 2.920 1.066 1.066 weight 1.000 ! spec=c13n...li-4, no=1497, id=2138, vol=4.649000e+01 assign (segid " " and resid 164 and name HB2) (segid " " and resid 130 and name HB2) 3.005 1.129 1.129 weight 1.000 ! spec=c13n...li-4, no=1503, id=2142, vol=3.912100e+01 assign (segid " " and resid 130 and name HB2) (segid " " and resid 164 and name HG1) 2.892 1.045 1.045 weight 1.000 ! spec=c13n...li-4, no=1505, id=2144, vol=4.933180e+01 assign (segid " " and resid 130 and name HB2) (segid " " and resid 127 and name HD12) 3.008 1.131 1.131 weight 1.000 ! spec=c13n...li-4, no=1506, id=2145, vol=3.893920e+01 or (segid " " and resid 130 and name HB2) (segid " " and resid 127 and name HD11) or (segid " " and resid 130 and name HB2) (segid " " and resid 127 and name HD13) assign (segid " " and resid 130 and name HB2) (segid " " and resid 131 and name HD12) 2.843 1.010 1.010 weight 1.000 ! spec=c13n...li-4, no=1507, id=2146, vol=5.460540e+01 or (segid " " and resid 130 and name HB2) (segid " " and resid 131 and name HD11) or (segid " " and resid 130 and name HB2) (segid " " and resid 131 and name HD13) assign (segid " " and resid 130 and name HA) (segid " " and resid 130 and name HB1) 2.139 0.572 3.861 weight 1.000 ! spec=c13n...li-4, no=1509, id=2147, vol=3.006532e+02 assign (segid " " and resid 130 and name HB1) (segid " " and resid 167 and name HB1) 2.967 1.100 1.100 weight 1.000 ! spec=c13n...li-4, no=1510, id=2148, vol=4.228710e+01 assign (segid " " and resid 167 and name HB2) (segid " " and resid 130 and name HB1) 2.858 1.021 1.021 weight 1.000 ! spec=c13n...li-4, no=1511, id=2149, vol=5.294260e+01 assign (segid " " and resid 130 and name HB1) (segid " " and resid 131 and name HD12) 3.021 1.141 1.141 weight 1.000 ! spec=c13n...li-4, no=1516, id=2151, vol=3.793810e+01 or (segid " " and resid 130 and name HB1) (segid " " and resid 131 and name HD11) or (segid " " and resid 130 and name HB1) (segid " " and resid 131 and name HD13) assign (segid " " and resid 186 and name HB2) (segid " " and resid 186 and name HB1) 2.176 0.592 0.592 weight 1.000 ! spec=c13n...li-4, no=1518, id=2152, vol=2.713362e+02 assign (segid " " and resid 113 and name HB2) (segid " " and resid 182 and name HE1) 2.877 1.035 1.035 weight 1.000 ! spec=c13n...li-4, no=1520, id=2153, vol=5.086190e+01 assign (segid " " and resid 113 and name HB2) (segid " " and resid 182 and name HD1) 3.008 1.131 1.131 weight 1.000 ! spec=c13n...li-4, no=1521, id=2154, vol=3.895520e+01 assign (segid " " and resid 113 and name HB2) (segid " " and resid 113 and name HG1) 2.419 0.731 0.731 weight 1.000 ! spec=c13n...li-4, no=1524, id=2156, vol=1.439815e+02 assign (segid " " and resid 113 and name HB2) (segid " " and resid 110 and name HD22) 2.872 1.031 1.031 weight 1.000 ! spec=c13n...li-4, no=1526, id=2158, vol=5.141480e+01 or (segid " " and resid 113 and name HB2) (segid " " and resid 110 and name HD21) or (segid " " and resid 113 and name HB2) (segid " " and resid 110 and name HD23) assign (segid " " and resid 113 and name HB2) (segid " " and resid 185 and name HD12) 2.731 0.932 0.932 weight 1.000 ! spec=c13n...li-4, no=1527, id=2159, vol=6.957320e+01 or (segid " " and resid 113 and name HB2) (segid " " and resid 185 and name HD11) or (segid " " and resid 113 and name HB2) (segid " " and resid 185 and name HD13) assign (segid " " and resid 109 and name HB1) (segid " " and resid 186 and name HZ3) 2.926 1.070 3.074 weight 1.000 ! spec=c13n...li-4, no=1528, id=2160, vol=4.598570e+01 assign (segid " " and resid 178 and name HG2) (segid " " and resid 178 and name HB2) 2.476 0.767 0.767 weight 1.000 ! spec=c13n...li-4, no=1539, id=2167, vol=1.250125e+02 assign (segid " " and resid 178 and name HB2) (segid " " and resid 178 and name HG1) 2.418 0.731 0.731 weight 1.000 ! spec=c13n...li-4, no=1541, id=2169, vol=1.441808e+02 assign (segid " " and resid 137 and name HB1) (segid " " and resid 137 and name HB2) 1.987 0.494 0.494 weight 1.000 ! spec=c13n...li-4, no=1544, id=2171, vol=4.683666e+02 assign (segid " " and resid 102 and name HG1) (segid " " and resid 101 and name HB2) 2.303 0.663 0.663 weight 1.000 ! spec=c13n...li-4, no=1545, id=2172, vol=1.933962e+02 assign (segid " " and resid 134 and name HA) (segid " " and resid 137 and name HB1) 2.301 0.662 3.699 weight 1.000 ! spec=c13n...li-4, no=1548, id=2175, vol=1.944968e+02 assign (segid " " and resid 141 and name HA) (segid " " and resid 141 and name HB2) 2.129 0.567 3.871 weight 1.000 ! spec=c13n...li-4, no=1549, id=2176, vol=3.093417e+02 assign (segid " " and resid 138 and name HA) (segid " " and resid 141 and name HB2) 2.346 0.688 0.688 weight 1.000 ! spec=c13n...li-4, no=1550, id=2177, vol=1.730856e+02 assign (segid " " and resid 135 and name HB1) (segid " " and resid 158 and name HA) 2.839 1.008 1.008 weight 1.000 ! spec=c13n...li-4, no=1551, id=2178, vol=5.502770e+01 assign (segid " " and resid 137 and name HB1) (segid " " and resid 136 and name HB2) 2.910 1.059 3.090 weight 1.000 ! spec=c13n...li-4, no=1553, id=2180, vol=4.745960e+01 assign (segid " " and resid 137 and name HB1) (segid " " and resid 133 and name HB2) 2.820 0.994 3.180 weight 1.000 ! spec=c13n...li-4, no=1554, id=2181, vol=5.727830e+01 assign (segid " " and resid 141 and name HB2) (segid " " and resid 142 and name HD11) 2.967 1.101 3.033 weight 1.000 ! spec=c13n...li-4, no=1560, id=2186, vol=4.223800e+01 assign (segid " " and resid 113 and name HB1) (segid " " and resid 182 and name HD1) 2.993 1.120 1.120 weight 1.000 ! spec=c13n...li-4, no=1562, id=2188, vol=4.008760e+01 assign (segid " " and resid 113 and name HB1) (segid " " and resid 182 and name HE1) 2.886 1.041 1.041 weight 1.000 ! spec=c13n...li-4, no=1563, id=2189, vol=4.995100e+01 assign (segid " " and resid 134 and name HA) (segid " " and resid 134 and name HB2) 2.086 0.544 3.914 weight 1.000 ! spec=c13n...li-4, no=1565, id=2191, vol=3.499953e+02 assign (segid " " and resid 137 and name HB2) (segid " " and resid 136 and name HB2) 2.845 1.011 1.011 weight 1.000 ! spec=c13n...li-4, no=1569, id=2194, vol=5.442560e+01 assign (segid " " and resid 113 and name HB2) (segid " " and resid 113 and name HB1) 2.005 0.503 0.503 weight 1.000 ! spec=c13n...li-4, no=1570, id=2195, vol=4.437485e+02 assign (segid " " and resid 120 and name HG2) (segid " " and resid 155 and name HB2) 2.964 1.098 1.098 weight 1.000 ! spec=c13n...li-4, no=1574, id=2197, vol=4.251800e+01 assign (segid " " and resid 134 and name HB2) (segid " " and resid 132 and name HG22) 2.857 1.020 3.143 weight 1.000 ! spec=c13n...li-4, no=1575, id=2198, vol=5.305690e+01 or (segid " " and resid 134 and name HB2) (segid " " and resid 132 and name HG21) or (segid " " and resid 134 and name HB2) (segid " " and resid 132 and name HG23) assign (segid " " and resid 165 and name HB1) (segid " " and resid 100 and name HD21) 2.555 0.816 0.816 weight 1.000 ! spec=c13n...li-4, no=1576, id=2199, vol=1.035779e+02 assign (segid " " and resid 134 and name HB2) (segid " " and resid 132 and name HD11) 2.532 0.801 0.801 weight 1.000 ! spec=c13n...li-4, no=1577, id=2200, vol=1.095324e+02 assign (segid " " and resid 151 and name HA2) (segid " " and resid 120 and name HG2) 2.485 0.772 0.772 weight 1.000 ! spec=c13n...li-4, no=1580, id=2203, vol=1.224183e+02 assign (segid " " and resid 138 and name HA) (segid " " and resid 138 and name HB1) 2.288 0.654 0.654 weight 1.000 ! spec=c13n...li-4, no=1581, id=2204, vol=2.009044e+02 assign (segid " " and resid 133 and name HB2) (segid " " and resid 137 and name HB2) 2.772 0.961 0.961 weight 1.000 ! spec=c13n...li-4, no=1588, id=2211, vol=6.353760e+01 assign (segid " " and resid 129 and name HB1) (segid " " and resid 126 and name HB2) 2.938 1.079 1.079 weight 1.000 ! spec=c13n...li-4, no=1590, id=2213, vol=4.480920e+01 assign (segid " " and resid 138 and name HB1) (segid " " and resid 138 and name HB2) 1.667 0.348 0.348 weight 1.000 ! spec=c13n...li-4, no=1591, id=2214, vol=1.341313e+03 assign (segid " " and resid 120 and name HB2) (segid " " and resid 120 and name HG2) 1.989 0.495 0.495 weight 1.000 ! spec=c13n...li-4, no=1596, id=2217, vol=4.654267e+02 assign (segid " " and resid 184 and name HB2) (segid " " and resid 185 and name HG) 2.981 1.111 1.111 weight 1.000 ! spec=c13n...li-4, no=1597, id=2218, vol=4.109220e+01 assign (segid " " and resid 120 and name HG2) (segid " " and resid 120 and name HG1) 2.182 0.595 0.595 weight 1.000 ! spec=c13n...li-4, no=1598, id=2219, vol=2.669473e+02 assign (segid " " and resid 120 and name HG2) (segid " " and resid 152 and name HB1) 2.371 0.703 0.703 weight 1.000 ! spec=c13n...li-4, no=1599, id=2220, vol=1.620943e+02 assign (segid " " and resid 184 and name HB2) (segid " " and resid 185 and name HD22) 2.592 0.840 0.840 weight 1.000 ! spec=c13n...li-4, no=1601, id=2222, vol=9.506070e+01 or (segid " " and resid 184 and name HB2) (segid " " and resid 185 and name HD21) or (segid " " and resid 184 and name HB2) (segid " " and resid 185 and name HD23) assign (segid " " and resid 120 and name HG2) (segid " " and resid 139 and name HG22) 3.020 1.140 1.140 weight 1.000 ! spec=c13n...li-4, no=1602, id=2223, vol=3.796940e+01 or (segid " " and resid 120 and name HG2) (segid " " and resid 139 and name HG21) or (segid " " and resid 120 and name HG2) (segid " " and resid 139 and name HG23) assign (segid " " and resid 120 and name HG2) (segid " " and resid 124 and name HD11) 2.751 0.946 3.249 weight 1.000 ! spec=c13n...li-4, no=1603, id=2224, vol=6.647620e+01 assign (segid " " and resid 120 and name HG2) (segid " " and resid 118 and name HG21) 2.963 1.098 3.037 weight 1.000 ! spec=c13n...li-4, no=1604, id=2225, vol=4.259940e+01 assign (segid " " and resid 178 and name HA) (segid " " and resid 178 and name HB1) 2.598 0.844 0.844 weight 1.000 ! spec=c13n...li-4, no=1606, id=2227, vol=9.381860e+01 assign (segid " " and resid 102 and name HA) (segid " " and resid 102 and name HB2) 2.280 0.650 0.650 weight 1.000 ! spec=c13n...li-4, no=1609, id=2229, vol=2.055088e+02 assign (segid " " and resid 178 and name HB2) (segid " " and resid 178 and name HB1) 2.056 0.528 0.528 weight 1.000 ! spec=c13n...li-4, no=1614, id=2234, vol=3.821907e+02 assign (segid " " and resid 109 and name HB2) (segid " " and resid 109 and name HG2) 2.168 0.588 0.588 weight 1.000 ! spec=c13n...li-4, no=1616, id=2236, vol=2.776611e+02 assign (segid " " and resid 102 and name HG2) (segid " " and resid 102 and name HB2) 2.024 0.512 0.512 weight 1.000 ! spec=c13n...li-4, no=1617, id=2237, vol=4.196853e+02 assign (segid " " and resid 95 and name HD2) (segid " " and resid 94 and name HA) 2.148 0.576 0.576 weight 1.000 ! spec=c13n...li-4, no=1622, id=2240, vol=2.939333e+02 assign (segid " " and resid 154 and name HD2) (segid " " and resid 154 and name HB2) 2.206 0.609 3.794 weight 1.000 ! spec=c13n...li-4, no=1628, id=2246, vol=2.499260e+02 assign (segid " " and resid 173 and name HG) (segid " " and resid 173 and name HB2) 2.030 0.515 0.515 weight 1.000 ! spec=c13n...li-4, no=1630, id=2247, vol=4.117402e+02 assign (segid " " and resid 95 and name HD2) (segid " " and resid 95 and name HD1) 1.989 0.494 0.494 weight 1.000 ! spec=c13n...li-4, no=1631, id=2248, vol=4.662442e+02 assign (segid " " and resid 169 and name HD2) (segid " " and resid 167 and name HA) 2.630 0.865 3.370 weight 1.000 ! spec=c13n...li-4, no=1633, id=2249, vol=8.706140e+01 assign (segid " " and resid 102 and name HA) (segid " " and resid 102 and name HB1) 2.279 0.649 0.649 weight 1.000 ! spec=c13n...li-4, no=1637, id=2253, vol=2.057122e+02 assign (segid " " and resid 117 and name HD2) (segid " " and resid 181 and name HD2) 2.885 1.041 3.115 weight 1.000 ! spec=c13n...li-4, no=1639, id=2255, vol=4.995790e+01 assign (segid " " and resid 169 and name HD2) (segid " " and resid 166 and name HB1) 2.683 0.899 3.317 weight 1.000 ! spec=c13n...li-4, no=1640, id=2256, vol=7.738120e+01 assign (segid " " and resid 102 and name HB1) (segid " " and resid 103 and name HB1) 2.792 0.974 3.208 weight 1.000 ! spec=c13n...li-4, no=1641, id=2257, vol=6.089140e+01 assign (segid " " and resid 108 and name HB2) (segid " " and resid 108 and name HD2) 1.884 0.444 0.444 weight 1.000 ! spec=c13n...li-4, no=1645, id=2259, vol=6.441943e+02 assign (segid " " and resid 102 and name HB1) (segid " " and resid 105 and name HD21) 2.791 0.974 3.209 weight 1.000 ! spec=c13n...li-4, no=1649, id=2262, vol=6.101860e+01 assign (segid " " and resid 108 and name HD2) (segid " " and resid 160 and name HD22) 2.768 0.958 3.232 weight 1.000 ! spec=c13n...li-4, no=1650, id=2263, vol=6.408010e+01 or (segid " " and resid 108 and name HD2) (segid " " and resid 160 and name HD21) or (segid " " and resid 108 and name HD2) (segid " " and resid 160 and name HD23) assign (segid " " and resid 146 and name HD2) (segid " " and resid 146 and name HG1) 2.710 0.918 0.918 weight 1.000 ! spec=c13n...li-4, no=1655, id=2267, vol=7.282200e+01 assign (segid " " and resid 123 and name HG11) (segid " " and resid 123 and name HB) 2.544 0.809 0.809 weight 1.000 ! spec=c13n...li-4, no=1662, id=2274, vol=1.063958e+02 assign (segid " " and resid 120 and name HB2) (segid " " and resid 124 and name HG11) 2.917 1.064 3.083 weight 1.000 ! spec=c13n...li-4, no=1667, id=2278, vol=4.681340e+01 assign (segid " " and resid 124 and name HA) (segid " " and resid 124 and name HG11) 2.470 0.763 3.530 weight 1.000 ! spec=c13n...li-4, no=1668, id=2279, vol=1.268537e+02 assign (segid " " and resid 124 and name HG12) (segid " " and resid 136 and name HB1) 3.022 1.142 1.142 weight 1.000 ! spec=c13n...li-4, no=1670, id=2281, vol=3.783610e+01 assign (segid " " and resid 124 and name HG11) (segid " " and resid 124 and name HG21) 2.307 0.665 3.693 weight 1.000 ! spec=c13n...li-4, no=1678, id=2285, vol=1.913660e+02 assign (segid " " and resid 124 and name HG11) (segid " " and resid 124 and name HD11) 2.135 0.570 0.570 weight 1.000 ! spec=c13n...li-4, no=1679, id=2286, vol=3.042180e+02 assign (segid " " and resid 124 and name HG12) (segid " " and resid 124 and name HA) 2.537 0.804 0.804 weight 1.000 ! spec=c13n...li-4, no=1682, id=2288, vol=1.081696e+02 assign (segid " " and resid 97 and name HG12) (segid " " and resid 97 and name HB) 2.504 0.784 0.784 weight 1.000 ! spec=c13n...li-4, no=1685, id=2291, vol=1.169322e+02 assign (segid " " and resid 97 and name HG11) (segid " " and resid 97 and name HG12) 1.817 0.413 0.413 weight 1.000 ! spec=c13n...li-4, no=1686, id=2292, vol=8.019342e+02 assign (segid " " and resid 124 and name HG12) (segid " " and resid 124 and name HG21) 2.198 0.604 3.802 weight 1.000 ! spec=c13n...li-4, no=1691, id=2293, vol=2.554216e+02 assign (segid " " and resid 124 and name HG12) (segid " " and resid 124 and name HD11) 2.161 0.584 3.839 weight 1.000 ! spec=c13n...li-4, no=1692, id=2294, vol=2.831331e+02 assign (segid " " and resid 124 and name HG12) (segid " " and resid 123 and name HD11) 2.895 1.047 3.105 weight 1.000 ! spec=c13n...li-4, no=1693, id=2295, vol=4.902080e+01 assign (segid " " and resid 97 and name HG12) (segid " " and resid 97 and name HD11) 2.119 0.561 0.561 weight 1.000 ! spec=c13n...li-4, no=1694, id=2296, vol=3.188809e+02 assign (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HD11) 2.213 0.612 3.787 weight 1.000 ! spec=c13n...li-4, no=1706, id=2303, vol=2.455092e+02 assign (segid " " and resid 186 and name HB2) (segid " " and resid 175 and name HD12) 2.672 0.892 0.892 weight 1.000 ! spec=c13n...li-4, no=1707, id=2304, vol=7.927230e+01 or (segid " " and resid 186 and name HB2) (segid " " and resid 175 and name HD11) or (segid " " and resid 186 and name HB2) (segid " " and resid 175 and name HD13) assign (segid " " and resid 175 and name HD12) (segid " " and resid 182 and name HB2) 2.796 0.978 0.978 weight 1.000 ! spec=c13n...li-4, no=1708, id=2305, vol=6.028600e+01 or (segid " " and resid 175 and name HD11) (segid " " and resid 182 and name HB2) or (segid " " and resid 175 and name HD13) (segid " " and resid 182 and name HB2) assign (segid " " and resid 175 and name HD12) (segid " " and resid 182 and name HB1) 2.434 0.741 0.741 weight 1.000 ! spec=c13n...li-4, no=1709, id=2306, vol=1.386340e+02 or (segid " " and resid 175 and name HD11) (segid " " and resid 182 and name HB1) or (segid " " and resid 175 and name HD13) (segid " " and resid 182 and name HB1) assign (segid " " and resid 175 and name HD12) (segid " " and resid 171 and name HB2) 3.087 1.191 1.191 weight 1.000 ! spec=c13n...li-4, no=1713, id=2310, vol=3.332040e+01 or (segid " " and resid 175 and name HD11) (segid " " and resid 171 and name HB2) or (segid " " and resid 175 and name HD13) (segid " " and resid 171 and name HB2) assign (segid " " and resid 175 and name HB1) (segid " " and resid 175 and name HD12) 2.480 0.769 0.769 weight 1.000 ! spec=c13n...li-4, no=1715, id=2312, vol=1.240078e+02 or (segid " " and resid 175 and name HB1) (segid " " and resid 175 and name HD11) or (segid " " and resid 175 and name HB1) (segid " " and resid 175 and name HD13) assign (segid " " and resid 175 and name HD12) (segid " " and resid 175 and name HD22) 1.983 0.492 0.492 weight 1.000 ! spec=c13n...li-4, no=1719, id=2314, vol=4.738987e+02 or (segid " " and resid 175 and name HD12) (segid " " and resid 175 and name HD21) or (segid " " and resid 175 and name HD12) (segid " " and resid 175 and name HD23) or (segid " " and resid 175 and name HD11) (segid " " and resid 175 and name HD22) or (segid " " and resid 175 and name HD11) (segid " " and resid 175 and name HD21) or (segid " " and resid 175 and name HD11) (segid " " and resid 175 and name HD23) or (segid " " and resid 175 and name HD13) (segid " " and resid 175 and name HD22) or (segid " " and resid 175 and name HD13) (segid " " and resid 175 and name HD21) or (segid " " and resid 175 and name HD13) (segid " " and resid 175 and name HD23) assign (segid " " and resid 175 and name HD12) (segid " " and resid 123 and name HD12) 2.671 0.892 0.892 weight 1.000 ! spec=c13n...li-4, no=1720, id=2315, vol=7.937190e+01 or (segid " " and resid 175 and name HD12) (segid " " and resid 123 and name HD11) or (segid " " and resid 175 and name HD12) (segid " " and resid 123 and name HD13) or (segid " " and resid 175 and name HD11) (segid " " and resid 123 and name HD12) or (segid " " and resid 175 and name HD11) (segid " " and resid 123 and name HD11) or (segid " " and resid 175 and name HD11) (segid " " and resid 123 and name HD13) or (segid " " and resid 175 and name HD13) (segid " " and resid 123 and name HD12) or (segid " " and resid 175 and name HD13) (segid " " and resid 123 and name HD11) or (segid " " and resid 175 and name HD13) (segid " " and resid 123 and name HD13) assign (segid " " and resid 175 and name HD11) (segid " " and resid 118 and name HD11) 2.778 0.965 3.222 weight 1.000 ! spec=c13n...li-4, no=1722, id=2317, vol=6.274010e+01 assign (segid " " and resid 107 and name HD11) (segid " " and resid 186 and name HZ3) 2.437 0.742 3.563 weight 1.000 ! spec=c13n...li-4, no=1725, id=2318, vol=1.377348e+02 assign (segid " " and resid 107 and name HD11) (segid " " and resid 103 and name HA) 2.885 1.040 3.115 weight 1.000 ! spec=c13n...li-4, no=1728, id=2321, vol=5.001730e+01 assign (segid " " and resid 156 and name HA) (segid " " and resid 107 and name HD11) 2.466 0.760 3.534 weight 1.000 ! spec=c13n...li-4, no=1729, id=2322, vol=1.281349e+02 assign (segid " " and resid 107 and name HB2) (segid " " and resid 107 and name HD11) 2.471 0.763 3.529 weight 1.000 ! spec=c13n...li-4, no=1730, id=2323, vol=1.266697e+02 assign (segid " " and resid 107 and name HB1) (segid " " and resid 107 and name HD11) 2.472 0.764 0.764 weight 1.000 ! spec=c13n...li-4, no=1731, id=2324, vol=1.263277e+02 assign (segid " " and resid 107 and name HD11) (segid " " and resid 160 and name HG) 2.695 0.908 3.305 weight 1.000 ! spec=c13n...li-4, no=1732, id=2325, vol=7.524370e+01 assign (segid " " and resid 107 and name HD11) (segid " " and resid 107 and name HG) 2.226 0.620 0.620 weight 1.000 ! spec=c13n...li-4, no=1733, id=2326, vol=2.367846e+02 assign (segid " " and resid 159 and name HB2) (segid " " and resid 107 and name HD11) 2.603 0.847 0.847 weight 1.000 ! spec=c13n...li-4, no=1734, id=2327, vol=9.259720e+01 assign (segid " " and resid 107 and name HD11) (segid " " and resid 160 and name HD21) 2.529 0.799 3.471 weight 1.000 ! spec=c13n...li-4, no=1735, id=2328, vol=1.102612e+02 assign (segid " " and resid 107 and name HD11) (segid " " and resid 107 and name HD21) 2.947 1.474 1.474 weight 1.000 ! spec=c13n...li-4, no=1739, id=2330, vol=5.290291e+02 assign (segid " " and resid 159 and name HB1) (segid " " and resid 107 and name HD11) 2.699 0.911 0.911 weight 1.000 ! spec=c13n...li-4, no=1740, id=2331, vol=7.456270e+01 assign (segid " " and resid 143 and name HB2) (segid " " and resid 143 and name HB1) 1.994 0.497 0.497 weight 1.000 ! spec=c13n...li-4, no=1749, id=2334, vol=4.587016e+02 assign (segid " " and resid 143 and name HB2) (segid " " and resid 121 and name HG21) 2.627 0.863 0.863 weight 1.000 ! spec=c13n...li-4, no=1752, id=2337, vol=8.776100e+01 assign (segid " " and resid 143 and name HB2) (segid " " and resid 142 and name HG21) 2.746 0.943 3.254 weight 1.000 ! spec=c13n...li-4, no=1753, id=2338, vol=6.722140e+01 assign (segid " " and resid 136 and name HA) (segid " " and resid 136 and name HB2) 2.405 0.723 0.723 weight 1.000 ! spec=c13n...li-4, no=1756, id=2341, vol=1.489477e+02 assign (segid " " and resid 136 and name HB2) (segid " " and resid 136 and name HB1) 1.860 0.433 0.433 weight 1.000 ! spec=c13n...li-4, no=1758, id=2342, vol=6.953298e+02 assign (segid " " and resid 140 and name HA) (segid " " and resid 143 and name HB1) 2.680 0.898 0.898 weight 1.000 ! spec=c13n...li-4, no=1762, id=2345, vol=7.773600e+01 assign (segid " " and resid 143 and name HB1) (segid " " and resid 148 and name HE2) 2.998 1.123 1.123 weight 1.000 ! spec=c13n...li-4, no=1770, id=2350, vol=3.972160e+01 or (segid " " and resid 143 and name HB1) (segid " " and resid 148 and name HE1) or (segid " " and resid 143 and name HB1) (segid " " and resid 148 and name HE3) assign (segid " " and resid 143 and name HB1) (segid " " and resid 121 and name HG21) 2.681 0.898 0.898 weight 1.000 ! spec=c13n...li-4, no=1771, id=2351, vol=7.769690e+01 or (segid " " and resid 143 and name HB1) (segid " " and resid 121 and name HG22) or (segid " " and resid 143 and name HB1) (segid " " and resid 121 and name HG23) assign (segid " " and resid 158 and name HB2) (segid " " and resid 139 and name HD11) 2.505 0.784 0.784 weight 1.000 ! spec=c13n...li-4, no=1772, id=2352, vol=1.167814e+02 assign (segid " " and resid 143 and name HB1) (segid " " and resid 142 and name HG21) 2.858 1.021 3.142 weight 1.000 ! spec=c13n...li-4, no=1774, id=2354, vol=5.287080e+01 assign (segid " " and resid 158 and name HB2) (segid " " and resid 158 and name HB1) 2.044 0.522 0.522 weight 1.000 ! spec=c13n...li-4, no=1782, id=2361, vol=3.952497e+02 assign (segid " " and resid 158 and name HB1) (segid " " and resid 139 and name HD11) 2.635 0.868 3.365 weight 1.000 ! spec=c13n...li-4, no=1784, id=2362, vol=8.610650e+01 assign (segid " " and resid 110 and name HA) (segid " " and resid 110 and name HG) 2.981 1.111 1.111 weight 1.000 ! spec=c13n...li-4, no=1793, id=2364, vol=4.104970e+01 assign (segid " " and resid 110 and name HG) (segid " " and resid 110 and name HD11) 2.473 0.764 0.764 weight 1.000 ! spec=c13n...li-4, no=1799, id=2368, vol=1.261626e+02 assign (segid " " and resid 110 and name HG) (segid " " and resid 110 and name HD21) 2.322 0.674 0.674 weight 1.000 ! spec=c13n...li-4, no=1800, id=2369, vol=1.841281e+02 assign (segid " " and resid 175 and name HD12) (segid " " and resid 175 and name HG) 2.404 0.723 0.723 weight 1.000 ! spec=c13n...li-4, no=1801, id=2370, vol=1.492405e+02 or (segid " " and resid 175 and name HD11) (segid " " and resid 175 and name HG) or (segid " " and resid 175 and name HD13) (segid " " and resid 175 and name HG) assign (segid " " and resid 173 and name HA) (segid " " and resid 173 and name HG) 2.529 0.800 0.800 weight 1.000 ! spec=c13n...li-4, no=1810, id=2376, vol=1.101425e+02 assign (segid " " and resid 179 and name HB2) (segid " " and resid 179 and name HB1) 2.041 0.521 0.521 weight 1.000 ! spec=c13n...li-4, no=1816, id=2380, vol=3.992928e+02 assign (segid " " and resid 179 and name HB1) (segid " " and resid 179 and name HG2) 2.341 0.685 0.685 weight 1.000 ! spec=c13n...li-4, no=1819, id=2382, vol=1.752402e+02 assign (segid " " and resid 109 and name HG2) (segid " " and resid 105 and name HD11) 2.221 0.616 0.616 weight 1.000 ! spec=c13n...li-4, no=1820, id=2383, vol=2.403758e+02 assign (segid " " and resid 173 and name HB1) (segid " " and resid 173 and name HG) 2.182 0.595 0.595 weight 1.000 ! spec=c13n...li-4, no=1833, id=2390, vol=2.668361e+02 assign (segid " " and resid 173 and name HG) (segid " " and resid 173 and name HD12) 1.823 0.416 0.416 weight 1.000 ! spec=c13n...li-4, no=1840, id=2392, vol=7.850873e+02 or (segid " " and resid 173 and name HG) (segid " " and resid 173 and name HD11) or (segid " " and resid 173 and name HG) (segid " " and resid 173 and name HD13) assign (segid " " and resid 160 and name HG) (segid " " and resid 160 and name HD12) 2.422 0.734 0.734 weight 1.000 ! spec=c13n...li-4, no=1843, id=2393, vol=1.426686e+02 or (segid " " and resid 160 and name HG) (segid " " and resid 160 and name HD11) or (segid " " and resid 160 and name HG) (segid " " and resid 160 and name HD13) assign (segid " " and resid 160 and name HG) (segid " " and resid 160 and name HD22) 2.150 0.578 0.578 weight 1.000 ! spec=c13n...li-4, no=1845, id=2394, vol=2.921548e+02 or (segid " " and resid 160 and name HG) (segid " " and resid 160 and name HD21) or (segid " " and resid 160 and name HG) (segid " " and resid 160 and name HD23) assign (segid " " and resid 160 and name HG) (segid " " and resid 156 and name HG11) 2.660 0.884 3.340 weight 1.000 ! spec=c13n...li-4, no=1846, id=2395, vol=8.145850e+01 assign (segid " " and resid 108 and name HA) (segid " " and resid 108 and name HG1) 2.817 0.992 0.992 weight 1.000 ! spec=c13n...li-4, no=1852, id=2399, vol=5.764130e+01 assign (segid " " and resid 108 and name HE2) (segid " " and resid 108 and name HG1) 2.725 0.928 0.928 weight 1.000 ! spec=c13n...li-4, no=1854, id=2401, vol=7.040150e+01 assign (segid " " and resid 108 and name HB2) (segid " " and resid 108 and name HG1) 2.311 0.668 0.668 weight 1.000 ! spec=c13n...li-4, no=1855, id=2402, vol=1.890608e+02 assign (segid " " and resid 108 and name HG1) (segid " " and resid 160 and name HG) 2.848 1.014 1.014 weight 1.000 ! spec=c13n...li-4, no=1856, id=2403, vol=5.399460e+01 assign (segid " " and resid 108 and name HG1) (segid " " and resid 160 and name HD11) 2.676 0.895 0.895 weight 1.000 ! spec=c13n...li-4, no=1860, id=2405, vol=7.856730e+01 assign (segid " " and resid 108 and name HG1) (segid " " and resid 160 and name HD21) 2.938 1.079 1.079 weight 1.000 ! spec=c13n...li-4, no=1861, id=2406, vol=4.480700e+01 assign (segid " " and resid 131 and name HA) (segid " " and resid 131 and name HG) 2.890 1.044 1.044 weight 1.000 ! spec=c13n...li-4, no=1862, id=2407, vol=4.951890e+01 assign (segid " " and resid 106 and name HA) (segid " " and resid 105 and name HG) 2.505 0.784 3.495 weight 1.000 ! spec=c13n...li-4, no=1864, id=2409, vol=1.166658e+02 assign (segid " " and resid 131 and name HG) (segid " " and resid 136 and name HB1) 2.590 0.838 3.410 weight 1.000 ! spec=c13n...li-4, no=1870, id=2415, vol=9.553810e+01 assign (segid " " and resid 176 and name HG2) (segid " " and resid 179 and name HG2) 2.724 0.927 3.276 weight 1.000 ! spec=c13n...li-4, no=1871, id=2416, vol=7.063010e+01 assign (segid " " and resid 105 and name HG) (segid " " and resid 106 and name HB2) 5.880 4.037 1.037 weight 1.000 ! spec=c13n...li-4, no=1872, id=2417, vol=5.054950e+01 assign (segid " " and resid 164 and name HG1) (segid " " and resid 165 and name HG2) 2.828 1.000 3.172 weight 1.000 ! spec=c13n...li-4, no=1873, id=2418, vol=5.638540e+01 assign (segid " " and resid 179 and name HB2) (segid " " and resid 179 and name HG2) 2.259 0.638 0.638 weight 1.000 ! spec=c13n...li-4, no=1874, id=2419, vol=2.168074e+02 assign (segid " " and resid 181 and name HB2) (segid " " and resid 181 and name HG2) 2.367 0.700 0.700 weight 1.000 ! spec=c13n...li-4, no=1876, id=2421, vol=1.639305e+02 assign (segid " " and resid 155 and name HG) (segid " " and resid 114 and name HE1) 3.050 1.163 1.163 weight 1.000 ! spec=c13n...li-4, no=1882, id=2426, vol=3.580110e+01 assign (segid " " and resid 185 and name HA) (segid " " and resid 185 and name HG) 2.570 0.826 0.826 weight 1.000 ! spec=c13n...li-4, no=1883, id=2427, vol=9.999280e+01 assign (segid " " and resid 184 and name HG2) (segid " " and resid 185 and name HG) 2.640 0.871 3.360 weight 1.000 ! spec=c13n...li-4, no=1885, id=2429, vol=8.524190e+01 assign (segid " " and resid 108 and name HB2) (segid " " and resid 108 and name HG2) 2.309 0.666 0.666 weight 1.000 ! spec=c13n...li-4, no=1886, id=2430, vol=1.904668e+02 assign (segid " " and resid 120 and name HG1) (segid " " and resid 152 and name HB1) 2.688 0.903 0.903 weight 1.000 ! spec=c13n...li-4, no=1887, id=2431, vol=7.652580e+01 assign (segid " " and resid 108 and name HG1) (segid " " and resid 108 and name HG2) 1.944 0.472 0.472 weight 1.000 ! spec=c13n...li-4, no=1888, id=2432, vol=5.343301e+02 assign (segid " " and resid 123 and name HG11) (segid " " and resid 123 and name HG12) 2.423 0.734 0.734 weight 1.000 ! spec=c13n...li-4, no=1889, id=2433, vol=1.426632e+02 assign (segid " " and resid 185 and name HG) (segid " " and resid 185 and name HB1) 2.393 0.716 0.716 weight 1.000 ! spec=c13n...li-4, no=1890, id=2434, vol=1.534230e+02 assign (segid " " and resid 155 and name HG) (segid " " and resid 159 and name HD22) 2.808 0.986 0.986 weight 1.000 ! spec=c13n...li-4, no=1892, id=2436, vol=5.883120e+01 or (segid " " and resid 155 and name HG) (segid " " and resid 159 and name HD21) or (segid " " and resid 155 and name HG) (segid " " and resid 159 and name HD23) or (segid " " and resid 155 and name HG) (segid " " and resid 159 and name HD12) or (segid " " and resid 155 and name HG) (segid " " and resid 159 and name HD11) or (segid " " and resid 155 and name HG) (segid " " and resid 159 and name HD13) assign (segid " " and resid 119 and name HA) (segid " " and resid 119 and name HG12) 2.813 0.989 0.989 weight 1.000 ! spec=c13n...li-4, no=1894, id=2438, vol=5.817250e+01 assign (segid " " and resid 159 and name HG) (segid " " and resid 158 and name HB2) 3.039 1.155 2.961 weight 1.000 ! spec=c13n...li-4, no=1898, id=2442, vol=3.659670e+01 assign (segid " " and resid 123 and name HG12) (segid " " and resid 123 and name HB) 2.828 1.000 1.000 weight 1.000 ! spec=c13n...li-4, no=1899, id=2443, vol=5.639930e+01 assign (segid " " and resid 119 and name HG12) (segid " " and resid 119 and name HG11) 1.903 0.453 0.453 weight 1.000 ! spec=c13n...li-4, no=1904, id=2446, vol=6.067012e+02 assign (segid " " and resid 108 and name HG2) (segid " " and resid 160 and name HD11) 2.897 1.049 3.103 weight 1.000 ! spec=c13n...li-4, no=1906, id=2447, vol=4.879280e+01 assign (segid " " and resid 119 and name HG12) (segid " " and resid 119 and name HG21) 2.317 0.671 3.683 weight 1.000 ! spec=c13n...li-4, no=1909, id=2450, vol=1.864689e+02 assign (segid " " and resid 108 and name HG2) (segid " " and resid 160 and name HD21) 2.665 0.888 0.888 weight 1.000 ! spec=c13n...li-4, no=1911, id=2452, vol=8.046650e+01 assign (segid " " and resid 169 and name HG2) (segid " " and resid 168 and name HB1) 2.339 0.684 0.684 weight 1.000 ! spec=c13n...li-4, no=1912, id=2453, vol=1.760840e+02 assign (segid " " and resid 135 and name HG2) (segid " " and resid 132 and name HG12) 2.610 0.852 0.852 weight 1.000 ! spec=c13n...li-4, no=1916, id=2457, vol=9.115370e+01 assign (segid " " and resid 132 and name HG12) (segid " " and resid 131 and name HG) 3.862 1.024 2.024 weight 1.000 ! spec=c13n...li-4, no=1918, id=2459, vol=5.250620e+01 assign (segid " " and resid 132 and name HG12) (segid " " and resid 132 and name HG22) 2.074 0.538 0.538 weight 1.000 ! spec=c13n...li-4, no=1920, id=2460, vol=3.621721e+02 or (segid " " and resid 132 and name HG12) (segid " " and resid 132 and name HG21) or (segid " " and resid 132 and name HG12) (segid " " and resid 132 and name HG23) assign (segid " " and resid 159 and name HG) (segid " " and resid 127 and name HD11) 3.658 1.883 1.883 weight 1.000 ! spec=c13n...li-4, no=1923, id=2463, vol=8.172450e+01 assign (segid " " and resid 119 and name HG11) (segid " " and resid 119 and name HA) 2.806 0.984 0.984 weight 1.000 ! spec=c13n...li-4, no=1928, id=2467, vol=5.903410e+01 assign (segid " " and resid 171 and name HA) (segid " " and resid 171 and name HG) 2.829 1.000 1.000 weight 1.000 ! spec=c13n...li-4, no=1929, id=2468, vol=5.630340e+01 assign (segid " " and resid 119 and name HB) (segid " " and resid 119 and name HG11) 2.461 0.757 0.757 weight 1.000 ! spec=c13n...li-4, no=1932, id=2471, vol=1.296529e+02 assign (segid " " and resid 187 and name HB) (segid " " and resid 187 and name HG12) 2.367 0.700 0.700 weight 1.000 ! spec=c13n...li-4, no=1933, id=2472, vol=1.638776e+02 assign (segid " " and resid 187 and name HG12) (segid " " and resid 187 and name HG11) 1.846 0.426 0.426 weight 1.000 ! spec=c13n...li-4, no=1935, id=2474, vol=7.288438e+02 assign (segid " " and resid 175 and name HD11) (segid " " and resid 171 and name HG) 2.264 0.641 3.736 weight 1.000 ! spec=c13n...li-4, no=1938, id=2476, vol=2.142417e+02 assign (segid " " and resid 110 and name HD11) (segid " " and resid 186 and name HE3) 2.620 0.858 0.858 weight 1.000 ! spec=c13n...li-4, no=1941, id=2478, vol=8.920360e+01 assign (segid " " and resid 110 and name HD11) (segid " " and resid 182 and name HE1) 2.631 0.865 0.865 weight 1.000 ! spec=c13n...li-4, no=1942, id=2479, vol=8.694600e+01 assign (segid " " and resid 110 and name HD11) (segid " " and resid 182 and name HD1) 2.839 1.007 1.007 weight 1.000 ! spec=c13n...li-4, no=1943, id=2480, vol=5.509960e+01 assign (segid " " and resid 110 and name HD11) (segid " " and resid 186 and name HA) 2.880 1.036 1.036 weight 1.000 ! spec=c13n...li-4, no=1945, id=2482, vol=5.058140e+01 assign (segid " " and resid 110 and name HD11) (segid " " and resid 113 and name HA) 3.045 1.159 2.955 weight 1.000 ! spec=c13n...li-4, no=1946, id=2483, vol=3.617720e+01 assign (segid " " and resid 110 and name HB2) (segid " " and resid 110 and name HD11) 3.340 1.685 1.685 weight 1.000 ! spec=c13n...li-4, no=1947, id=2484, vol=1.754502e+02 assign (segid " " and resid 110 and name HD11) (segid " " and resid 113 and name HB1) 2.157 0.582 0.582 weight 1.000 ! spec=c13n...li-4, no=1948, id=2485, vol=2.863406e+02 assign (segid " " and resid 110 and name HD11) (segid " " and resid 185 and name HB2) 2.475 0.766 0.766 weight 1.000 ! spec=c13n...li-4, no=1950, id=2487, vol=1.253945e+02 assign (segid " " and resid 110 and name HD12) (segid " " and resid 106 and name HD12) 2.590 0.839 0.839 weight 1.000 ! spec=c13n...li-4, no=1954, id=2488, vol=9.548680e+01 or (segid " " and resid 110 and name HD12) (segid " " and resid 106 and name HD11) or (segid " " and resid 110 and name HD12) (segid " " and resid 106 and name HD13) or (segid " " and resid 110 and name HD11) (segid " " and resid 106 and name HD12) or (segid " " and resid 110 and name HD11) (segid " " and resid 106 and name HD11) or (segid " " and resid 110 and name HD11) (segid " " and resid 106 and name HD13) or (segid " " and resid 110 and name HD13) (segid " " and resid 106 and name HD12) or (segid " " and resid 110 and name HD13) (segid " " and resid 106 and name HD11) or (segid " " and resid 110 and name HD13) (segid " " and resid 106 and name HD13) assign (segid " " and resid 187 and name HG11) (segid " " and resid 187 and name HA) 2.797 0.978 0.978 weight 1.000 ! spec=c13n...li-4, no=1956, id=2490, vol=6.022450e+01 assign (segid " " and resid 177 and name HE2) (segid " " and resid 173 and name HD11) 2.600 0.845 0.845 weight 1.000 ! spec=c13n...li-4, no=1965, id=2494, vol=9.330860e+01 assign (segid " " and resid 113 and name HA) (segid " " and resid 185 and name HD11) 2.560 0.819 0.819 weight 1.000 ! spec=c13n...li-4, no=1976, id=2497, vol=1.024726e+02 assign (segid " " and resid 120 and name HD2) (segid " " and resid 155 and name HD11) 2.673 0.893 3.327 weight 1.000 ! spec=c13n...li-4, no=1977, id=2498, vol=7.905280e+01 assign (segid " " and resid 113 and name HB2) (segid " " and resid 185 and name HD11) 2.323 0.675 0.675 weight 1.000 ! spec=c13n...li-4, no=1980, id=2500, vol=1.833962e+02 assign (segid " " and resid 113 and name HG1) (segid " " and resid 185 and name HD11) 2.520 0.794 0.794 weight 1.000 ! spec=c13n...li-4, no=1981, id=2501, vol=1.125293e+02 assign (segid " " and resid 155 and name HD11) (segid " " and resid 139 and name HG12) 2.977 1.108 3.023 weight 1.000 ! spec=c13n...li-4, no=1985, id=2504, vol=4.143890e+01 assign (segid " " and resid 155 and name HD11) (segid " " and resid 114 and name HZ) 2.392 0.715 3.608 weight 1.000 ! spec=c13n...li-4, no=1993, id=2508, vol=1.540959e+02 assign (segid " " and resid 127 and name HD12) (segid " " and resid 127 and name HA) 2.824 0.997 0.997 weight 1.000 ! spec=c13n...li-4, no=1994, id=2509, vol=5.681500e+01 or (segid " " and resid 127 and name HA) (segid " " and resid 127 and name HD11) or (segid " " and resid 127 and name HD13) (segid " " and resid 127 and name HA) assign (segid " " and resid 160 and name HD22) (segid " " and resid 157 and name HA) 2.481 0.769 0.769 weight 1.000 ! spec=c13n...li-4, no=1995, id=2510, vol=1.236466e+02 or (segid " " and resid 157 and name HA) (segid " " and resid 160 and name HD21) or (segid " " and resid 160 and name HD23) (segid " " and resid 157 and name HA) assign (segid " " and resid 155 and name HD12) (segid " " and resid 152 and name HA) 2.437 0.742 0.742 weight 1.000 ! spec=c13n...li-4, no=1996, id=2511, vol=1.376314e+02 or (segid " " and resid 152 and name HA) (segid " " and resid 155 and name HD11) or (segid " " and resid 155 and name HD13) (segid " " and resid 152 and name HA) assign (segid " " and resid 127 and name HD11) (segid " " and resid 130 and name HB1) 2.997 1.123 1.123 weight 1.000 ! spec=c13n...li-4, no=1997, id=2512, vol=3.980500e+01 assign (segid " " and resid 155 and name HG) (segid " " and resid 155 and name HD11) 2.180 0.594 0.594 weight 1.000 ! spec=c13n...li-4, no=2000, id=2514, vol=2.684336e+02 assign (segid " " and resid 160 and name HD22) (segid " " and resid 160 and name HD12) 2.049 0.525 0.525 weight 1.000 ! spec=c13n...li-4, no=2003, id=2516, vol=3.897831e+02 or (segid " " and resid 160 and name HD22) (segid " " and resid 160 and name HD11) or (segid " " and resid 160 and name HD22) (segid " " and resid 160 and name HD13) or (segid " " and resid 160 and name HD21) (segid " " and resid 160 and name HD12) or (segid " " and resid 160 and name HD21) (segid " " and resid 160 and name HD11) or (segid " " and resid 160 and name HD21) (segid " " and resid 160 and name HD13) or (segid " " and resid 160 and name HD23) (segid " " and resid 160 and name HD12) or (segid " " and resid 160 and name HD23) (segid " " and resid 160 and name HD11) or (segid " " and resid 160 and name HD23) (segid " " and resid 160 and name HD13) assign (segid " " and resid 127 and name HD12) (segid " " and resid 159 and name HD22) 2.298 0.660 0.660 weight 1.000 ! spec=c13n...li-4, no=2005, id=2517, vol=1.958702e+02 or (segid " " and resid 127 and name HD12) (segid " " and resid 159 and name HD21) or (segid " " and resid 127 and name HD12) (segid " " and resid 159 and name HD23) or (segid " " and resid 127 and name HD12) (segid " " and resid 159 and name HD12) or (segid " " and resid 127 and name HD12) (segid " " and resid 159 and name HD11) or (segid " " and resid 127 and name HD12) (segid " " and resid 159 and name HD13) or (segid " " and resid 127 and name HD11) (segid " " and resid 159 and name HD22) or (segid " " and resid 127 and name HD11) (segid " " and resid 159 and name HD21) or (segid " " and resid 127 and name HD11) (segid " " and resid 159 and name HD23) or (segid " " and resid 127 and name HD11) (segid " " and resid 159 and name HD12) or (segid " " and resid 127 and name HD11) (segid " " and resid 159 and name HD11) or (segid " " and resid 127 and name HD11) (segid " " and resid 159 and name HD13) or (segid " " and resid 127 and name HD13) (segid " " and resid 159 and name HD22) or (segid " " and resid 127 and name HD13) (segid " " and resid 159 and name HD21) or (segid " " and resid 127 and name HD13) (segid " " and resid 159 and name HD23) or (segid " " and resid 127 and name HD13) (segid " " and resid 159 and name HD12) or (segid " " and resid 127 and name HD13) (segid " " and resid 159 and name HD11) or (segid " " and resid 127 and name HD13) (segid " " and resid 159 and name HD13) assign (segid " " and resid 155 and name HD11) (segid " " and resid 118 and name HG21) 2.431 0.739 0.739 weight 1.000 ! spec=c13n...li-4, no=2007, id=2519, vol=1.397818e+02 assign (segid " " and resid 155 and name HD11) (segid " " and resid 118 and name HD11) 2.899 1.051 1.051 weight 1.000 ! spec=c13n...li-4, no=2008, id=2520, vol=4.854570e+01 assign (segid " " and resid 106 and name HD11) (segid " " and resid 103 and name HN) 2.646 0.875 3.354 weight 1.000 ! spec=c13n...li-4, no=2009, id=2521, vol=8.409660e+01 assign (segid " " and resid 106 and name HD11) (segid " " and resid 186 and name HZ2) 2.541 0.807 3.459 weight 1.000 ! spec=c13n...li-4, no=2010, id=2522, vol=1.072207e+02 assign (segid " " and resid 187 and name HN) (segid " " and resid 106 and name HD11) 2.543 0.808 0.808 weight 1.000 ! spec=c13n...li-4, no=2011, id=2523, vol=1.066122e+02 assign (segid " " and resid 106 and name HD11) (segid " " and resid 103 and name HE1) 2.780 0.966 3.220 weight 1.000 ! spec=c13n...li-4, no=2012, id=2524, vol=6.246740e+01 assign (segid " " and resid 186 and name HA) (segid " " and resid 106 and name HD11) 2.592 0.840 3.408 weight 1.000 ! spec=c13n...li-4, no=2014, id=2526, vol=9.517350e+01 assign (segid " " and resid 106 and name HB2) (segid " " and resid 106 and name HD11) 2.189 0.599 3.811 weight 1.000 ! spec=c13n...li-4, no=2016, id=2528, vol=2.620749e+02 assign (segid " " and resid 106 and name HD11) (segid " " and resid 109 and name HG2) 2.097 0.550 3.903 weight 1.000 ! spec=c13n...li-4, no=2017, id=2529, vol=3.391671e+02 assign (segid " " and resid 106 and name HD11) (segid " " and resid 187 and name HG11) 2.338 0.684 3.662 weight 1.000 ! spec=c13n...li-4, no=2021, id=2533, vol=1.763311e+02 assign (segid " " and resid 106 and name HD11) (segid " " and resid 187 and name HD11) 2.613 0.853 3.387 weight 1.000 ! spec=c13n...li-4, no=2025, id=2535, vol=9.060310e+01 assign (segid " " and resid 131 and name HD11) (segid " " and resid 159 and name HD11) 2.493 0.777 0.777 weight 1.000 ! spec=c13n...li-4, no=2029, id=2536, vol=1.201344e+02 assign (segid " " and resid 159 and name HD21) (segid " " and resid 171 and name HB1) 2.568 0.825 0.825 weight 1.000 ! spec=c13n...li-4, no=2034, id=2539, vol=1.004425e+02 assign (segid " " and resid 127 and name HD11) (segid " " and resid 159 and name HD11) 2.116 0.560 3.884 weight 1.000 ! spec=c13n...li-4, no=2038, id=2543, vol=3.214574e+02 assign (segid " " and resid 159 and name HD21) (segid " " and resid 107 and name HD11) 2.364 0.699 3.636 weight 1.000 ! spec=c13n...li-4, no=2039, id=2544, vol=1.651615e+02 assign (segid " " and resid 118 and name HG12) (segid " " and resid 118 and name HG11) 2.169 0.588 0.588 weight 1.000 ! spec=c13n...li-4, no=2048, id=2551, vol=2.772251e+02 assign (segid " " and resid 164 and name HA) (segid " " and resid 164 and name HG2) 2.748 0.944 0.944 weight 1.000 ! spec=c13n...li-4, no=2061, id=2558, vol=6.700550e+01 assign (segid " " and resid 130 and name HB2) (segid " " and resid 164 and name HG2) 2.582 0.833 0.833 weight 1.000 ! spec=c13n...li-4, no=2062, id=2559, vol=9.739390e+01 assign (segid " " and resid 164 and name HG2) (segid " " and resid 168 and name HD1) 2.980 1.110 3.020 weight 1.000 ! spec=c13n...li-4, no=2063, id=2560, vol=4.120000e+01 assign (segid " " and resid 164 and name HB2) (segid " " and resid 164 and name HG2) 2.371 0.703 0.703 weight 1.000 ! spec=c13n...li-4, no=2064, id=2561, vol=1.621685e+02 assign (segid " " and resid 164 and name HG1) (segid " " and resid 165 and name HA) 2.532 0.801 3.468 weight 1.000 ! spec=c13n...li-4, no=2071, id=2564, vol=1.095480e+02 assign (segid " " and resid 172 and name HB2) (segid " " and resid 172 and name HG1) 2.688 0.903 0.903 weight 1.000 ! spec=c13n...li-4, no=2075, id=2567, vol=7.649610e+01 assign (segid " " and resid 164 and name HB2) (segid " " and resid 164 and name HG1) 2.361 0.697 0.697 weight 1.000 ! spec=c13n...li-4, no=2076, id=2568, vol=1.665534e+02 assign (segid " " and resid 172 and name HB1) (segid " " and resid 172 and name HG1) 2.693 0.906 0.906 weight 1.000 ! spec=c13n...li-4, no=2079, id=2570, vol=7.560490e+01 assign (segid " " and resid 164 and name HG1) (segid " " and resid 164 and name HG2) 1.745 0.381 0.381 weight 1.000 ! spec=c13n...li-4, no=2080, id=2571, vol=1.021260e+03 assign (segid " " and resid 181 and name HA) (segid " " and resid 181 and name HG2) 2.396 0.717 0.717 weight 1.000 ! spec=c13n...li-4, no=2087, id=2574, vol=1.525738e+02 assign (segid " " and resid 172 and name HG2) (segid " " and resid 172 and name HA) 3.079 1.185 1.185 weight 1.000 ! spec=c13n...li-4, no=2090, id=2577, vol=3.385790e+01 assign (segid " " and resid 99 and name HE2) (segid " " and resid 99 and name HG2) 2.386 0.712 0.712 weight 1.000 ! spec=c13n...li-4, no=2091, id=2578, vol=1.562926e+02 assign (segid " " and resid 172 and name HB2) (segid " " and resid 172 and name HG2) 2.655 0.881 0.881 weight 1.000 ! spec=c13n...li-4, no=2093, id=2580, vol=8.228560e+01 assign (segid " " and resid 172 and name HG2) (segid " " and resid 176 and name HB2) 2.953 1.090 1.090 weight 1.000 ! spec=c13n...li-4, no=2095, id=2581, vol=4.347970e+01 assign (segid " " and resid 99 and name HB2) (segid " " and resid 99 and name HG2) 2.054 0.527 0.527 weight 1.000 ! spec=c13n...li-4, no=2096, id=2582, vol=3.838972e+02 assign (segid " " and resid 172 and name HB1) (segid " " and resid 172 and name HG2) 2.750 0.945 0.945 weight 1.000 ! spec=c13n...li-4, no=2098, id=2584, vol=6.672540e+01 assign (segid " " and resid 99 and name HG1) (segid " " and resid 99 and name HA) 2.724 0.927 0.927 weight 1.000 ! spec=c13n...li-4, no=2106, id=2587, vol=7.059910e+01 assign (segid " " and resid 96 and name HE2) (segid " " and resid 96 and name HG1) 2.245 0.630 0.630 weight 1.000 ! spec=c13n...li-4, no=2108, id=2589, vol=2.254233e+02 assign (segid " " and resid 146 and name HG2) (segid " " and resid 142 and name HG21) 2.855 1.019 3.145 weight 1.000 ! spec=c13n...li-4, no=2117, id=2595, vol=5.319240e+01 assign (segid " " and resid 167 and name HA) (segid " " and resid 170 and name HG21) 2.589 0.838 0.838 weight 1.000 ! spec=c13n...li-4, no=2118, id=2596, vol=9.576920e+01 assign (segid " " and resid 127 and name HA) (segid " " and resid 170 and name HG21) 2.192 0.600 0.600 weight 1.000 ! spec=c13n...li-4, no=2119, id=2597, vol=2.601063e+02 assign (segid " " and resid 96 and name HA) (segid " " and resid 96 and name HG1) 2.583 0.834 3.417 weight 1.000 ! spec=c13n...li-4, no=2120, id=2598, vol=9.698360e+01 assign (segid " " and resid 170 and name HB) (segid " " and resid 170 and name HG21) 1.979 0.490 4.021 weight 1.000 ! spec=c13n...li-4, no=2124, id=2601, vol=4.793258e+02 assign (segid " " and resid 171 and name HA) (segid " " and resid 170 and name HG21) 2.521 0.795 0.795 weight 1.000 ! spec=c13n...li-4, no=2125, id=2602, vol=1.122736e+02 or (segid " " and resid 171 and name HA) (segid " " and resid 170 and name HG22) or (segid " " and resid 171 and name HA) (segid " " and resid 170 and name HG23) assign (segid " " and resid 170 and name HA) (segid " " and resid 170 and name HG21) 1.974 0.487 4.026 weight 1.000 ! spec=c13n...li-4, no=2127, id=2603, vol=4.871718e+02 assign (segid " " and resid 170 and name HG21) (segid " " and resid 130 and name HB1) 3.000 1.125 1.125 weight 1.000 ! spec=c13n...li-4, no=2129, id=2605, vol=3.957580e+01 or (segid " " and resid 170 and name HG22) (segid " " and resid 130 and name HB1) or (segid " " and resid 170 and name HG23) (segid " " and resid 130 and name HB1) assign (segid " " and resid 154 and name HE2) (segid " " and resid 154 and name HG2) 2.914 1.061 1.061 weight 1.000 ! spec=c13n...li-4, no=2130, id=2606, vol=4.713670e+01 assign (segid " " and resid 170 and name HG21) (segid " " and resid 126 and name HB1) 3.091 1.194 1.194 weight 1.000 ! spec=c13n...li-4, no=2131, id=2607, vol=3.308580e+01 or (segid " " and resid 170 and name HG22) (segid " " and resid 126 and name HB1) or (segid " " and resid 170 and name HG23) (segid " " and resid 126 and name HB1) assign (segid " " and resid 154 and name HB2) (segid " " and resid 154 and name HG2) 2.659 0.884 0.884 weight 1.000 ! spec=c13n...li-4, no=2135, id=2610, vol=8.156080e+01 assign (segid " " and resid 129 and name HB1) (segid " " and resid 170 and name HG21) 2.678 0.896 0.896 weight 1.000 ! spec=c13n...li-4, no=2137, id=2612, vol=7.817590e+01 or (segid " " and resid 129 and name HB1) (segid " " and resid 170 and name HG22) or (segid " " and resid 129 and name HB1) (segid " " and resid 170 and name HG23) assign (segid " " and resid 154 and name HG2) (segid " " and resid 139 and name HD12) 2.465 0.760 0.760 weight 1.000 ! spec=c13n...li-4, no=2144, id=2615, vol=1.285054e+02 or (segid " " and resid 154 and name HG2) (segid " " and resid 139 and name HD11) or (segid " " and resid 154 and name HG2) (segid " " and resid 139 and name HD13) assign (segid " " and resid 127 and name HD11) (segid " " and resid 170 and name HG21) 1.973 0.487 4.027 weight 1.000 ! spec=c13n...li-4, no=2147, id=2616, vol=4.884778e+02 assign (segid " " and resid 121 and name HG21) (segid " " and resid 143 and name HA) 2.742 0.940 3.258 weight 1.000 ! spec=c13n...li-4, no=2149, id=2618, vol=6.788890e+01 assign (segid " " and resid 121 and name HG21) (segid " " and resid 148 and name HA) 2.832 1.002 1.002 weight 1.000 ! spec=c13n...li-4, no=2150, id=2619, vol=5.591860e+01 assign (segid " " and resid 121 and name HG21) (segid " " and resid 121 and name HA) 1.868 0.436 4.132 weight 1.000 ! spec=c13n...li-4, no=2151, id=2620, vol=6.788531e+02 assign (segid " " and resid 140 and name HA) (segid " " and resid 121 and name HG21) 2.566 0.823 3.434 weight 1.000 ! spec=c13n...li-4, no=2152, id=2621, vol=1.011250e+02 assign (segid " " and resid 121 and name HG21) (segid " " and resid 121 and name HB) 1.909 0.456 4.091 weight 1.000 ! spec=c13n...li-4, no=2153, id=2622, vol=5.958102e+02 assign (segid " " and resid 143 and name HB2) (segid " " and resid 121 and name HG21) 2.669 0.891 0.891 weight 1.000 ! spec=c13n...li-4, no=2154, id=2623, vol=7.968580e+01 or (segid " " and resid 121 and name HG22) (segid " " and resid 143 and name HB2) or (segid " " and resid 121 and name HG23) (segid " " and resid 143 and name HB2) assign (segid " " and resid 143 and name HB1) (segid " " and resid 121 and name HG21) 2.544 0.809 0.809 weight 1.000 ! spec=c13n...li-4, no=2155, id=2624, vol=1.063939e+02 assign (segid " " and resid 121 and name HG21) (segid " " and resid 148 and name HE2) 2.259 0.638 0.638 weight 1.000 ! spec=c13n...li-4, no=2157, id=2626, vol=2.172095e+02 or (segid " " and resid 121 and name HG21) (segid " " and resid 148 and name HE1) or (segid " " and resid 121 and name HG21) (segid " " and resid 148 and name HE3) or (segid " " and resid 121 and name HG22) (segid " " and resid 148 and name HE2) or (segid " " and resid 121 and name HG22) (segid " " and resid 148 and name HE1) or (segid " " and resid 121 and name HG22) (segid " " and resid 148 and name HE3) or (segid " " and resid 121 and name HG23) (segid " " and resid 148 and name HE2) or (segid " " and resid 121 and name HG23) (segid " " and resid 148 and name HE1) or (segid " " and resid 121 and name HG23) (segid " " and resid 148 and name HE3) assign (segid " " and resid 154 and name HG2) (segid " " and resid 154 and name HD2) 2.822 0.995 0.995 weight 1.000 ! spec=c13n...li-4, no=2159, id=2628, vol=5.713330e+01 assign (segid " " and resid 120 and name HB2) (segid " " and resid 121 and name HG21) 2.554 0.815 3.446 weight 1.000 ! spec=c13n...li-4, no=2162, id=2631, vol=1.038719e+02 assign (segid " " and resid 154 and name HG2) (segid " " and resid 154 and name HD1) 2.885 1.040 1.040 weight 1.000 ! spec=c13n...li-4, no=2163, id=2632, vol=5.003520e+01 assign (segid " " and resid 154 and name HG2) (segid " " and resid 139 and name HD11) 2.447 0.748 0.748 weight 1.000 ! spec=c13n...li-4, no=2169, id=2634, vol=1.344265e+02 assign (segid " " and resid 121 and name HG21) (segid " " and resid 119 and name HG21) 2.189 0.599 3.811 weight 1.000 ! spec=c13n...li-4, no=2171, id=2635, vol=2.622332e+02 assign (segid " " and resid 106 and name HD22) (segid " " and resid 102 and name HB2) 2.060 0.531 0.531 weight 1.000 ! spec=c13n...li-4, no=2179, id=2639, vol=3.768460e+02 or (segid " " and resid 106 and name HD21) (segid " " and resid 102 and name HB2) or (segid " " and resid 106 and name HD23) (segid " " and resid 102 and name HB2) assign (segid " " and resid 106 and name HD21) (segid " " and resid 102 and name HB1) 2.971 1.104 1.104 weight 1.000 ! spec=c13n...li-4, no=2180, id=2640, vol=4.189230e+01 assign (segid " " and resid 106 and name HB1) (segid " " and resid 106 and name HD21) 2.294 0.658 0.658 weight 1.000 ! spec=c13n...li-4, no=2181, id=2641, vol=1.980924e+02 assign (segid " " and resid 110 and name HD21) (segid " " and resid 187 and name HD11) 2.584 0.835 3.416 weight 1.000 ! spec=c13n...li-4, no=2183, id=2642, vol=9.681610e+01 assign (segid " " and resid 106 and name HD22) (segid " " and resid 106 and name HD12) 1.882 0.443 0.443 weight 1.000 ! spec=c13n...li-4, no=2185, id=2643, vol=6.488910e+02 or (segid " " and resid 106 and name HD22) (segid " " and resid 106 and name HD11) or (segid " " and resid 106 and name HD22) (segid " " and resid 106 and name HD13) or (segid " " and resid 106 and name HD21) (segid " " and resid 106 and name HD12) or (segid " " and resid 106 and name HD11) (segid " " and resid 106 and name HD21) or (segid " " and resid 106 and name HD21) (segid " " and resid 106 and name HD13) or (segid " " and resid 106 and name HD23) (segid " " and resid 106 and name HD12) or (segid " " and resid 106 and name HD23) (segid " " and resid 106 and name HD11) or (segid " " and resid 106 and name HD23) (segid " " and resid 106 and name HD13) assign (segid " " and resid 100 and name HD12) (segid " " and resid 163 and name HA) 2.563 0.821 0.821 weight 1.000 ! spec=c13n...li-4, no=2190, id=2647, vol=1.017218e+02 or (segid " " and resid 100 and name HD11) (segid " " and resid 163 and name HA) or (segid " " and resid 100 and name HD13) (segid " " and resid 163 and name HA) assign (segid " " and resid 173 and name HA) (segid " " and resid 173 and name HD11) 2.655 0.881 3.345 weight 1.000 ! spec=c13n...li-4, no=2193, id=2649, vol=8.230660e+01 assign (segid " " and resid 160 and name HD12) (segid " " and resid 104 and name HA) 2.291 0.656 0.656 weight 1.000 ! spec=c13n...li-4, no=2194, id=2650, vol=1.994854e+02 or (segid " " and resid 104 and name HA) (segid " " and resid 160 and name HD11) or (segid " " and resid 160 and name HD13) (segid " " and resid 104 and name HA) assign (segid " " and resid 105 and name HA) (segid " " and resid 105 and name HD11) 2.928 1.071 1.071 weight 1.000 ! spec=c13n...li-4, no=2196, id=2652, vol=4.580150e+01 assign (segid " " and resid 102 and name HA) (segid " " and resid 105 and name HD11) 2.269 0.643 3.731 weight 1.000 ! spec=c13n...li-4, no=2200, id=2655, vol=2.113670e+02 assign (segid " " and resid 160 and name HD12) (segid " " and resid 160 and name HA) 2.124 0.564 0.564 weight 1.000 ! spec=c13n...li-4, no=2201, id=2656, vol=3.141857e+02 or (segid " " and resid 160 and name HA) (segid " " and resid 160 and name HD11) or (segid " " and resid 160 and name HD13) (segid " " and resid 160 and name HA) assign (segid " " and resid 109 and name HB2) (segid " " and resid 105 and name HD11) 2.936 1.077 1.077 weight 1.000 ! spec=c13n...li-4, no=2206, id=2660, vol=4.504650e+01 assign (segid " " and resid 107 and name HB2) (segid " " and resid 160 and name HD11) 2.303 0.663 0.663 weight 1.000 ! spec=c13n...li-4, no=2207, id=2661, vol=1.931315e+02 assign (segid " " and resid 109 and name HB1) (segid " " and resid 105 and name HD11) 2.452 0.752 3.548 weight 1.000 ! spec=c13n...li-4, no=2208, id=2662, vol=1.325775e+02 assign (segid " " and resid 105 and name HD21) (segid " " and resid 101 and name HB2) 2.928 1.072 3.072 weight 1.000 ! spec=c13n...li-4, no=2209, id=2663, vol=4.577690e+01 assign (segid " " and resid 160 and name HD11) (segid " " and resid 107 and name HB1) 2.293 0.657 0.657 weight 1.000 ! spec=c13n...li-4, no=2211, id=2665, vol=1.981723e+02 assign (segid " " and resid 105 and name HD21) (segid " " and resid 101 and name HB1) 2.839 1.007 1.007 weight 1.000 ! spec=c13n...li-4, no=2214, id=2668, vol=5.507230e+01 assign (segid " " and resid 105 and name HB2) (segid " " and resid 105 and name HD21) 1.860 0.432 0.432 weight 1.000 ! spec=c13n...li-4, no=2215, id=2669, vol=6.963864e+02 assign (segid " " and resid 160 and name HB1) (segid " " and resid 160 and name HD11) 2.316 0.671 3.684 weight 1.000 ! spec=c13n...li-4, no=2218, id=2672, vol=1.866011e+02 assign (segid " " and resid 160 and name HD21) (segid " " and resid 160 and name HD11) 1.914 0.458 0.458 weight 1.000 ! spec=c13n...li-4, no=2224, id=2676, vol=5.862966e+02 assign (segid " " and resid 107 and name HD11) (segid " " and resid 160 and name HD11) 2.251 0.633 3.749 weight 1.000 ! spec=c13n...li-4, no=2227, id=2678, vol=2.217798e+02 assign (segid " " and resid 100 and name HD21) (segid " " and resid 103 and name HD1) 2.847 1.013 3.153 weight 1.000 ! spec=c13n...li-4, no=2229, id=2680, vol=5.411740e+01 assign (segid " " and resid 100 and name HD21) (segid " " and resid 97 and name HA) 2.850 1.015 1.015 weight 1.000 ! spec=c13n...li-4, no=2233, id=2683, vol=5.380890e+01 assign (segid " " and resid 100 and name HD21) (segid " " and resid 165 and name HA) 2.231 0.622 3.769 weight 1.000 ! spec=c13n...li-4, no=2234, id=2684, vol=2.341401e+02 assign (segid " " and resid 136 and name HA) (segid " " and resid 127 and name HD22) 1.973 0.486 0.486 weight 1.000 ! spec=c13n...li-4, no=2236, id=2686, vol=4.892897e+02 or (segid " " and resid 136 and name HA) (segid " " and resid 127 and name HD21) or (segid " " and resid 136 and name HA) (segid " " and resid 127 and name HD23) assign (segid " " and resid 100 and name HD21) (segid " " and resid 168 and name HD1) 2.613 0.853 3.387 weight 1.000 ! spec=c13n...li-4, no=2238, id=2688, vol=9.059410e+01 assign (segid " " and resid 100 and name HD21) (segid " " and resid 165 and name HG2) 3.890 1.044 2.044 weight 1.000 ! spec=c13n...li-4, no=2239, id=2689, vol=4.950520e+01 assign (segid " " and resid 140 and name HB2) (segid " " and resid 140 and name HD11) 2.092 0.547 0.547 weight 1.000 ! spec=c13n...li-4, no=2240, id=2690, vol=3.440720e+02 assign (segid " " and resid 140 and name HD11) (segid " " and resid 140 and name HG) 1.985 0.493 0.493 weight 1.000 ! spec=c13n...li-4, no=2241, id=2691, vol=4.707072e+02 assign (segid " " and resid 127 and name HD21) (segid " " and resid 139 and name HG12) 2.799 0.980 0.980 weight 1.000 ! spec=c13n...li-4, no=2248, id=2696, vol=5.992050e+01 assign (segid " " and resid 100 and name HD22) (segid " " and resid 168 and name HG2) 2.942 1.082 1.082 weight 1.000 ! spec=c13n...li-4, no=2253, id=2697, vol=4.446870e+01 or (segid " " and resid 100 and name HD21) (segid " " and resid 168 and name HG2) or (segid " " and resid 100 and name HD23) (segid " " and resid 168 and name HG2) assign (segid " " and resid 171 and name HA) (segid " " and resid 171 and name HD21) 2.089 0.545 0.545 weight 1.000 ! spec=c13n...li-4, no=2257, id=2701, vol=3.473654e+02 assign (segid " " and resid 127 and name HD21) (segid " " and resid 158 and name HB2) 2.823 0.996 3.177 weight 1.000 ! spec=c13n...li-4, no=2258, id=2702, vol=5.699360e+01 assign (segid " " and resid 171 and name HD22) (segid " " and resid 175 and name HB2) 2.592 0.840 3.408 weight 1.000 ! spec=c13n...li-4, no=2260, id=2704, vol=9.502370e+01 or (segid " " and resid 171 and name HD21) (segid " " and resid 175 and name HB2) or (segid " " and resid 171 and name HD23) (segid " " and resid 175 and name HB2) assign (segid " " and resid 171 and name HD22) (segid " " and resid 171 and name HD12) 2.030 0.515 0.515 weight 1.000 ! spec=c13n...li-4, no=2266, id=2709, vol=4.124559e+02 or (segid " " and resid 171 and name HD22) (segid " " and resid 171 and name HD11) or (segid " " and resid 171 and name HD22) (segid " " and resid 171 and name HD13) or (segid " " and resid 171 and name HD21) (segid " " and resid 171 and name HD12) or (segid " " and resid 171 and name HD21) (segid " " and resid 171 and name HD11) or (segid " " and resid 171 and name HD21) (segid " " and resid 171 and name HD13) or (segid " " and resid 171 and name HD23) (segid " " and resid 171 and name HD12) or (segid " " and resid 171 and name HD23) (segid " " and resid 171 and name HD11) or (segid " " and resid 171 and name HD23) (segid " " and resid 171 and name HD13) assign (segid " " and resid 171 and name HD21) (segid " " and resid 118 and name HD11) 2.869 1.029 1.029 weight 1.000 ! spec=c13n...li-4, no=2267, id=2710, vol=5.175670e+01 assign (segid " " and resid 136 and name HA) (segid " " and resid 131 and name HD21) 2.601 0.845 3.399 weight 1.000 ! spec=c13n...li-4, no=2269, id=2712, vol=9.322900e+01 assign (segid " " and resid 131 and name HD21) (segid " " and resid 159 and name HA) 2.692 0.906 0.906 weight 1.000 ! spec=c13n...li-4, no=2270, id=2713, vol=7.572180e+01 assign (segid " " and resid 158 and name HB2) (segid " " and resid 131 and name HD21) 2.383 0.710 0.710 weight 1.000 ! spec=c13n...li-4, no=2271, id=2714, vol=1.574978e+02 assign (segid " " and resid 158 and name HB1) (segid " " and resid 131 and name HD21) 2.298 0.660 0.660 weight 1.000 ! spec=c13n...li-4, no=2272, id=2715, vol=1.959991e+02 assign (segid " " and resid 135 and name HB2) (segid " " and resid 131 and name HD21) 2.858 1.021 1.021 weight 1.000 ! spec=c13n...li-4, no=2273, id=2716, vol=5.286850e+01 assign (segid " " and resid 131 and name HD22) (segid " " and resid 131 and name HB1) 2.422 0.734 0.734 weight 1.000 ! spec=c13n...li-4, no=2275, id=2718, vol=1.426772e+02 or (segid " " and resid 131 and name HD21) (segid " " and resid 131 and name HB1) or (segid " " and resid 131 and name HD23) (segid " " and resid 131 and name HB1) assign (segid " " and resid 131 and name HD21) (segid " " and resid 127 and name HD21) 3.016 1.508 1.508 weight 1.000 ! spec=c13n...li-4, no=2277, id=2720, vol=4.299258e+02 assign (segid " " and resid 159 and name HD11) (segid " " and resid 131 and name HD21) 2.063 0.532 0.532 weight 1.000 ! spec=c13n...li-4, no=2279, id=2721, vol=3.742162e+02 assign (segid " " and resid 108 and name HA) (segid " " and resid 156 and name HG21) 2.736 0.936 3.264 weight 1.000 ! spec=c13n...li-4, no=2282, id=2724, vol=6.871830e+01 assign (segid " " and resid 156 and name HG22) (segid " " and resid 156 and name HA) 2.251 0.633 3.749 weight 1.000 ! spec=c13n...li-4, no=2284, id=2726, vol=2.216008e+02 or (segid " " and resid 156 and name HA) (segid " " and resid 156 and name HG21) or (segid " " and resid 156 and name HG23) (segid " " and resid 156 and name HA) assign (segid " " and resid 156 and name HG21) (segid " " and resid 157 and name HG2) 2.391 0.714 0.714 weight 1.000 ! spec=c13n...li-4, no=2286, id=2728, vol=1.545063e+02 assign (segid " " and resid 156 and name HG21) (segid " " and resid 107 and name HG) 3.744 1.941 3.256 weight 1.000 ! spec=c13n...li-4, no=2288, id=2730, vol=6.759410e+01 assign (segid " " and resid 156 and name HG21) (segid " " and resid 160 and name HD21) 2.510 0.787 3.490 weight 1.000 ! spec=c13n...li-4, no=2290, id=2731, vol=1.154047e+02 assign (segid " " and resid 156 and name HG22) (segid " " and resid 156 and name HG12) 1.964 0.482 0.482 weight 1.000 ! spec=c13n...li-4, no=2292, id=2733, vol=5.028666e+02 or (segid " " and resid 156 and name HG22) (segid " " and resid 156 and name HG11) or (segid " " and resid 156 and name HG22) (segid " " and resid 156 and name HG13) or (segid " " and resid 156 and name HG21) (segid " " and resid 156 and name HG12) or (segid " " and resid 156 and name HG21) (segid " " and resid 156 and name HG11) or (segid " " and resid 156 and name HG21) (segid " " and resid 156 and name HG13) or (segid " " and resid 156 and name HG23) (segid " " and resid 156 and name HG12) or (segid " " and resid 156 and name HG23) (segid " " and resid 156 and name HG11) or (segid " " and resid 156 and name HG23) (segid " " and resid 156 and name HG13) assign (segid " " and resid 171 and name HD11) (segid " " and resid 167 and name HE3) 2.654 0.880 0.880 weight 1.000 ! spec=c13n...li-4, no=2295, id=2735, vol=8.257300e+01 assign (segid " " and resid 171 and name HD11) (segid " " and resid 186 and name HZ2) 2.715 0.921 0.921 weight 1.000 ! spec=c13n...li-4, no=2296, id=2736, vol=7.197360e+01 assign (segid " " and resid 171 and name HD12) (segid " " and resid 171 and name HB1) 2.405 0.723 0.723 weight 1.000 ! spec=c13n...li-4, no=2302, id=2742, vol=1.489382e+02 or (segid " " and resid 171 and name HB1) (segid " " and resid 171 and name HD11) or (segid " " and resid 171 and name HD13) (segid " " and resid 171 and name HB1) assign (segid " " and resid 171 and name HG) (segid " " and resid 171 and name HD12) 2.217 0.614 0.614 weight 1.000 ! spec=c13n...li-4, no=2303, id=2743, vol=2.430671e+02 or (segid " " and resid 171 and name HG) (segid " " and resid 171 and name HD11) or (segid " " and resid 171 and name HG) (segid " " and resid 171 and name HD13) assign (segid " " and resid 171 and name HD11) (segid " " and resid 159 and name HB2) 3.058 1.169 2.942 weight 1.000 ! spec=c13n...li-4, no=2304, id=2744, vol=3.525250e+01 assign (segid " " and resid 171 and name HD11) (segid " " and resid 168 and name HB2) 2.978 1.108 1.108 weight 1.000 ! spec=c13n...li-4, no=2305, id=2745, vol=4.137060e+01 assign (segid " " and resid 175 and name HD12) (segid " " and resid 171 and name HD12) 2.512 0.789 3.488 weight 1.000 ! spec=c13n...li-4, no=2306, id=2746, vol=1.146812e+02 or (segid " " and resid 175 and name HD12) (segid " " and resid 171 and name HD11) or (segid " " and resid 175 and name HD12) (segid " " and resid 171 and name HD13) or (segid " " and resid 175 and name HD11) (segid " " and resid 171 and name HD12) or (segid " " and resid 175 and name HD11) (segid " " and resid 171 and name HD11) or (segid " " and resid 175 and name HD11) (segid " " and resid 171 and name HD13) or (segid " " and resid 175 and name HD13) (segid " " and resid 171 and name HD12) or (segid " " and resid 175 and name HD13) (segid " " and resid 171 and name HD11) or (segid " " and resid 175 and name HD13) (segid " " and resid 171 and name HD13) assign (segid " " and resid 171 and name HD21) (segid " " and resid 171 and name HD11) 1.965 0.483 4.035 weight 1.000 ! spec=c13n...li-4, no=2307, id=2747, vol=5.002876e+02 assign (segid " " and resid 159 and name HD21) (segid " " and resid 171 and name HD11) 2.142 0.574 0.574 weight 1.000 ! spec=c13n...li-4, no=2309, id=2748, vol=2.981444e+02 assign (segid " " and resid 171 and name HD11) (segid " " and resid 107 and name HD11) 2.475 0.766 3.525 weight 1.000 ! spec=c13n...li-4, no=2310, id=2749, vol=1.254855e+02 assign (segid " " and resid 116 and name HB) (segid " " and resid 116 and name HG21) 1.708 0.365 0.365 weight 1.000 ! spec=c13n...li-4, no=2313, id=2751, vol=1.159356e+03 or (segid " " and resid 116 and name HG22) (segid " " and resid 116 and name HB) or (segid " " and resid 116 and name HG23) (segid " " and resid 116 and name HB) assign (segid " " and resid 116 and name HG21) (segid " " and resid 115 and name HE2) 2.765 0.956 0.956 weight 1.000 ! spec=c13n...li-4, no=2314, id=2752, vol=6.452480e+01 assign (segid " " and resid 116 and name HG21) (segid " " and resid 117 and name HG2) 2.553 0.815 3.447 weight 1.000 ! spec=c13n...li-4, no=2316, id=2754, vol=1.040286e+02 assign (segid " " and resid 116 and name HG21) (segid " " and resid 115 and name HB2) 2.533 0.802 3.467 weight 1.000 ! spec=c13n...li-4, no=2317, id=2755, vol=1.092435e+02 assign (segid " " and resid 116 and name HG21) (segid " " and resid 115 and name HD2) 2.387 0.712 0.712 weight 1.000 ! spec=c13n...li-4, no=2318, id=2756, vol=1.558703e+02 or (segid " " and resid 116 and name HG22) (segid " " and resid 115 and name HD2) or (segid " " and resid 116 and name HG23) (segid " " and resid 115 and name HD2) assign (segid " " and resid 116 and name HG21) (segid " " and resid 115 and name HG2) 2.175 0.591 3.825 weight 1.000 ! spec=c13n...li-4, no=2320, id=2758, vol=2.727121e+02 assign (segid " " and resid 145 and name HA) (segid " " and resid 145 and name HG21) 1.876 0.440 0.440 weight 1.000 ! spec=c13n...li-4, no=2321, id=2759, vol=6.619915e+02 or (segid " " and resid 145 and name HG22) (segid " " and resid 145 and name HA) or (segid " " and resid 145 and name HG23) (segid " " and resid 145 and name HA) assign (segid " " and resid 145 and name HB) (segid " " and resid 145 and name HG21) 1.796 0.403 0.403 weight 1.000 ! spec=c13n...li-4, no=2322, id=2760, vol=8.594900e+02 or (segid " " and resid 145 and name HG22) (segid " " and resid 145 and name HB) or (segid " " and resid 145 and name HG23) (segid " " and resid 145 and name HB) assign (segid " " and resid 144 and name HB2) (segid " " and resid 145 and name HG21) 2.408 0.725 0.725 weight 1.000 ! spec=c13n...li-4, no=2323, id=2761, vol=1.479991e+02 or (segid " " and resid 144 and name HB2) (segid " " and resid 145 and name HG22) or (segid " " and resid 144 and name HB2) (segid " " and resid 145 and name HG23) assign (segid " " and resid 121 and name HG21) (segid " " and resid 120 and name HG2) 2.863 1.024 3.137 weight 1.000 ! spec=c13n...li-4, no=2327, id=2765, vol=5.239500e+01 assign (segid " " and resid 116 and name HG21) (segid " " and resid 112 and name HB1) 2.872 1.031 3.128 weight 1.000 ! spec=c13n...li-4, no=2328, id=2766, vol=5.138880e+01 assign (segid " " and resid 110 and name HD21) (segid " " and resid 186 and name HE3) 2.917 1.064 1.064 weight 1.000 ! spec=c13n...li-4, no=2331, id=2767, vol=4.676760e+01 assign (segid " " and resid 113 and name HG2) (segid " " and resid 110 and name HD21) 2.622 0.859 3.378 weight 1.000 ! spec=c13n...li-4, no=2334, id=2770, vol=8.873180e+01 assign (segid " " and resid 110 and name HB2) (segid " " and resid 110 and name HD21) 2.227 0.620 3.773 weight 1.000 ! spec=c13n...li-4, no=2335, id=2771, vol=2.365157e+02 assign (segid " " and resid 110 and name HD21) (segid " " and resid 185 and name HB2) 2.537 0.804 3.463 weight 1.000 ! spec=c13n...li-4, no=2337, id=2773, vol=1.082273e+02 assign (segid " " and resid 124 and name HA) (segid " " and resid 127 and name HD22) 2.300 0.661 0.661 weight 1.000 ! spec=c13n...li-4, no=2344, id=2774, vol=1.948214e+02 or (segid " " and resid 124 and name HA) (segid " " and resid 127 and name HD21) or (segid " " and resid 124 and name HA) (segid " " and resid 127 and name HD23) assign (segid " " and resid 127 and name HD21) (segid " " and resid 139 and name HB) 2.202 0.606 3.798 weight 1.000 ! spec=c13n...li-4, no=2345, id=2775, vol=2.528320e+02 assign (segid " " and resid 127 and name HD22) (segid " " and resid 127 and name HB1) 1.998 0.499 0.499 weight 1.000 ! spec=c13n...li-4, no=2346, id=2776, vol=4.533970e+02 or (segid " " and resid 127 and name HD21) (segid " " and resid 127 and name HB1) or (segid " " and resid 127 and name HD23) (segid " " and resid 127 and name HB1) assign (segid " " and resid 171 and name HG) (segid " " and resid 171 and name HD22) 1.955 0.478 0.478 weight 1.000 ! spec=c13n...li-4, no=2347, id=2777, vol=5.161158e+02 or (segid " " and resid 171 and name HG) (segid " " and resid 171 and name HD21) or (segid " " and resid 171 and name HG) (segid " " and resid 171 and name HD23) assign (segid " " and resid 175 and name HD22) (segid " " and resid 180 and name HA) 2.993 1.120 1.120 weight 1.000 ! spec=c13n...li-4, no=2352, id=2780, vol=4.007820e+01 or (segid " " and resid 175 and name HD21) (segid " " and resid 180 and name HA) or (segid " " and resid 175 and name HD23) (segid " " and resid 180 and name HA) assign (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HD21) 2.121 0.562 0.562 weight 1.000 ! spec=c13n...li-4, no=2356, id=2784, vol=3.167468e+02 assign (segid " " and resid 182 and name HB2) (segid " " and resid 175 and name HD22) 2.907 1.057 1.057 weight 1.000 ! spec=c13n...li-4, no=2357, id=2785, vol=4.773340e+01 or (segid " " and resid 182 and name HB2) (segid " " and resid 175 and name HD21) or (segid " " and resid 182 and name HB2) (segid " " and resid 175 and name HD23) assign (segid " " and resid 182 and name HB1) (segid " " and resid 175 and name HD22) 2.366 0.700 0.700 weight 1.000 ! spec=c13n...li-4, no=2358, id=2786, vol=1.641997e+02 or (segid " " and resid 182 and name HB1) (segid " " and resid 175 and name HD21) or (segid " " and resid 182 and name HB1) (segid " " and resid 175 and name HD23) assign (segid " " and resid 175 and name HD21) (segid " " and resid 175 and name HG) 2.212 0.611 0.611 weight 1.000 ! spec=c13n...li-4, no=2360, id=2788, vol=2.464047e+02 assign (segid " " and resid 184 and name HG2) (segid " " and resid 185 and name HD21) 2.913 1.061 1.061 weight 1.000 ! spec=c13n...li-4, no=2361, id=2789, vol=4.716190e+01 assign (segid " " and resid 184 and name HB2) (segid " " and resid 185 and name HD21) 2.939 1.080 1.080 weight 1.000 ! spec=c13n...li-4, no=2363, id=2790, vol=4.472210e+01 assign (segid " " and resid 171 and name HB1) (segid " " and resid 123 and name HG11) 4.038 2.519 1.519 weight 1.000 ! spec=c13n...li-4, no=2365, id=2791, vol=4.025786e+02 assign (segid " " and resid 185 and name HG) (segid " " and resid 185 and name HD21) 1.948 0.474 0.474 weight 1.000 ! spec=c13n...li-4, no=2366, id=2792, vol=5.273701e+02 assign (segid " " and resid 171 and name HD21) (segid " " and resid 123 and name HG12) 2.059 0.530 3.941 weight 1.000 ! spec=c13n...li-4, no=2367, id=2793, vol=3.783980e+02 assign (segid " " and resid 185 and name HD21) (segid " " and resid 185 and name HB1) 2.357 0.694 3.643 weight 1.000 ! spec=c13n...li-4, no=2368, id=2794, vol=1.682200e+02 assign (segid " " and resid 175 and name HD22) (segid " " and resid 118 and name HD12) 2.155 0.580 0.580 weight 1.000 ! spec=c13n...li-4, no=2374, id=2798, vol=2.880918e+02 or (segid " " and resid 175 and name HD22) (segid " " and resid 118 and name HD11) or (segid " " and resid 175 and name HD22) (segid " " and resid 118 and name HD13) or (segid " " and resid 175 and name HD21) (segid " " and resid 118 and name HD12) or (segid " " and resid 175 and name HD21) (segid " " and resid 118 and name HD11) or (segid " " and resid 175 and name HD21) (segid " " and resid 118 and name HD13) or (segid " " and resid 175 and name HD23) (segid " " and resid 118 and name HD12) or (segid " " and resid 175 and name HD23) (segid " " and resid 118 and name HD11) or (segid " " and resid 175 and name HD23) (segid " " and resid 118 and name HD13) assign (segid " " and resid 175 and name HD22) (segid " " and resid 175 and name HB2) 2.663 0.887 0.887 weight 1.000 ! spec=c13n...li-4, no=2375, id=2799, vol=8.076240e+01 or (segid " " and resid 175 and name HB2) (segid " " and resid 175 and name HD21) or (segid " " and resid 175 and name HD23) (segid " " and resid 175 and name HB2) assign (segid " " and resid 188 and name HG12) (segid " " and resid 186 and name HB2) 2.864 1.026 1.026 weight 1.000 ! spec=c13n...li-4, no=2378, id=2801, vol=5.219660e+01 or (segid " " and resid 188 and name HG11) (segid " " and resid 186 and name HB2) or (segid " " and resid 188 and name HG13) (segid " " and resid 186 and name HB2) assign (segid " " and resid 188 and name HG11) (segid " " and resid 168 and name HG2) 2.456 0.754 3.544 weight 1.000 ! spec=c13n...li-4, no=2383, id=2804, vol=1.314317e+02 assign (segid " " and resid 107 and name HD21) (segid " " and resid 186 and name HZ3) 2.850 1.015 1.015 weight 1.000 ! spec=c13n...li-4, no=2385, id=2806, vol=5.380770e+01 assign (segid " " and resid 107 and name HD21) (segid " " and resid 114 and name HE1) 2.871 1.031 3.129 weight 1.000 ! spec=c13n...li-4, no=2386, id=2807, vol=5.145510e+01 assign (segid " " and resid 188 and name HG11) (segid " " and resid 169 and name HE2) 2.681 0.898 3.319 weight 1.000 ! spec=c13n...li-4, no=2389, id=2810, vol=7.767340e+01 assign (segid " " and resid 107 and name HB2) (segid " " and resid 107 and name HD21) 2.417 0.730 3.583 weight 1.000 ! spec=c13n...li-4, no=2391, id=2811, vol=1.447026e+02 assign (segid " " and resid 107 and name HB1) (segid " " and resid 107 and name HD21) 2.433 0.740 0.740 weight 1.000 ! spec=c13n...li-4, no=2392, id=2812, vol=1.388860e+02 assign (segid " " and resid 107 and name HD21) (segid " " and resid 107 and name HG) 2.234 0.624 3.766 weight 1.000 ! spec=c13n...li-4, no=2394, id=2814, vol=2.319273e+02 assign (segid " " and resid 107 and name HD21) (segid " " and resid 159 and name HB2) 2.941 1.081 3.059 weight 1.000 ! spec=c13n...li-4, no=2395, id=2815, vol=4.456190e+01 assign (segid " " and resid 160 and name HD21) (segid " " and resid 107 and name HD21) 2.825 0.998 3.175 weight 1.000 ! spec=c13n...li-4, no=2396, id=2816, vol=5.668780e+01 assign (segid " " and resid 107 and name HD21) (segid " " and resid 160 and name HD11) 2.469 0.762 3.531 weight 1.000 ! spec=c13n...li-4, no=2398, id=2817, vol=1.273980e+02 assign (segid " " and resid 126 and name HB2) (segid " " and resid 174 and name HB2) 2.359 0.695 0.695 weight 1.000 ! spec=c13n...li-4, no=2405, id=2821, vol=1.674194e+02 or (segid " " and resid 126 and name HB2) (segid " " and resid 174 and name HB1) or (segid " " and resid 126 and name HB2) (segid " " and resid 174 and name HB3) assign (segid " " and resid 174 and name HB1) (segid " " and resid 127 and name HB1) 2.332 0.680 3.668 weight 1.000 ! spec=c13n...li-4, no=2408, id=2824, vol=1.791835e+02 assign (segid " " and resid 108 and name HA) (segid " " and resid 156 and name HG11) 2.694 0.907 3.306 weight 1.000 ! spec=c13n...li-4, no=2413, id=2827, vol=7.538510e+01 assign (segid " " and resid 153 and name HA) (segid " " and resid 156 and name HG11) 2.680 0.898 3.320 weight 1.000 ! spec=c13n...li-4, no=2414, id=2828, vol=7.783700e+01 assign (segid " " and resid 157 and name HA) (segid " " and resid 156 and name HG12) 2.651 0.879 0.879 weight 1.000 ! spec=c13n...li-4, no=2415, id=2829, vol=8.303130e+01 or (segid " " and resid 157 and name HA) (segid " " and resid 156 and name HG11) or (segid " " and resid 157 and name HA) (segid " " and resid 156 and name HG13) assign (segid " " and resid 156 and name HG11) (segid " " and resid 157 and name HB2) 2.737 0.936 3.263 weight 1.000 ! spec=c13n...li-4, no=2417, id=2831, vol=6.864510e+01 assign (segid " " and resid 156 and name HG12) (segid " " and resid 157 and name HG2) 2.316 0.671 3.684 weight 1.000 ! spec=c13n...li-4, no=2418, id=2832, vol=1.867927e+02 or (segid " " and resid 156 and name HG11) (segid " " and resid 157 and name HG2) or (segid " " and resid 156 and name HG13) (segid " " and resid 157 and name HG2) assign (segid " " and resid 156 and name HG11) (segid " " and resid 155 and name HB1) 2.388 0.713 3.612 weight 1.000 ! spec=c13n...li-4, no=2420, id=2834, vol=1.554810e+02 assign (segid " " and resid 160 and name HD11) (segid " " and resid 156 and name HG11) 2.537 0.805 0.805 weight 1.000 ! spec=c13n...li-4, no=2421, id=2835, vol=1.081308e+02 assign (segid " " and resid 156 and name HG11) (segid " " and resid 107 and name HG) 4.301 2.662 1.662 weight 1.000 ! spec=c13n...li-4, no=2422, id=2836, vol=1.941600e+02 assign (segid " " and resid 156 and name HG11) (segid " " and resid 160 and name HD21) 2.043 0.522 0.522 weight 1.000 ! spec=c13n...li-4, no=2423, id=2837, vol=3.965999e+02 assign (segid " " and resid 156 and name HG21) (segid " " and resid 156 and name HG11) 2.922 1.462 1.462 weight 1.000 ! spec=c13n...li-4, no=2425, id=2838, vol=5.714654e+02 assign (segid " " and resid 156 and name HG11) (segid " " and resid 107 and name HD21) 2.296 0.659 3.704 weight 1.000 ! spec=c13n...li-4, no=2426, id=2839, vol=1.965749e+02 assign (segid " " and resid 188 and name HG21) (segid " " and resid 186 and name HD1) 2.725 0.928 3.275 weight 1.000 ! spec=c13n...li-4, no=2428, id=2840, vol=7.042670e+01 assign (segid " " and resid 172 and name HB1) (segid " " and resid 188 and name HG12) 2.708 0.917 0.917 weight 1.000 ! spec=c13n...li-4, no=2433, id=2845, vol=7.309460e+01 or (segid " " and resid 172 and name HB1) (segid " " and resid 188 and name HG11) or (segid " " and resid 172 and name HB1) (segid " " and resid 188 and name HG13) assign (segid " " and resid 188 and name HB) (segid " " and resid 188 and name HG12) 2.088 0.545 0.545 weight 1.000 ! spec=c13n...li-4, no=2435, id=2847, vol=3.484275e+02 or (segid " " and resid 188 and name HB) (segid " " and resid 188 and name HG11) or (segid " " and resid 188 and name HB) (segid " " and resid 188 and name HG13) assign (segid " " and resid 188 and name HG11) (segid " " and resid 171 and name HB1) 2.719 0.924 3.281 weight 1.000 ! spec=c13n...li-4, no=2436, id=2848, vol=7.129800e+01 assign (segid " " and resid 188 and name HG22) (segid " " and resid 172 and name HG2) 3.089 1.192 1.192 weight 1.000 ! spec=c13n...li-4, no=2437, id=2849, vol=3.320990e+01 or (segid " " and resid 188 and name HG21) (segid " " and resid 172 and name HG2) or (segid " " and resid 188 and name HG23) (segid " " and resid 172 and name HG2) assign (segid " " and resid 188 and name HG11) (segid " " and resid 168 and name HB1) 2.220 0.616 0.616 weight 1.000 ! spec=c13n...li-4, no=2439, id=2850, vol=2.407600e+02 assign (segid " " and resid 148 and name HE1) (segid " " and resid 143 and name HA) 2.733 0.933 0.933 weight 1.000 ! spec=c13n...li-4, no=2442, id=2851, vol=6.926260e+01 assign (segid " " and resid 148 and name HE1) (segid " " and resid 148 and name HA) 2.639 0.871 0.871 weight 1.000 ! spec=c13n...li-4, no=2443, id=2852, vol=8.532790e+01 assign (segid " " and resid 143 and name HB2) (segid " " and resid 148 and name HE2) 2.646 0.875 0.875 weight 1.000 ! spec=c13n...li-4, no=2445, id=2854, vol=8.406750e+01 or (segid " " and resid 143 and name HB2) (segid " " and resid 148 and name HE1) or (segid " " and resid 143 and name HB2) (segid " " and resid 148 and name HE3) assign (segid " " and resid 148 and name HG2) (segid " " and resid 148 and name HE1) 1.946 0.473 4.054 weight 1.000 ! spec=c13n...li-4, no=2446, id=2855, vol=5.315130e+02 assign (segid " " and resid 149 and name HE1) (segid " " and resid 115 and name HE2) 2.370 0.702 3.630 weight 1.000 ! spec=c13n...li-4, no=2448, id=2857, vol=1.628644e+02 assign (segid " " and resid 149 and name HE1) (segid " " and resid 149 and name HG2) 2.208 0.610 3.792 weight 1.000 ! spec=c13n...li-4, no=2450, id=2859, vol=2.486601e+02 assign (segid " " and resid 149 and name HG1) (segid " " and resid 149 and name HE1) 2.165 0.586 0.586 weight 1.000 ! spec=c13n...li-4, no=2451, id=2860, vol=2.801594e+02 assign (segid " " and resid 121 and name HG21) (segid " " and resid 148 and name HE1) 1.983 0.492 4.017 weight 1.000 ! spec=c13n...li-4, no=2456, id=2861, vol=4.741887e+02 assign (segid " " and resid 116 and name HG21) (segid " " and resid 149 and name HE1) 2.153 0.579 3.847 weight 1.000 ! spec=c13n...li-4, no=2459, id=2864, vol=2.897419e+02 assign (segid " " and resid 148 and name HE1) (segid " " and resid 119 and name HG21) 2.005 0.502 0.502 weight 1.000 ! spec=c13n...li-4, no=2460, id=2865, vol=4.438640e+02 assign (segid " " and resid 148 and name HE1) (segid " " and resid 119 and name HD11) 2.526 0.797 3.474 weight 1.000 ! spec=c13n...li-4, no=2461, id=2866, vol=1.110791e+02 assign (segid " " and resid 152 and name HB1) (segid " " and resid 114 and name HE1) 2.495 0.778 3.505 weight 1.000 ! spec=c13n...li-4, no=2462, id=2867, vol=1.195896e+02 assign (segid " " and resid 152 and name HB1) (segid " " and resid 114 and name HD1) 2.465 0.759 3.535 weight 1.000 ! spec=c13n...li-4, no=2463, id=2868, vol=1.285726e+02 assign (segid " " and resid 152 and name HB1) (segid " " and resid 119 and name HA) 2.937 1.078 3.063 weight 1.000 ! spec=c13n...li-4, no=2464, id=2869, vol=4.490660e+01 assign (segid " " and resid 120 and name HD2) (segid " " and resid 152 and name HB1) 2.777 0.964 0.964 weight 1.000 ! spec=c13n...li-4, no=2467, id=2871, vol=6.289970e+01 assign (segid " " and resid 152 and name HB1) (segid " " and resid 118 and name HA) 2.976 1.107 3.024 weight 1.000 ! spec=c13n...li-4, no=2469, id=2873, vol=4.153580e+01 assign (segid " " and resid 152 and name HB1) (segid " " and resid 149 and name HB2) 2.841 1.009 3.159 weight 1.000 ! spec=c13n...li-4, no=2470, id=2874, vol=5.482790e+01 assign (segid " " and resid 152 and name HB2) (segid " " and resid 115 and name HB1) 2.377 0.706 0.706 weight 1.000 ! spec=c13n...li-4, no=2473, id=2877, vol=1.600237e+02 or (segid " " and resid 115 and name HB1) (segid " " and resid 152 and name HB1) or (segid " " and resid 152 and name HB3) (segid " " and resid 115 and name HB1) assign (segid " " and resid 152 and name HB2) (segid " " and resid 118 and name HB) 2.687 0.902 0.902 weight 1.000 ! spec=c13n...li-4, no=2475, id=2878, vol=7.664430e+01 or (segid " " and resid 118 and name HB) (segid " " and resid 152 and name HB1) or (segid " " and resid 152 and name HB3) (segid " " and resid 118 and name HB) assign (segid " " and resid 152 and name HB1) (segid " " and resid 155 and name HD11) 2.737 0.936 0.936 weight 1.000 ! spec=c13n...li-4, no=2476, id=2879, vol=6.858930e+01 assign (segid " " and resid 152 and name HB1) (segid " " and resid 118 and name HG21) 2.681 0.898 0.898 weight 1.000 ! spec=c13n...li-4, no=2477, id=2880, vol=7.772970e+01 assign (segid " " and resid 123 and name HG12) (segid " " and resid 174 and name HB2) 2.403 0.722 0.722 weight 1.000 ! spec=c13n...li-4, no=2478, id=2881, vol=1.499050e+02 or (segid " " and resid 123 and name HG12) (segid " " and resid 174 and name HB1) or (segid " " and resid 123 and name HG12) (segid " " and resid 174 and name HB3) assign (segid " " and resid 146 and name HA) (segid " " and resid 150 and name HB2) 2.607 0.849 3.393 weight 1.000 ! spec=c13n...li-4, no=2479, id=2882, vol=9.190770e+01 or (segid " " and resid 146 and name HA) (segid " " and resid 150 and name HB1) or (segid " " and resid 146 and name HA) (segid " " and resid 150 and name HB3) assign (segid " " and resid 150 and name HB1) (segid " " and resid 150 and name HA) 1.833 0.420 4.167 weight 1.000 ! spec=c13n...li-4, no=2480, id=2883, vol=7.604637e+02 assign (segid " " and resid 146 and name HE2) (segid " " and resid 150 and name HB2) 2.824 0.997 0.997 weight 1.000 ! spec=c13n...li-4, no=2482, id=2885, vol=5.679630e+01 or (segid " " and resid 146 and name HE2) (segid " " and resid 150 and name HB1) or (segid " " and resid 146 and name HE2) (segid " " and resid 150 and name HB3) assign (segid " " and resid 150 and name HB1) (segid " " and resid 149 and name HB2) 2.531 0.801 3.469 weight 1.000 ! spec=c13n...li-4, no=2483, id=2886, vol=1.095899e+02 assign (segid " " and resid 150 and name HB2) (segid " " and resid 146 and name HB2) 2.021 0.510 3.979 weight 1.000 ! spec=c13n...li-4, no=2484, id=2887, vol=4.236109e+02 or (segid " " and resid 150 and name HB1) (segid " " and resid 146 and name HB2) or (segid " " and resid 150 and name HB3) (segid " " and resid 146 and name HB2) assign (segid " " and resid 150 and name HB2) (segid " " and resid 146 and name HB1) 2.066 0.534 0.534 weight 1.000 ! spec=c13n...li-4, no=2485, id=2888, vol=3.706233e+02 or (segid " " and resid 150 and name HB1) (segid " " and resid 146 and name HB1) or (segid " " and resid 150 and name HB3) (segid " " and resid 146 and name HB1) assign (segid " " and resid 146 and name HD2) (segid " " and resid 150 and name HB2) 2.364 0.699 3.636 weight 1.000 ! spec=c13n...li-4, no=2486, id=2889, vol=1.651341e+02 or (segid " " and resid 146 and name HD2) (segid " " and resid 150 and name HB1) or (segid " " and resid 146 and name HD2) (segid " " and resid 150 and name HB3) assign (segid " " and resid 150 and name HB2) (segid " " and resid 146 and name HG2) 2.264 0.641 0.641 weight 1.000 ! spec=c13n...li-4, no=2488, id=2891, vol=2.139293e+02 or (segid " " and resid 150 and name HB1) (segid " " and resid 146 and name HG2) or (segid " " and resid 150 and name HB3) (segid " " and resid 146 and name HG2) assign (segid " " and resid 150 and name HB1) (segid " " and resid 142 and name HG21) 1.906 0.454 4.094 weight 1.000 ! spec=c13n...li-4, no=2490, id=2892, vol=6.009507e+02 assign (segid " " and resid 132 and name HB) (segid " " and resid 132 and name HG21) 1.987 0.493 0.493 weight 1.000 ! spec=c13n...li-4, no=2493, id=2895, vol=4.687016e+02 assign (segid " " and resid 132 and name HG22) (segid " " and resid 131 and name HB1) 3.022 1.142 2.978 weight 1.000 ! spec=c13n...li-4, no=2494, id=2896, vol=3.782970e+01 or (segid " " and resid 132 and name HG21) (segid " " and resid 131 and name HB1) or (segid " " and resid 132 and name HG23) (segid " " and resid 131 and name HB1) assign (segid " " and resid 119 and name HG22) (segid " " and resid 119 and name HA) 2.286 0.653 0.653 weight 1.000 ! spec=c13n...li-4, no=2498, id=2898, vol=2.021010e+02 or (segid " " and resid 119 and name HA) (segid " " and resid 119 and name HG21) or (segid " " and resid 119 and name HG23) (segid " " and resid 119 and name HA) assign (segid " " and resid 98 and name HA) (segid " " and resid 97 and name HG21) 2.541 0.807 3.459 weight 1.000 ! spec=c13n...li-4, no=2499, id=2899, vol=1.071406e+02 assign (segid " " and resid 97 and name HA) (segid " " and resid 97 and name HG21) 2.202 0.606 3.798 weight 1.000 ! spec=c13n...li-4, no=2501, id=2901, vol=2.532601e+02 assign (segid " " and resid 119 and name HG22) (segid " " and resid 120 and name HD2) 2.806 0.984 0.984 weight 1.000 ! spec=c13n...li-4, no=2502, id=2902, vol=5.902040e+01 or (segid " " and resid 120 and name HD2) (segid " " and resid 119 and name HG21) or (segid " " and resid 119 and name HG23) (segid " " and resid 120 and name HD2) assign (segid " " and resid 124 and name HA) (segid " " and resid 124 and name HG21) 2.150 0.578 3.850 weight 1.000 ! spec=c13n...li-4, no=2503, id=2903, vol=2.918774e+02 assign (segid " " and resid 125 and name HA) (segid " " and resid 124 and name HG21) 2.579 0.832 0.832 weight 1.000 ! spec=c13n...li-4, no=2504, id=2904, vol=9.789560e+01 assign (segid " " and resid 97 and name HB) (segid " " and resid 97 and name HG21) 1.864 0.434 4.136 weight 1.000 ! spec=c13n...li-4, no=2507, id=2907, vol=6.876030e+02 assign (segid " " and resid 97 and name HG21) (segid " " and resid 100 and name HB1) 2.461 0.757 0.757 weight 1.000 ! spec=c13n...li-4, no=2508, id=2908, vol=1.298637e+02 assign (segid " " and resid 148 and name HB1) (segid " " and resid 119 and name HG21) 2.724 0.928 0.928 weight 1.000 ! spec=c13n...li-4, no=2510, id=2910, vol=7.052230e+01 assign (segid " " and resid 119 and name HG22) (segid " " and resid 119 and name HG12) 2.376 0.706 0.706 weight 1.000 ! spec=c13n...li-4, no=2512, id=2912, vol=1.602850e+02 or (segid " " and resid 119 and name HG12) (segid " " and resid 119 and name HG21) or (segid " " and resid 119 and name HG23) (segid " " and resid 119 and name HG12) assign (segid " " and resid 142 and name HG22) (segid " " and resid 151 and name HA2) 2.499 0.780 0.780 weight 1.000 ! spec=c13n...li-4, no=2517, id=2916, vol=1.184702e+02 or (segid " " and resid 151 and name HA2) (segid " " and resid 142 and name HG21) or (segid " " and resid 142 and name HG23) (segid " " and resid 151 and name HA2) assign (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HG21) 2.120 0.562 0.562 weight 1.000 ! spec=c13n...li-4, no=2519, id=2918, vol=3.180333e+02 assign (segid " " and resid 142 and name HG22) (segid " " and resid 151 and name HA1) 2.374 0.705 0.705 weight 1.000 ! spec=c13n...li-4, no=2521, id=2920, vol=1.608992e+02 or (segid " " and resid 151 and name HA1) (segid " " and resid 142 and name HG21) or (segid " " and resid 142 and name HG23) (segid " " and resid 151 and name HA1) assign (segid " " and resid 189 and name HG2) (segid " " and resid 187 and name HG21) 3.008 1.131 2.992 weight 1.000 ! spec=c13n...li-4, no=2522, id=2921, vol=3.894180e+01 assign (segid " " and resid 146 and name HB1) (segid " " and resid 142 and name HG21) 2.270 0.644 0.644 weight 1.000 ! spec=c13n...li-4, no=2525, id=2923, vol=2.108464e+02 assign (segid " " and resid 146 and name HD2) (segid " " and resid 142 and name HG21) 2.628 0.863 0.863 weight 1.000 ! spec=c13n...li-4, no=2526, id=2924, vol=8.755230e+01 assign (segid " " and resid 187 and name HG22) (segid " " and resid 187 and name HB) 2.572 0.827 0.827 weight 1.000 ! spec=c13n...li-4, no=2527, id=2925, vol=9.956620e+01 or (segid " " and resid 187 and name HB) (segid " " and resid 187 and name HG21) or (segid " " and resid 187 and name HG23) (segid " " and resid 187 and name HB) assign (segid " " and resid 187 and name HB) (segid " " and resid 187 and name HG21) 1.956 0.478 4.044 weight 1.000 ! spec=c13n...li-4, no=2528, id=2926, vol=5.145145e+02 assign (segid " " and resid 142 and name HG21) (segid " " and resid 142 and name HG11) 2.438 0.743 3.562 weight 1.000 ! spec=c13n...li-4, no=2530, id=2928, vol=1.373381e+02 assign (segid " " and resid 187 and name HG21) (segid " " and resid 187 and name HG12) 2.317 0.671 3.683 weight 1.000 ! spec=c13n...li-4, no=2531, id=2929, vol=1.865574e+02 assign (segid " " and resid 187 and name HG21) (segid " " and resid 187 and name HG11) 2.259 0.638 3.741 weight 1.000 ! spec=c13n...li-4, no=2532, id=2930, vol=2.167189e+02 assign (segid " " and resid 139 and name HG22) (segid " " and resid 151 and name HA2) 2.907 1.056 1.056 weight 1.000 ! spec=c13n...li-4, no=2536, id=2932, vol=4.776450e+01 or (segid " " and resid 151 and name HA2) (segid " " and resid 139 and name HG21) or (segid " " and resid 139 and name HG23) (segid " " and resid 151 and name HA2) assign (segid " " and resid 124 and name HA) (segid " " and resid 123 and name HG21) 2.241 0.628 3.759 weight 1.000 ! spec=c13n...li-4, no=2539, id=2935, vol=2.274348e+02 assign (segid " " and resid 122 and name HB2) (segid " " and resid 123 and name HG22) 2.521 0.795 0.795 weight 1.000 ! spec=c13n...li-4, no=2542, id=2938, vol=1.122135e+02 or (segid " " and resid 122 and name HB2) (segid " " and resid 123 and name HG21) or (segid " " and resid 122 and name HB2) (segid " " and resid 123 and name HG23) assign (segid " " and resid 154 and name HB2) (segid " " and resid 139 and name HG21) 3.035 1.151 2.965 weight 1.000 ! spec=c13n...li-4, no=2545, id=2939, vol=3.689640e+01 assign (segid " " and resid 120 and name HG2) (segid " " and resid 139 and name HG21) 2.751 0.946 0.946 weight 1.000 ! spec=c13n...li-4, no=2546, id=2940, vol=6.652340e+01 assign (segid " " and resid 123 and name HB) (segid " " and resid 123 and name HG21) 2.092 0.547 0.547 weight 1.000 ! spec=c13n...li-4, no=2548, id=2942, vol=3.435651e+02 assign (segid " " and resid 123 and name HG21) (segid " " and resid 123 and name HG11) 2.274 0.646 0.646 weight 1.000 ! spec=c13n...li-4, no=2549, id=2943, vol=2.086877e+02 assign (segid " " and resid 123 and name HG12) (segid " " and resid 123 and name HG21) 2.342 0.685 3.658 weight 1.000 ! spec=c13n...li-4, no=2550, id=2944, vol=1.749323e+02 assign (segid " " and resid 175 and name HD11) (segid " " and resid 123 and name HG21) 2.332 0.680 3.668 weight 1.000 ! spec=c13n...li-4, no=2552, id=2945, vol=1.794742e+02 assign (segid " " and resid 123 and name HG21) (segid " " and resid 123 and name HD11) 1.892 0.447 0.447 weight 1.000 ! spec=c13n...li-4, no=2553, id=2946, vol=6.288154e+02 assign (segid " " and resid 118 and name HG21) (segid " " and resid 114 and name HE1) 2.861 1.023 1.023 weight 1.000 ! spec=c13n...li-4, no=2556, id=2949, vol=5.256640e+01 assign (segid " " and resid 118 and name HG21) (segid " " and resid 114 and name HZ) 2.926 1.070 3.074 weight 1.000 ! spec=c13n...li-4, no=2557, id=2950, vol=4.594580e+01 assign (segid " " and resid 118 and name HG21) (segid " " and resid 152 and name HA) 2.962 1.097 1.097 weight 1.000 ! spec=c13n...li-4, no=2559, id=2952, vol=4.266330e+01 assign (segid " " and resid 118 and name HG22) (segid " " and resid 120 and name HA) 2.653 0.880 0.880 weight 1.000 ! spec=c13n...li-4, no=2561, id=2954, vol=8.265670e+01 or (segid " " and resid 120 and name HA) (segid " " and resid 118 and name HG21) or (segid " " and resid 118 and name HG23) (segid " " and resid 120 and name HA) assign (segid " " and resid 118 and name HG21) (segid " " and resid 123 and name HG11) 2.846 1.012 3.154 weight 1.000 ! spec=c13n...li-4, no=2564, id=2957, vol=5.429660e+01 assign (segid " " and resid 118 and name HG22) (segid " " and resid 152 and name HB2) 2.682 0.899 0.899 weight 1.000 ! spec=c13n...li-4, no=2565, id=2958, vol=7.745730e+01 or (segid " " and resid 118 and name HG22) (segid " " and resid 152 and name HB1) or (segid " " and resid 118 and name HG22) (segid " " and resid 152 and name HB3) or (segid " " and resid 118 and name HG21) (segid " " and resid 152 and name HB2) or (segid " " and resid 152 and name HB1) (segid " " and resid 118 and name HG21) or (segid " " and resid 118 and name HG21) (segid " " and resid 152 and name HB3) or (segid " " and resid 118 and name HG23) (segid " " and resid 152 and name HB2) or (segid " " and resid 118 and name HG23) (segid " " and resid 152 and name HB1) or (segid " " and resid 118 and name HG23) (segid " " and resid 152 and name HB3) assign (segid " " and resid 118 and name HB) (segid " " and resid 118 and name HG21) 2.178 0.593 3.822 weight 1.000 ! spec=c13n...li-4, no=2566, id=2959, vol=2.697746e+02 assign (segid " " and resid 123 and name HG21) (segid " " and resid 118 and name HG21) 2.180 0.594 0.594 weight 1.000 ! spec=c13n...li-4, no=2567, id=2960, vol=2.684995e+02 assign (segid " " and resid 118 and name HG21) (segid " " and resid 123 and name HD11) 2.333 0.681 0.681 weight 1.000 ! spec=c13n...li-4, no=2569, id=2962, vol=1.786673e+02 assign (segid " " and resid 118 and name HG12) (segid " " and resid 118 and name HG21) 2.254 0.635 3.746 weight 1.000 ! spec=c13n...li-4, no=2571, id=2963, vol=2.198758e+02 assign (segid " " and resid 118 and name HG11) (segid " " and resid 118 and name HG21) 2.629 0.864 3.371 weight 1.000 ! spec=c13n...li-4, no=2573, id=2965, vol=8.729380e+01 assign (segid " " and resid 124 and name HD11) (segid " " and resid 139 and name HA) 2.650 0.878 3.350 weight 1.000 ! spec=c13n...li-4, no=2577, id=2969, vol=8.318450e+01 assign (segid " " and resid 124 and name HD11) (segid " " and resid 123 and name HG11) 2.350 0.690 3.650 weight 1.000 ! spec=c13n...li-4, no=2583, id=2973, vol=1.713695e+02 assign (segid " " and resid 124 and name HD11) (segid " " and resid 124 and name HG21) 2.214 0.613 3.786 weight 1.000 ! spec=c13n...li-4, no=2585, id=2975, vol=2.449746e+02 assign (segid " " and resid 123 and name HB) (segid " " and resid 123 and name HD11) 2.313 0.669 3.687 weight 1.000 ! spec=c13n...li-4, no=2589, id=2978, vol=1.883329e+02 assign (segid " " and resid 123 and name HG11) (segid " " and resid 123 and name HD11) 2.435 0.741 0.741 weight 1.000 ! spec=c13n...li-4, no=2590, id=2979, vol=1.383679e+02 assign (segid " " and resid 123 and name HG12) (segid " " and resid 123 and name HD11) 2.293 0.657 0.657 weight 1.000 ! spec=c13n...li-4, no=2591, id=2980, vol=1.982048e+02 assign (segid " " and resid 175 and name HD11) (segid " " and resid 123 and name HD11) 2.290 0.656 3.710 weight 1.000 ! spec=c13n...li-4, no=2592, id=2981, vol=1.997248e+02 assign (segid " " and resid 132 and name HB) (segid " " and resid 132 and name HD11) 2.130 0.567 0.567 weight 1.000 ! spec=c13n...li-4, no=2601, id=2988, vol=3.091569e+02 assign (segid " " and resid 132 and name HG12) (segid " " and resid 132 and name HD12) 1.904 0.453 4.096 weight 1.000 ! spec=c13n...li-4, no=2602, id=2989, vol=6.049777e+02 assign (segid " " and resid 97 and name HD11) (segid " " and resid 97 and name HB) 2.448 0.749 0.749 weight 1.000 ! spec=c13n...li-4, no=2608, id=2993, vol=1.339267e+02 assign (segid " " and resid 97 and name HD11) (segid " " and resid 97 and name HG11) 2.217 0.614 3.783 weight 1.000 ! spec=c13n...li-4, no=2609, id=2994, vol=2.429322e+02 assign (segid " " and resid 139 and name HD12) (segid " " and resid 138 and name HB2) 2.358 0.695 0.695 weight 1.000 ! spec=c13n...li-4, no=2616, id=2999, vol=1.679282e+02 or (segid " " and resid 139 and name HD11) (segid " " and resid 138 and name HB2) or (segid " " and resid 139 and name HD13) (segid " " and resid 138 and name HB2) assign (segid " " and resid 139 and name HD11) (segid " " and resid 139 and name HB) 2.047 0.524 3.953 weight 1.000 ! spec=c13n...li-4, no=2617, id=3000, vol=3.918141e+02 assign (segid " " and resid 139 and name HD11) (segid " " and resid 154 and name HD1) 2.728 0.930 3.272 weight 1.000 ! spec=c13n...li-4, no=2618, id=3001, vol=6.994380e+01 assign (segid " " and resid 139 and name HD11) (segid " " and resid 139 and name HG12) 2.157 0.582 0.582 weight 1.000 ! spec=c13n...li-4, no=2620, id=3003, vol=2.863020e+02 assign (segid " " and resid 119 and name HA) (segid " " and resid 119 and name HD11) 2.303 0.663 0.663 weight 1.000 ! spec=c13n...li-4, no=2622, id=3004, vol=1.932584e+02 assign (segid " " and resid 120 and name HD2) (segid " " and resid 119 and name HD11) 3.090 1.194 1.194 weight 1.000 ! spec=c13n...li-4, no=2624, id=3006, vol=3.309520e+01 assign (segid " " and resid 119 and name HD11) (segid " " and resid 148 and name HB1) 2.424 0.734 0.734 weight 1.000 ! spec=c13n...li-4, no=2626, id=3008, vol=1.422207e+02 assign (segid " " and resid 119 and name HG12) (segid " " and resid 119 and name HD11) 2.232 0.623 0.623 weight 1.000 ! spec=c13n...li-4, no=2627, id=3009, vol=2.331591e+02 assign (segid " " and resid 119 and name HD11) (segid " " and resid 119 and name HG11) 2.212 0.612 0.612 weight 1.000 ! spec=c13n...li-4, no=2628, id=3010, vol=2.460560e+02 assign (segid " " and resid 119 and name HD11) (segid " " and resid 119 and name HG21) 2.076 0.539 0.539 weight 1.000 ! spec=c13n...li-4, no=2629, id=3011, vol=3.599739e+02 assign (segid " " and resid 187 and name HD12) (segid " " and resid 185 and name HA) 3.009 1.132 1.132 weight 1.000 ! spec=c13n...li-4, no=2631, id=3012, vol=3.885390e+01 or (segid " " and resid 185 and name HA) (segid " " and resid 187 and name HD11) or (segid " " and resid 187 and name HD13) (segid " " and resid 185 and name HA) assign (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HD11) 2.226 0.620 0.620 weight 1.000 ! spec=c13n...li-4, no=2632, id=3013, vol=2.368627e+02 assign (segid " " and resid 187 and name HD11) (segid " " and resid 187 and name HB) 2.424 0.735 3.576 weight 1.000 ! spec=c13n...li-4, no=2633, id=3014, vol=1.420361e+02 assign (segid " " and resid 187 and name HG11) (segid " " and resid 187 and name HD12) 2.135 0.570 3.865 weight 1.000 ! spec=c13n...li-4, no=2634, id=3015, vol=3.041975e+02 assign (segid " " and resid 187 and name HG12) (segid " " and resid 187 and name HD11) 2.104 0.554 3.896 weight 1.000 ! spec=c13n...li-4, no=2635, id=3016, vol=3.320556e+02 assign (segid " " and resid 118 and name HD11) (segid " " and resid 182 and name HD1) 2.736 0.935 3.264 weight 1.000 ! spec=c13n...li-4, no=2638, id=3017, vol=6.879380e+01 assign (segid " " and resid 118 and name HD11) (segid " " and resid 114 and name HE1) 2.791 0.974 3.209 weight 1.000 ! spec=c13n...li-4, no=2639, id=3018, vol=6.094910e+01 assign (segid " " and resid 118 and name HD11) (segid " " and resid 114 and name HD1) 2.953 1.090 3.047 weight 1.000 ! spec=c13n...li-4, no=2640, id=3019, vol=4.351830e+01 assign (segid " " and resid 118 and name HD12) (segid " " and resid 114 and name HA) 2.958 1.094 1.094 weight 1.000 ! spec=c13n...li-4, no=2641, id=3020, vol=4.304390e+01 or (segid " " and resid 114 and name HA) (segid " " and resid 118 and name HD11) or (segid " " and resid 118 and name HD13) (segid " " and resid 114 and name HA) assign (segid " " and resid 118 and name HD11) (segid " " and resid 117 and name HB1) 2.850 1.016 3.150 weight 1.000 ! spec=c13n...li-4, no=2642, id=3021, vol=5.375930e+01 assign (segid " " and resid 118 and name HB) (segid " " and resid 118 and name HD11) 2.576 0.829 0.829 weight 1.000 ! spec=c13n...li-4, no=2643, id=3022, vol=9.878040e+01 assign (segid " " and resid 123 and name HG21) (segid " " and resid 118 and name HD11) 2.090 0.546 0.546 weight 1.000 ! spec=c13n...li-4, no=2645, id=3024, vol=3.456659e+02 assign (segid " " and resid 118 and name HG21) (segid " " and resid 118 and name HD11) 2.181 0.595 0.595 weight 1.000 ! spec=c13n...li-4, no=2646, id=3025, vol=2.677355e+02 assign (segid " " and resid 118 and name HG11) (segid " " and resid 118 and name HD11) 2.556 0.817 0.817 weight 1.000 ! spec=c13n...li-4, no=2648, id=3026, vol=1.033988e+02 assign (segid " " and resid 118 and name HD11) (segid " " and resid 120 and name HD2) 2.960 1.095 3.040 weight 1.000 ! spec=c13n...li-4, no=2649, id=3027, vol=4.288000e+01 assign (segid " " and resid 118 and name HD11) (segid " " and resid 152 and name HA) 3.165 1.252 2.835 weight 1.000 ! spec=c13n...li-4, no=2650, id=3028, vol=2.868910e+01 assign (segid " " and resid 182 and name HB1) (segid " " and resid 118 and name HD11) 2.695 0.908 3.305 weight 1.000 ! spec=c13n...li-4, no=2653, id=3031, vol=7.526750e+01 assign (segid " " and resid 118 and name HG12) (segid " " and resid 118 and name HD11) 2.514 0.790 0.790 weight 1.000 ! spec=c13n...li-4, no=2654, id=3032, vol=1.141908e+02 assign (segid " " and resid 123 and name HD11) (segid " " and resid 118 and name HD11) 2.536 0.804 0.804 weight 1.000 ! spec=c13n...li-4, no=2655, id=3033, vol=1.083938e+02 assign (segid " " and resid 116 and name HB) (segid " " and resid 149 and name HE1) 3.188 1.271 1.271 weight 1.000 ! spec=c13n...li-4, no=2658, id=3035, vol=2.744680e+01 assign (segid " " and resid 145 and name HB) (segid " " and resid 146 and name HG2) 3.237 1.310 2.763 weight 1.000 ! spec=c13n...li-4, no=2659, id=3036, vol=2.507320e+01 assign (segid " " and resid 170 and name HB) (segid " " and resid 167 and name HB1) 3.138 1.231 2.862 weight 1.000 ! spec=c13n...li-4, no=2661, id=3038, vol=3.019120e+01 assign (segid " " and resid 170 and name HB) (segid " " and resid 167 and name HB2) 3.305 1.366 1.366 weight 1.000 ! spec=c13n...li-4, no=2662, id=3039, vol=2.211650e+01 assign (segid " " and resid 112 and name HA) (segid " " and resid 115 and name HD2) 2.626 0.862 0.862 weight 1.000 ! spec=c13n...li-4, no=2663, id=3040, vol=8.794520e+01 assign (segid " " and resid 168 and name HA) (segid " " and resid 186 and name HD1) 3.089 1.193 1.193 weight 1.000 ! spec=c13n...li-4, no=2664, id=3041, vol=3.317320e+01 assign (segid " " and resid 168 and name HA) (segid " " and resid 171 and name HD11) 3.129 1.224 1.224 weight 1.000 ! spec=c13n...li-4, no=2666, id=3043, vol=3.069780e+01 assign (segid " " and resid 168 and name HB1) (segid " " and resid 168 and name HA) 2.592 0.840 0.840 weight 1.000 ! spec=c13n...li-4, no=2667, id=3044, vol=9.508840e+01 assign (segid " " and resid 127 and name HD11) (segid " " and resid 170 and name HA) 3.246 1.317 2.754 weight 1.000 ! spec=c13n...li-4, no=2668, id=3045, vol=2.464250e+01 assign (segid " " and resid 143 and name HA) (segid " " and resid 148 and name HE2) 3.166 1.253 1.253 weight 1.000 ! spec=c13n...li-4, no=2677, id=3053, vol=2.864170e+01 or (segid " " and resid 148 and name HE1) (segid " " and resid 143 and name HA) or (segid " " and resid 143 and name HA) (segid " " and resid 148 and name HE3) assign (segid " " and resid 143 and name HA) (segid " " and resid 150 and name HB1) 3.165 1.252 1.252 weight 1.000 ! spec=c13n...li-4, no=2679, id=3055, vol=2.866150e+01 assign (segid " " and resid 167 and name HA) (segid " " and resid 166 and name HA) 3.136 1.230 2.864 weight 1.000 ! spec=c13n...li-4, no=2682, id=3058, vol=3.029070e+01 assign (segid " " and resid 103 and name HA) (segid " " and resid 188 and name HG11) 3.288 1.351 2.712 weight 1.000 ! spec=c13n...li-4, no=2683, id=3059, vol=2.282410e+01 assign (segid " " and resid 188 and name HA) (segid " " and resid 103 and name HB2) 3.642 1.658 1.658 weight 1.000 ! spec=c13n...li-4, no=2684, id=3060, vol=1.234900e+01 assign (segid " " and resid 175 and name HB1) (segid " " and resid 183 and name HA) 3.396 1.442 1.442 weight 1.000 ! spec=c13n...li-4, no=2686, id=3062, vol=1.879660e+01 assign (segid " " and resid 114 and name HA) (segid " " and resid 113 and name HB1) 3.325 1.382 1.382 weight 1.000 ! spec=c13n...li-4, no=2689, id=3063, vol=2.132850e+01 assign (segid " " and resid 114 and name HA) (segid " " and resid 118 and name HG11) 3.171 1.257 1.257 weight 1.000 ! spec=c13n...li-4, no=2690, id=3064, vol=2.835950e+01 assign (segid " " and resid 160 and name HD11) (segid " " and resid 107 and name HA) 2.903 1.054 3.097 weight 1.000 ! spec=c13n...li-4, no=2692, id=3066, vol=4.814270e+01 assign (segid " " and resid 188 and name HA) (segid " " and resid 187 and name HG22) 3.051 1.164 1.164 weight 1.000 ! spec=c13n...li-4, no=2694, id=3068, vol=3.573310e+01 or (segid " " and resid 188 and name HA) (segid " " and resid 187 and name HG21) or (segid " " and resid 188 and name HA) (segid " " and resid 187 and name HG23) assign (segid " " and resid 188 and name HA) (segid " " and resid 106 and name HD11) 3.302 1.363 2.698 weight 1.000 ! spec=c13n...li-4, no=2695, id=3069, vol=2.226480e+01 assign (segid " " and resid 155 and name HA) (segid " " and resid 158 and name HB2) 2.651 0.878 0.878 weight 1.000 ! spec=c13n...li-4, no=2696, id=3070, vol=8.313850e+01 assign (segid " " and resid 155 and name HA) (segid " " and resid 159 and name HD22) 3.192 1.273 1.273 weight 1.000 ! spec=c13n...li-4, no=2699, id=3073, vol=2.728060e+01 or (segid " " and resid 155 and name HA) (segid " " and resid 159 and name HD21) or (segid " " and resid 155 and name HA) (segid " " and resid 159 and name HD23) or (segid " " and resid 155 and name HA) (segid " " and resid 159 and name HD12) or (segid " " and resid 155 and name HA) (segid " " and resid 159 and name HD11) or (segid " " and resid 155 and name HA) (segid " " and resid 159 and name HD13) assign (segid " " and resid 137 and name HA) (segid " " and resid 140 and name HG) 2.749 0.945 0.945 weight 1.000 ! spec=c13n...li-4, no=2701, id=3075, vol=6.677470e+01 assign (segid " " and resid 137 and name HA) (segid " " and resid 140 and name HB1) 2.628 0.863 3.372 weight 1.000 ! spec=c13n...li-4, no=2702, id=3076, vol=8.760770e+01 assign (segid " " and resid 137 and name HA) (segid " " and resid 140 and name HD11) 2.223 0.618 0.618 weight 1.000 ! spec=c13n...li-4, no=2703, id=3077, vol=2.390468e+02 assign (segid " " and resid 155 and name HA) (segid " " and resid 131 and name HD21) 2.615 0.855 3.385 weight 1.000 ! spec=c13n...li-4, no=2704, id=3078, vol=9.015650e+01 assign (segid " " and resid 156 and name HB) (segid " " and resid 153 and name HA) 2.272 0.645 3.728 weight 1.000 ! spec=c13n...li-4, no=2705, id=3079, vol=2.096562e+02 assign (segid " " and resid 157 and name HA) (segid " " and resid 160 and name HD11) 3.232 1.306 1.306 weight 1.000 ! spec=c13n...li-4, no=2707, id=3081, vol=2.527630e+01 assign (segid " " and resid 122 and name HA) (segid " " and resid 124 and name HG21) 3.247 1.318 2.753 weight 1.000 ! spec=c13n...li-4, no=2712, id=3084, vol=2.459200e+01 assign (segid " " and resid 119 and name HA) (segid " " and resid 120 and name HB2) 2.993 1.119 3.007 weight 1.000 ! spec=c13n...li-4, no=2713, id=3085, vol=4.014200e+01 assign (segid " " and resid 119 and name HA) (segid " " and resid 118 and name HD11) 3.624 1.642 2.376 weight 1.000 ! spec=c13n...li-4, no=2714, id=3086, vol=1.271900e+01 assign (segid " " and resid 109 and name HG2) (segid " " and resid 106 and name HA) 2.473 0.764 0.764 weight 1.000 ! spec=c13n...li-4, no=2715, id=3087, vol=1.260763e+02 assign (segid " " and resid 173 and name HA) (segid " " and resid 176 and name HB1) 2.742 0.940 3.258 weight 1.000 ! spec=c13n...li-4, no=2720, id=3092, vol=6.789580e+01 assign (segid " " and resid 184 and name HA) (segid " " and resid 185 and name HD21) 2.850 1.015 3.150 weight 1.000 ! spec=c13n...li-4, no=2722, id=3094, vol=5.382180e+01 assign (segid " " and resid 175 and name HB2) (segid " " and resid 175 and name HA) 2.610 0.852 0.852 weight 1.000 ! spec=c13n...li-4, no=2726, id=3096, vol=9.111980e+01 assign (segid " " and resid 175 and name HA) (segid " " and resid 118 and name HD11) 3.428 1.469 2.572 weight 1.000 ! spec=c13n...li-4, no=2727, id=3097, vol=1.776440e+01 assign (segid " " and resid 186 and name HA) (segid " " and resid 187 and name HD12) 3.166 1.253 1.253 weight 1.000 ! spec=c13n...li-4, no=2732, id=3102, vol=2.865380e+01 or (segid " " and resid 186 and name HA) (segid " " and resid 187 and name HD11) or (segid " " and resid 186 and name HA) (segid " " and resid 187 and name HD13) assign (segid " " and resid 185 and name HA) (segid " " and resid 110 and name HD22) 2.913 1.060 3.087 weight 1.000 ! spec=c13n...li-4, no=2737, id=3103, vol=4.722420e+01 or (segid " " and resid 185 and name HA) (segid " " and resid 110 and name HD21) or (segid " " and resid 185 and name HA) (segid " " and resid 110 and name HD23) assign (segid " " and resid 152 and name HA) (segid " " and resid 139 and name HG21) 3.122 1.219 1.219 weight 1.000 ! spec=c13n...li-4, no=2739, id=3105, vol=3.112210e+01 assign (segid " " and resid 166 and name HA) (segid " " and resid 169 and name HD2) 3.289 1.352 1.352 weight 1.000 ! spec=c13n...li-4, no=2742, id=3108, vol=2.279430e+01 assign (segid " " and resid 120 and name HD2) (segid " " and resid 148 and name HB2) 3.184 1.268 1.268 weight 1.000 ! spec=c13n...li-4, no=2745, id=3110, vol=2.765140e+01 assign (segid " " and resid 120 and name HD2) (segid " " and resid 119 and name HG11) 3.298 1.359 1.359 weight 1.000 ! spec=c13n...li-4, no=2746, id=3111, vol=2.241960e+01 assign (segid " " and resid 150 and name HB1) (segid " " and resid 151 and name HA2) 3.140 1.232 1.232 weight 1.000 ! spec=c13n...li-4, no=2748, id=3112, vol=3.010450e+01 assign (segid " " and resid 151 and name HA1) (segid " " and resid 154 and name HB2) 3.165 1.252 1.252 weight 1.000 ! spec=c13n...li-4, no=2750, id=3114, vol=2.866850e+01 assign (segid " " and resid 151 and name HA1) (segid " " and resid 142 and name HG12) 3.186 1.269 1.269 weight 1.000 ! spec=c13n...li-4, no=2751, id=3115, vol=2.758180e+01 assign (segid " " and resid 109 and name HD1) (segid " " and resid 106 and name HA) 3.246 1.317 1.317 weight 1.000 ! spec=c13n...li-4, no=2752, id=3116, vol=2.465840e+01 assign (segid " " and resid 117 and name HD2) (segid " " and resid 113 and name HB2) 3.185 1.268 1.268 weight 1.000 ! spec=c13n...li-4, no=2755, id=3119, vol=2.762290e+01 assign (segid " " and resid 117 and name HD2) (segid " " and resid 182 and name HB1) 3.154 1.243 2.846 weight 1.000 ! spec=c13n...li-4, no=2756, id=3120, vol=2.931060e+01 assign (segid " " and resid 110 and name HB2) (segid " " and resid 107 and name HA) 3.281 1.346 1.346 weight 1.000 ! spec=c13n...li-4, no=2758, id=3122, vol=2.310170e+01 assign (segid " " and resid 131 and name HB2) (segid " " and resid 135 and name HB2) 3.169 1.256 1.256 weight 1.000 ! spec=c13n...li-4, no=2762, id=3124, vol=2.844890e+01 assign (segid " " and resid 122 and name HB2) (segid " " and resid 175 and name HD21) 2.678 0.897 3.322 weight 1.000 ! spec=c13n...li-4, no=2764, id=3125, vol=7.809190e+01 assign (segid " " and resid 126 and name HB1) (segid " " and resid 127 and name HB1) 3.139 1.232 2.861 weight 1.000 ! spec=c13n...li-4, no=2765, id=3126, vol=3.011290e+01 assign (segid " " and resid 178 and name HB2) (segid " " and resid 122 and name HB2) 2.910 1.058 1.058 weight 1.000 ! spec=c13n...li-4, no=2766, id=3127, vol=4.749280e+01 assign (segid " " and resid 174 and name HA) (segid " " and resid 126 and name HB1) 3.081 1.187 1.187 weight 1.000 ! spec=c13n...li-4, no=2768, id=3129, vol=3.368800e+01 assign (segid " " and resid 107 and name HB2) (segid " " and resid 167 and name HH2) 3.169 1.256 1.256 weight 1.000 ! spec=c13n...li-4, no=2773, id=3132, vol=2.844210e+01 assign (segid " " and resid 107 and name HB2) (segid " " and resid 186 and name HZ3) 3.136 1.229 2.864 weight 1.000 ! spec=c13n...li-4, no=2774, id=3133, vol=3.031260e+01 assign (segid " " and resid 107 and name HB1) (segid " " and resid 167 and name HH2) 3.022 1.142 1.142 weight 1.000 ! spec=c13n...li-4, no=2777, id=3134, vol=3.784670e+01 assign (segid " " and resid 107 and name HB1) (segid " " and resid 186 and name HH2) 3.061 1.171 1.171 weight 1.000 ! spec=c13n...li-4, no=2778, id=3135, vol=3.508090e+01 assign (segid " " and resid 140 and name HB2) (segid " " and resid 124 and name HG11) 2.979 1.109 1.109 weight 1.000 ! spec=c13n...li-4, no=2783, id=3139, vol=4.128810e+01 assign (segid " " and resid 100 and name HB1) (segid " " and resid 101 and name HA) 3.187 1.270 2.813 weight 1.000 ! spec=c13n...li-4, no=2784, id=3140, vol=2.749900e+01 assign (segid " " and resid 165 and name HA) (segid " " and resid 100 and name HB1) 3.137 1.230 2.863 weight 1.000 ! spec=c13n...li-4, no=2785, id=3141, vol=3.026790e+01 assign (segid " " and resid 118 and name HG21) (segid " " and resid 155 and name HB1) 3.297 1.359 1.359 weight 1.000 ! spec=c13n...li-4, no=2786, id=3142, vol=2.245300e+01 assign (segid " " and resid 114 and name HB2) (segid " " and resid 114 and name HE1) 3.289 1.352 1.352 weight 1.000 ! spec=c13n...li-4, no=2787, id=3143, vol=2.276360e+01 assign (segid " " and resid 114 and name HB2) (segid " " and resid 182 and name HE1) 3.117 1.214 2.883 weight 1.000 ! spec=c13n...li-4, no=2788, id=3144, vol=3.146970e+01 assign (segid " " and resid 114 and name HB2) (segid " " and resid 152 and name HB2) 3.238 1.311 1.311 weight 1.000 ! spec=c13n...li-4, no=2789, id=3145, vol=2.501860e+01 or (segid " " and resid 114 and name HB2) (segid " " and resid 152 and name HB1) or (segid " " and resid 114 and name HB2) (segid " " and resid 152 and name HB3) assign (segid " " and resid 182 and name HB2) (segid " " and resid 117 and name HD2) 3.150 1.240 1.240 weight 1.000 ! spec=c13n...li-4, no=2790, id=3146, vol=2.952100e+01 assign (segid " " and resid 182 and name HB2) (segid " " and resid 117 and name HB1) 3.124 1.220 1.220 weight 1.000 ! spec=c13n...li-4, no=2791, id=3147, vol=3.100890e+01 assign (segid " " and resid 114 and name HB1) (segid " " and resid 186 and name HZ3) 3.156 1.245 2.844 weight 1.000 ! spec=c13n...li-4, no=2795, id=3151, vol=2.916060e+01 assign (segid " " and resid 159 and name HB2) (segid " " and resid 160 and name HD21) 3.463 1.499 1.499 weight 1.000 ! spec=c13n...li-4, no=2798, id=3154, vol=1.672180e+01 assign (segid " " and resid 159 and name HB1) (segid " " and resid 156 and name HA) 3.283 1.347 1.347 weight 1.000 ! spec=c13n...li-4, no=2799, id=3155, vol=2.304240e+01 assign (segid " " and resid 103 and name HB2) (segid " " and resid 103 and name HE1) 3.070 1.178 2.930 weight 1.000 ! spec=c13n...li-4, no=2800, id=3156, vol=3.440770e+01 assign (segid " " and resid 103 and name HB2) (segid " " and resid 167 and name HH2) 3.248 1.319 1.319 weight 1.000 ! spec=c13n...li-4, no=2801, id=3157, vol=2.454810e+01 assign (segid " " and resid 103 and name HB1) (segid " " and resid 167 and name HZ2) 3.205 1.284 1.284 weight 1.000 ! spec=c13n...li-4, no=2804, id=3160, vol=2.661410e+01 assign (segid " " and resid 103 and name HB1) (segid " " and resid 103 and name HE1) 3.314 1.373 2.686 weight 1.000 ! spec=c13n...li-4, no=2805, id=3161, vol=2.175810e+01 assign (segid " " and resid 132 and name HD11) (segid " " and resid 135 and name HG1) 3.275 1.341 1.341 weight 1.000 ! spec=c13n...li-4, no=2807, id=3163, vol=2.336600e+01 assign (segid " " and resid 135 and name HG2) (segid " " and resid 131 and name HD21) 3.314 1.373 2.686 weight 1.000 ! spec=c13n...li-4, no=2808, id=3164, vol=2.175040e+01 assign (segid " " and resid 142 and name HB) (segid " " and resid 142 and name HA) 2.606 0.849 0.849 weight 1.000 ! spec=c13n...li-4, no=2809, id=3165, vol=9.208280e+01 assign (segid " " and resid 102 and name HG2) (segid " " and resid 99 and name HA) 3.138 1.231 1.231 weight 1.000 ! spec=c13n...li-4, no=2811, id=3167, vol=3.018040e+01 assign (segid " " and resid 102 and name HG2) (segid " " and resid 105 and name HD22) 3.083 1.188 1.188 weight 1.000 ! spec=c13n...li-4, no=2812, id=3168, vol=3.357310e+01 or (segid " " and resid 102 and name HG2) (segid " " and resid 105 and name HD21) or (segid " " and resid 102 and name HG2) (segid " " and resid 105 and name HD23) assign (segid " " and resid 146 and name HB1) (segid " " and resid 142 and name HA) 3.197 1.278 1.278 weight 1.000 ! spec=c13n...li-4, no=2813, id=3169, vol=2.700010e+01 assign (segid " " and resid 94 and name HB2) (segid " " and resid 94 and name HG2) 2.540 0.806 0.806 weight 1.000 ! spec=c13n...li-4, no=2817, id=3171, vol=1.074305e+02 assign (segid " " and resid 138 and name HA) (segid " " and resid 141 and name HG1) 2.882 1.038 1.038 weight 1.000 ! spec=c13n...li-4, no=2819, id=3173, vol=5.034900e+01 assign (segid " " and resid 148 and name HB1) (segid " " and resid 119 and name HD12) 3.130 1.225 1.225 weight 1.000 ! spec=c13n...li-4, no=2820, id=3174, vol=3.065620e+01 or (segid " " and resid 119 and name HD11) (segid " " and resid 148 and name HB1) or (segid " " and resid 148 and name HB1) (segid " " and resid 119 and name HD13) assign (segid " " and resid 169 and name HB2) (segid " " and resid 169 and name HG2) 2.117 0.560 0.560 weight 1.000 ! spec=c13n...li-4, no=2823, id=3177, vol=3.200166e+02 assign (segid " " and resid 117 and name HB1) (segid " " and resid 182 and name HD1) 3.161 1.249 1.249 weight 1.000 ! spec=c13n...li-4, no=2824, id=3178, vol=2.891020e+01 assign (segid " " and resid 117 and name HB1) (segid " " and resid 118 and name HD12) 3.112 1.211 1.211 weight 1.000 ! spec=c13n...li-4, no=2825, id=3179, vol=3.173870e+01 or (segid " " and resid 118 and name HD11) (segid " " and resid 117 and name HB1) or (segid " " and resid 117 and name HB1) (segid " " and resid 118 and name HD13) assign (segid " " and resid 186 and name HB1) (segid " " and resid 182 and name HD1) 3.097 1.199 1.199 weight 1.000 ! spec=c13n...li-4, no=2827, id=3181, vol=3.268530e+01 assign (segid " " and resid 186 and name HB1) (segid " " and resid 186 and name HD1) 3.209 1.287 1.287 weight 1.000 ! spec=c13n...li-4, no=2828, id=3182, vol=2.641580e+01 assign (segid " " and resid 93 and name HB2) (segid " " and resid 93 and name HD2) 3.191 1.273 1.273 weight 1.000 ! spec=c13n...li-4, no=2829, id=3183, vol=2.731930e+01 assign (segid " " and resid 135 and name HB2) (segid " " and resid 131 and name HA) 3.217 1.294 1.294 weight 1.000 ! spec=c13n...li-4, no=2830, id=3184, vol=2.601330e+01 assign (segid " " and resid 101 and name HB2) (segid " " and resid 97 and name HG21) 2.845 1.012 3.155 weight 1.000 ! spec=c13n...li-4, no=2831, id=3185, vol=5.434500e+01 assign (segid " " and resid 132 and name HD11) (segid " " and resid 135 and name HB2) 3.217 1.293 2.783 weight 1.000 ! spec=c13n...li-4, no=2832, id=3186, vol=2.603680e+01 assign (segid " " and resid 135 and name HB2) (segid " " and resid 132 and name HG12) 3.196 1.277 1.277 weight 1.000 ! spec=c13n...li-4, no=2833, id=3187, vol=2.706960e+01 assign (segid " " and resid 104 and name HB2) (segid " " and resid 104 and name HD2) 3.122 1.218 1.218 weight 1.000 ! spec=c13n...li-4, no=2835, id=3189, vol=3.115380e+01 assign (segid " " and resid 104 and name HB1) (segid " " and resid 104 and name HD2) 3.068 1.177 1.177 weight 1.000 ! spec=c13n...li-4, no=2845, id=3195, vol=3.456120e+01 assign (segid " " and resid 156 and name HB) (segid " " and resid 160 and name HD21) 3.100 1.201 2.900 weight 1.000 ! spec=c13n...li-4, no=2846, id=3196, vol=3.248630e+01 assign (segid " " and resid 99 and name HA) (segid " " and resid 102 and name HB2) 3.012 1.134 1.134 weight 1.000 ! spec=c13n...li-4, no=2849, id=3199, vol=3.864080e+01 assign (segid " " and resid 178 and name HB1) (segid " " and resid 179 and name HD2) 3.022 1.142 2.978 weight 1.000 ! spec=c13n...li-4, no=2851, id=3201, vol=3.786100e+01 assign (segid " " and resid 168 and name HB2) (segid " " and resid 167 and name HH2) 2.985 1.114 1.114 weight 1.000 ! spec=c13n...li-4, no=2858, id=3205, vol=4.077690e+01 assign (segid " " and resid 168 and name HB2) (segid " " and resid 168 and name HG2) 3.128 1.223 1.223 weight 1.000 ! spec=c13n...li-4, no=2860, id=3207, vol=3.079930e+01 assign (segid " " and resid 168 and name HB1) (segid " " and resid 168 and name HG2) 2.953 1.090 1.090 weight 1.000 ! spec=c13n...li-4, no=2861, id=3208, vol=4.351720e+01 assign (segid " " and resid 130 and name HB1) (segid " " and resid 166 and name HB1) 2.872 1.031 1.031 weight 1.000 ! spec=c13n...li-4, no=2866, id=3212, vol=5.137170e+01 assign (segid " " and resid 130 and name HB2) (segid " " and resid 170 and name HG21) 3.085 1.190 1.190 weight 1.000 ! spec=c13n...li-4, no=2868, id=3214, vol=3.344390e+01 or (segid " " and resid 130 and name HB2) (segid " " and resid 170 and name HG22) or (segid " " and resid 130 and name HB2) (segid " " and resid 170 and name HG23) assign (segid " " and resid 130 and name HB1) (segid " " and resid 127 and name HD12) 3.099 1.200 1.200 weight 1.000 ! spec=c13n...li-4, no=2870, id=3216, vol=3.255000e+01 or (segid " " and resid 127 and name HD11) (segid " " and resid 130 and name HB1) or (segid " " and resid 130 and name HB1) (segid " " and resid 127 and name HD13) assign (segid " " and resid 186 and name HB1) (segid " " and resid 172 and name HB1) 3.093 1.196 1.196 weight 1.000 ! spec=c13n...li-4, no=2871, id=3217, vol=3.291260e+01 assign (segid " " and resid 101 and name HB2) (segid " " and resid 101 and name HG2) 2.395 0.717 0.717 weight 1.000 ! spec=c13n...li-4, no=2873, id=3218, vol=1.526186e+02 assign (segid " " and resid 120 and name HG2) (segid " " and resid 143 and name HA) 3.030 1.147 2.970 weight 1.000 ! spec=c13n...li-4, no=2876, id=3220, vol=3.727800e+01 assign (segid " " and resid 161 and name HA) (segid " " and resid 161 and name HG2) 2.558 0.818 3.442 weight 1.000 ! spec=c13n...li-4, no=2878, id=3222, vol=1.029125e+02 assign (segid " " and resid 146 and name HE2) (segid " " and resid 146 and name HD2) 2.309 0.667 0.667 weight 1.000 ! spec=c13n...li-4, no=2881, id=3224, vol=1.901599e+02 assign (segid " " and resid 99 and name HE2) (segid " " and resid 99 and name HD2) 2.160 0.583 0.583 weight 1.000 ! spec=c13n...li-4, no=2883, id=3226, vol=2.836347e+02 assign (segid " " and resid 124 and name HG11) (segid " " and resid 139 and name HG22) 2.761 0.953 0.953 weight 1.000 ! spec=c13n...li-4, no=2885, id=3228, vol=6.506140e+01 or (segid " " and resid 124 and name HG11) (segid " " and resid 139 and name HG21) or (segid " " and resid 124 and name HG11) (segid " " and resid 139 and name HG23) assign (segid " " and resid 107 and name HD11) (segid " " and resid 186 and name HH2) 3.104 1.204 1.204 weight 1.000 ! spec=c13n...li-4, no=2892, id=3231, vol=3.223170e+01 assign (segid " " and resid 107 and name HD11) (segid " " and resid 167 and name HE3) 3.226 1.301 1.301 weight 1.000 ! spec=c13n...li-4, no=2893, id=3232, vol=2.558160e+01 assign (segid " " and resid 106 and name HD21) (segid " " and resid 103 and name HN) 3.098 1.199 1.199 weight 1.000 ! spec=c13n...li-4, no=2895, id=3234, vol=3.263800e+01 assign (segid " " and resid 127 and name HD11) (segid " " and resid 131 and name HD11) 1.880 0.442 4.120 weight 1.000 ! spec=c13n...li-4, no=2896, id=3235, vol=6.521362e+02 assign (segid " " and resid 159 and name HD22) (segid " " and resid 159 and name HA) 3.117 1.214 1.214 weight 1.000 ! spec=c13n...li-4, no=2900, id=3239, vol=3.144510e+01 or (segid " " and resid 159 and name HA) (segid " " and resid 159 and name HD21) or (segid " " and resid 159 and name HD23) (segid " " and resid 159 and name HA) or (segid " " and resid 159 and name HD12) (segid " " and resid 159 and name HA) or (segid " " and resid 159 and name HA) (segid " " and resid 159 and name HD11) or (segid " " and resid 159 and name HD13) (segid " " and resid 159 and name HA) assign (segid " " and resid 155 and name HG) (segid " " and resid 114 and name HZ) 3.112 1.210 1.210 weight 1.000 ! spec=c13n...li-4, no=2913, id=3249, vol=3.175040e+01 assign (segid " " and resid 132 and name HG12) (segid " " and resid 133 and name HA) 3.138 1.231 2.862 weight 1.000 ! spec=c13n...li-4, no=2914, id=3250, vol=3.019390e+01 assign (segid " " and resid 131 and name HD21) (segid " " and resid 159 and name HG) 2.900 1.051 3.100 weight 1.000 ! spec=c13n...li-4, no=2920, id=3256, vol=4.849290e+01 assign (segid " " and resid 107 and name HD11) (segid " " and resid 159 and name HG) 2.991 1.118 3.009 weight 1.000 ! spec=c13n...li-4, no=2921, id=3257, vol=4.031200e+01 assign (segid " " and resid 172 and name HG1) (segid " " and resid 172 and name HA) 3.097 1.199 1.199 weight 1.000 ! spec=c13n...li-4, no=2931, id=3262, vol=3.270330e+01 assign (segid " " and resid 172 and name HG1) (segid " " and resid 176 and name HB2) 3.121 1.218 1.218 weight 1.000 ! spec=c13n...li-4, no=2933, id=3264, vol=3.119260e+01 assign (segid " " and resid 173 and name HD12) (segid " " and resid 170 and name HA) 2.353 0.692 0.692 weight 1.000 ! spec=c13n...li-4, no=2939, id=3269, vol=1.698595e+02 or (segid " " and resid 170 and name HA) (segid " " and resid 173 and name HD11) or (segid " " and resid 173 and name HD13) (segid " " and resid 170 and name HA) assign (segid " " and resid 102 and name HG2) (segid " " and resid 105 and name HD21) 2.509 0.787 0.787 weight 1.000 ! spec=c13n...li-4, no=2940, id=3270, vol=1.156275e+02 assign (segid " " and resid 185 and name HD22) (segid " " and resid 185 and name HA) 2.562 0.821 0.821 weight 1.000 ! spec=c13n...li-4, no=2941, id=3271, vol=1.018649e+02 or (segid " " and resid 185 and name HA) (segid " " and resid 185 and name HD21) or (segid " " and resid 185 and name HD23) (segid " " and resid 185 and name HA) assign (segid " " and resid 131 and name HD21) (segid " " and resid 162 and name HB1) 3.078 1.184 2.922 weight 1.000 ! spec=c13n...li-4, no=2942, id=3272, vol=3.388780e+01 assign (segid " " and resid 114 and name HB2) (segid " " and resid 156 and name HG22) 3.035 1.152 1.152 weight 1.000 ! spec=c13n...li-4, no=2943, id=3273, vol=3.687520e+01 or (segid " " and resid 114 and name HB2) (segid " " and resid 156 and name HG21) or (segid " " and resid 114 and name HB2) (segid " " and resid 156 and name HG23) assign (segid " " and resid 145 and name HG21) (segid " " and resid 142 and name HA) 3.022 1.142 1.142 weight 1.000 ! spec=c13n...li-4, no=2944, id=3274, vol=3.781890e+01 assign (segid " " and resid 188 and name HG11) (segid " " and resid 103 and name HD1) 3.047 1.161 1.161 weight 1.000 ! spec=c13n...li-4, no=2949, id=3278, vol=3.600220e+01 assign (segid " " and resid 107 and name HD21) (segid " " and resid 167 and name HE3) 3.051 1.163 2.949 weight 1.000 ! spec=c13n...li-4, no=2950, id=3279, vol=3.578190e+01 assign (segid " " and resid 107 and name HD21) (segid " " and resid 186 and name HH2) 3.081 1.186 1.186 weight 1.000 ! spec=c13n...li-4, no=2951, id=3280, vol=3.373850e+01 assign (segid " " and resid 169 and name HG2) (segid " " and resid 188 and name HG12) 2.387 0.712 0.712 weight 1.000 ! spec=c13n...li-4, no=2954, id=3283, vol=1.558819e+02 or (segid " " and resid 169 and name HG2) (segid " " and resid 188 and name HG11) or (segid " " and resid 169 and name HG2) (segid " " and resid 188 and name HG13) assign (segid " " and resid 148 and name HE1) (segid " " and resid 119 and name HA) 2.990 1.118 1.118 weight 1.000 ! spec=c13n...li-4, no=2955, id=3284, vol=4.032960e+01 assign (segid " " and resid 148 and name HE1) (segid " " and resid 147 and name HA1) 3.038 1.154 2.962 weight 1.000 ! spec=c13n...li-4, no=2956, id=3285, vol=3.667510e+01 assign (segid " " and resid 148 and name HE2) (segid " " and resid 147 and name HA1) 3.066 1.175 1.175 weight 1.000 ! spec=c13n...li-4, no=2957, id=3286, vol=3.467830e+01 or (segid " " and resid 148 and name HE1) (segid " " and resid 147 and name HA1) or (segid " " and resid 148 and name HE3) (segid " " and resid 147 and name HA1) assign (segid " " and resid 152 and name HB1) (segid " " and resid 118 and name HD11) 3.113 1.212 2.887 weight 1.000 ! spec=c13n...li-4, no=2958, id=3287, vol=3.166370e+01 assign (segid " " and resid 150 and name HB2) (segid " " and resid 150 and name HN) 3.080 1.186 1.186 weight 1.000 ! spec=c13n...li-4, no=2959, id=3288, vol=3.376870e+01 or (segid " " and resid 150 and name HN) (segid " " and resid 150 and name HB1) or (segid " " and resid 150 and name HB3) (segid " " and resid 150 and name HN) assign (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HG22) 3.025 1.144 1.144 weight 1.000 ! spec=c13n...li-4, no=2960, id=3289, vol=3.763360e+01 or (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HG21) or (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HG23) assign (segid " " and resid 118 and name HG22) (segid " " and resid 119 and name HA) 3.133 1.227 1.227 weight 1.000 ! spec=c13n...li-4, no=2961, id=3290, vol=3.047770e+01 or (segid " " and resid 119 and name HA) (segid " " and resid 118 and name HG21) or (segid " " and resid 118 and name HG23) (segid " " and resid 119 and name HA) assign (segid " " and resid 124 and name HD11) (segid " " and resid 124 and name HB) 2.208 0.609 0.609 weight 1.000 ! spec=c13n...li-4, no=2964, id=3293, vol=2.489317e+02 assign (segid " " and resid 123 and name HD11) (segid " " and resid 152 and name HA) 3.152 1.242 2.848 weight 1.000 ! spec=c13n...li-4, no=2967, id=3295, vol=2.942960e+01 assign (segid " " and resid 123 and name HD11) (segid " " and resid 114 and name HE1) 3.064 1.173 1.173 weight 1.000 ! spec=c13n...li-4, no=2968, id=3296, vol=3.485740e+01 assign (segid " " and resid 97 and name HD11) (segid " " and resid 96 and name HA) 3.109 1.208 2.891 weight 1.000 ! spec=c13n...li-4, no=2970, id=3298, vol=3.194980e+01 assign (segid " " and resid 123 and name HA) (segid " " and resid 175 and name HD21) 2.647 0.876 0.876 weight 1.000 ! spec=c13n...li-4, no=2977, id=3304, vol=8.374520e+01 assign (segid " " and resid 167 and name HA) (segid " " and resid 167 and name HD1) 3.260 1.329 1.329 weight 1.000 ! spec=c13n...li-4, no=2979, id=3306, vol=2.400860e+01 assign (segid " " and resid 104 and name HA) (segid " " and resid 107 and name HB1) 2.757 0.950 0.950 weight 1.000 ! spec=c13n...li-4, no=2980, id=3307, vol=6.561860e+01 assign (segid " " and resid 107 and name HA) (segid " " and resid 186 and name HZ3) 3.208 1.286 1.286 weight 1.000 ! spec=c13n...li-4, no=2984, id=3309, vol=2.647600e+01 assign (segid " " and resid 181 and name HD2) (segid " " and resid 181 and name HA) 2.323 0.674 0.674 weight 1.000 ! spec=c13n...li-4, no=2992, id=3317, vol=1.836855e+02 assign (segid " " and resid 119 and name HA) (segid " " and resid 152 and name HA) 3.045 1.159 2.955 weight 1.000 ! spec=c13n...li-4, no=2995, id=3320, vol=3.620070e+01 assign (segid " " and resid 98 and name HA) (segid " " and resid 98 and name HB2) 2.098 0.550 0.550 weight 1.000 ! spec=c13n...li-4, no=2996, id=3321, vol=3.385033e+02 assign (segid " " and resid 110 and name HA) (segid " " and resid 182 and name HE1) 3.150 1.240 1.240 weight 1.000 ! spec=c13n...li-4, no=2998, id=3323, vol=2.952520e+01 assign (segid " " and resid 127 and name HA) (segid " " and resid 127 and name HB1) 2.334 0.681 0.681 weight 1.000 ! spec=c13n...li-4, no=3000, id=3324, vol=1.782070e+02 assign (segid " " and resid 131 and name HA) (segid " " and resid 132 and name HG22) 3.128 1.223 1.223 weight 1.000 ! spec=c13n...li-4, no=3002, id=3326, vol=3.077760e+01 or (segid " " and resid 131 and name HA) (segid " " and resid 132 and name HG21) or (segid " " and resid 131 and name HA) (segid " " and resid 132 and name HG23) assign (segid " " and resid 120 and name HD1) (segid " " and resid 152 and name HA) 3.092 1.195 1.195 weight 1.000 ! spec=c13n...li-4, no=3004, id=3327, vol=3.296620e+01 assign (segid " " and resid 168 and name HD1) (segid " " and resid 167 and name HD1) 3.238 1.311 2.762 weight 1.000 ! spec=c13n...li-4, no=3007, id=3329, vol=2.501740e+01 assign (segid " " and resid 147 and name HA2) (segid " " and resid 150 and name HB2) 3.215 1.292 1.292 weight 1.000 ! spec=c13n...li-4, no=3009, id=3331, vol=2.610080e+01 or (segid " " and resid 147 and name HA2) (segid " " and resid 150 and name HB1) or (segid " " and resid 147 and name HA2) (segid " " and resid 150 and name HB3) assign (segid " " and resid 147 and name HA1) (segid " " and resid 150 and name HB1) 3.309 1.368 1.368 weight 1.000 ! spec=c13n...li-4, no=3010, id=3332, vol=2.198400e+01 assign (segid " " and resid 109 and name HD2) (segid " " and resid 105 and name HD12) 2.716 0.922 0.922 weight 1.000 ! spec=c13n...li-4, no=3012, id=3334, vol=7.180350e+01 or (segid " " and resid 109 and name HD2) (segid " " and resid 105 and name HD11) or (segid " " and resid 109 and name HD2) (segid " " and resid 105 and name HD13) assign (segid " " and resid 117 and name HD2) (segid " " and resid 182 and name HD1) 2.641 0.872 3.359 weight 1.000 ! spec=c13n...li-4, no=3013, id=3335, vol=8.488820e+01 assign (segid " " and resid 169 and name HE2) (segid " " and resid 168 and name HD1) 2.695 0.908 0.908 weight 1.000 ! spec=c13n...li-4, no=3021, id=3342, vol=7.519300e+01 assign (segid " " and resid 103 and name HB1) (segid " " and resid 186 and name HH2) 3.213 1.291 1.291 weight 1.000 ! spec=c13n...li-4, no=3025, id=3346, vol=2.618620e+01 assign (segid " " and resid 137 and name HG2) (segid " " and resid 136 and name HB2) 3.273 1.339 1.339 weight 1.000 ! spec=c13n...li-4, no=3026, id=3347, vol=2.343310e+01 assign (segid " " and resid 129 and name HB2) (segid " " and resid 129 and name HG2) 2.060 0.530 3.940 weight 1.000 ! spec=c13n...li-4, no=3028, id=3349, vol=3.773359e+02 assign (segid " " and resid 118 and name HB) (segid " " and resid 123 and name HG21) 3.108 1.208 2.892 weight 1.000 ! spec=c13n...li-4, no=3033, id=3351, vol=3.198020e+01 assign (segid " " and resid 157 and name HG2) (segid " " and resid 157 and name HG1) 1.844 0.425 0.425 weight 1.000 ! spec=c13n...li-4, no=3035, id=3353, vol=7.327508e+02 assign (segid " " and resid 186 and name HH2) (segid " " and resid 186 and name HZ2) 2.638 0.870 0.870 weight 1.000 ! spec=c13n...ro-1, no=4, id=3360, vol=1.885450e+01 assign (segid " " and resid 182 and name HE1) (segid " " and resid 186 and name HE3) 2.751 0.946 3.249 weight 1.000 ! spec=c13n...ro-1, no=8, id=3362, vol=1.464950e+01 assign (segid " " and resid 182 and name HE1) (segid " " and resid 182 and name HD1) 2.225 0.619 0.619 weight 1.000 ! spec=c13n...ro-1, no=13, id=3363, vol=5.242060e+01 assign (segid " " and resid 182 and name HD1) (segid " " and resid 116 and name HN) 2.718 0.923 3.282 weight 1.000 ! spec=c13n...ro-1, no=15, id=3364, vol=1.576430e+01 assign (segid " " and resid 172 and name HB1) (segid " " and resid 186 and name HD1) 2.663 0.887 0.887 weight 1.000 ! spec=c13n...ro-1, no=22, id=3368, vol=1.780950e+01 assign (segid " " and resid 114 and name HE1) (segid " " and resid 114 and name HZ) 2.342 0.686 0.686 weight 1.000 ! spec=c13n...ro-1, no=29, id=3372, vol=3.845320e+01 assign (segid " " and resid 114 and name HE1) (segid " " and resid 155 and name HD11) 2.469 0.762 0.762 weight 1.000 ! spec=c13n...ro-1, no=31, id=3374, vol=2.803200e+01 assign (segid " " and resid 171 and name HD21) (segid " " and resid 114 and name HZ) 2.502 0.783 3.498 weight 1.000 ! spec=c13n...ro-1, no=34, id=3376, vol=2.589680e+01 assign (segid " " and resid 103 and name HD1) (segid " " and resid 103 and name HE1) 2.131 0.567 0.567 weight 1.000 ! spec=c13n...ro-1, no=35, id=3377, vol=6.790420e+01 assign (segid " " and resid 188 and name HG11) (segid " " and resid 103 and name HE1) 2.612 0.853 3.388 weight 1.000 ! spec=c13n...ro-1, no=38, id=3379, vol=2.002070e+01 assign (segid " " and resid 114 and name HE1) (segid " " and resid 114 and name HD1) 2.302 0.663 0.663 weight 1.000 ! spec=c13n...ro-1, no=39, id=3380, vol=4.265700e+01 assign (segid " " and resid 114 and name HD2) (segid " " and resid 107 and name HD21) 2.481 0.769 3.519 weight 1.000 ! spec=c13n...ro-1, no=43, id=3383, vol=2.726190e+01 assign (segid " " and resid 167 and name HD1) (segid " " and resid 164 and name HB2) 2.986 1.115 3.014 weight 1.000 ! spec=c13n...ro-1, no=46, id=3385, vol=8.956400e+00 assign (segid " " and resid 167 and name HD1) (segid " " and resid 100 and name HD11) 2.905 1.055 3.095 weight 1.000 ! spec=c13n...ro-1, no=47, id=3386, vol=1.058020e+01 assign (segid " " and resid 186 and name HD1) (segid " " and resid 188 and name HG11) 2.937 1.078 1.078 weight 1.000 ! spec=c13n...ro-1, no=50, id=3388, vol=9.908100e+00 assign (segid " " and resid 103 and name HE1) (segid " " and resid 99 and name HE2) 3.079 1.185 2.921 weight 1.000 ! spec=c13n...ro-1, no=53, id=3391, vol=7.453300e+00 assign (segid " " and resid 103 and name HE1) (segid " " and resid 99 and name HB2) 2.924 1.068 3.076 weight 1.000 ! spec=c13n...ro-1, no=54, id=3392, vol=1.017590e+01 assign (segid " " and resid 103 and name HE1) (segid " " and resid 188 and name HB) 2.923 1.068 3.077 weight 1.000 ! spec=c13n...ro-1, no=55, id=3393, vol=1.018710e+01 assign (segid " " and resid 103 and name HE1) (segid " " and resid 106 and name HD21) 3.189 1.272 2.811 weight 1.000 ! spec=c13n...ro-1, no=57, id=3395, vol=6.036400e+00 assign (segid " " and resid 103 and name HD1) (segid " " and resid 168 and name HG2) 3.006 1.129 2.994 weight 1.000 ! spec=c13n...ro-1, no=58, id=3396, vol=8.612900e+00 assign (segid " " and resid 103 and name HD1) (segid " " and resid 106 and name HD21) 2.957 1.093 1.093 weight 1.000 ! spec=c13n...ro-1, no=60, id=3398, vol=9.498200e+00 assign (segid " " and resid 103 and name HD1) (segid " " and resid 168 and name HB1) 2.937 1.078 1.078 weight 1.000 ! spec=c13n...ro-1, no=61, id=3399, vol=9.896700e+00 assign (segid " " and resid 106 and name HD11) (segid " " and resid 103 and name HD1) 3.059 1.169 2.941 weight 1.000 ! spec=c13n...ro-1, no=62, id=3400, vol=7.760500e+00 assign (segid " " and resid 114 and name HE1) (segid " " and resid 118 and name HG12) 2.896 1.048 1.048 weight 1.000 ! spec=c13n...ro-1, no=71, id=3408, vol=1.077040e+01 assign (segid " " and resid 114 and name HZ) (segid " " and resid 171 and name HB1) 3.134 1.228 2.866 weight 1.000 ! spec=c13n...ro-1, no=74, id=3410, vol=6.700800e+00 assign (segid " " and resid 106 and name HD21) (segid " " and resid 186 and name HZ2) 2.968 1.101 3.032 weight 1.000 ! spec=c13n...ro-1, no=77, id=3413, vol=9.303400e+00 assign (segid " " and resid 182 and name HD1) (segid " " and resid 117 and name HB2) 2.958 1.093 1.093 weight 1.000 ! spec=c13n...ro-1, no=81, id=3417, vol=9.490400e+00 assign (segid " " and resid 175 and name HD11) (segid " " and resid 186 and name HD1) 3.124 1.220 1.220 weight 1.000 ! spec=c13n...ro-1, no=86, id=3421, vol=6.839800e+00 assign (segid " " and resid 167 and name HD1) (segid " " and resid 168 and name HD2) 2.734 0.935 0.935 weight 1.000 ! spec=c13n...ro-1, no=87, id=3422, vol=1.519880e+01 assign (segid " " and resid 167 and name HD1) (segid " " and resid 100 and name HD12) 3.081 1.186 1.186 weight 1.000 ! spec=c13n...ro-1, no=89, id=3424, vol=7.431500e+00 or (segid " " and resid 167 and name HD1) (segid " " and resid 100 and name HD11) or (segid " " and resid 167 and name HD1) (segid " " and resid 100 and name HD13) assign (segid " " and resid 186 and name HZ3) (segid " " and resid 103 and name HA) 3.154 1.244 2.846 weight 1.000 ! spec=c13n...ro-1, no=94, id=3428, vol=6.449900e+00 assign (segid " " and resid 186 and name HZ3) (segid " " and resid 106 and name HD11) 2.847 1.013 1.013 weight 1.000 ! spec=c13n...ro-1, no=96, id=3430, vol=1.193900e+01 assign (segid " " and resid 186 and name HZ3) (segid " " and resid 186 and name HZ2) 3.129 1.224 2.871 weight 1.000 ! spec=c13n...ro-1, no=99, id=3433, vol=6.767300e+00 assign (segid " " and resid 103 and name HE1) (segid " " and resid 99 and name HG2) 3.211 1.289 2.789 weight 1.000 ! spec=c13n...ro-1, no=100, id=3434, vol=5.798800e+00 assign (segid " " and resid 186 and name HZ3) (segid " " and resid 186 and name HH2) 2.996 1.122 1.122 weight 1.000 ! spec=c13n...ro-1, no=101, id=3435, vol=8.788300e+00 assign (segid " " and resid 107 and name HA) (segid " " and resid 186 and name HH2) 3.037 1.153 1.153 weight 1.000 ! spec=c13n...ro-1, no=102, id=3436, vol=8.091000e+00 assign (segid " " and resid 103 and name HB2) (segid " " and resid 186 and name HH2) 3.076 1.182 1.182 weight 1.000 ! spec=c13n...ro-1, no=103, id=3437, vol=7.506600e+00 assign (segid " " and resid 186 and name HH2) (segid " " and resid 106 and name HD21) 3.269 1.335 1.335 weight 1.000 ! spec=c13n...ro-1, no=106, id=3440, vol=5.210600e+00 assign (segid " " and resid 119 and name HN) (segid " " and resid 119 and name HA) 3.147 1.238 1.238 weight 1.000 ! spec=n15n...hn-2, no=20, id=0, vol=3.328000e-01 assign (segid " " and resid 119 and name HN) (segid " " and resid 118 and name HA) 2.261 0.639 0.639 weight 1.000 ! spec=n15n...hn-2, no=21, id=1, vol=2.420900e+00 assign (segid " " and resid 119 and name HN) (segid " " and resid 119 and name HB) 2.628 0.863 0.863 weight 1.000 ! spec=n15n...hn-2, no=22, id=2, vol=9.818000e-01 assign (segid " " and resid 119 and name HN) (segid " " and resid 119 and name HG12) 3.020 1.140 1.140 weight 1.000 ! spec=n15n...hn-2, no=52, id=3, vol=4.261000e-01 assign (segid " " and resid 119 and name HN) (segid " " and resid 118 and name HB) 2.933 1.075 3.067 weight 1.000 ! spec=n15n...hn-2, no=53, id=4, vol=5.078000e-01 assign (segid " " and resid 119 and name HN) (segid " " and resid 118 and name HG21) 2.810 0.987 0.987 weight 1.000 ! spec=n15n...hn-2, no=54, id=5, vol=6.570000e-01 assign (segid " " and resid 121 and name HN) (segid " " and resid 121 and name HA) 2.968 1.101 1.101 weight 1.000 ! spec=n15n...hn-2, no=85, id=7, vol=4.730000e-01 assign (segid " " and resid 121 and name HN) (segid " " and resid 120 and name HB2) 2.735 0.935 0.935 weight 1.000 ! spec=n15n...hn-2, no=88, id=10, vol=7.727000e-01 assign (segid " " and resid 121 and name HN) (segid " " and resid 121 and name HG21) 2.374 0.705 0.705 weight 1.000 ! spec=n15n...hn-2, no=89, id=11, vol=1.803700e+00 assign (segid " " and resid 121 and name HN) (segid " " and resid 124 and name HG21) 2.442 0.746 3.558 weight 1.000 ! spec=n15n...hn-2, no=90, id=12, vol=1.522700e+00 assign (segid " " and resid 121 and name HN) (segid " " and resid 124 and name HD11) 3.027 1.145 1.145 weight 1.000 ! spec=n15n...hn-2, no=91, id=13, vol=4.203000e-01 assign (segid " " and resid 163 and name HN) (segid " " and resid 163 and name HA) 2.789 0.972 0.972 weight 1.000 ! spec=n15n...hn-2, no=98, id=15, vol=6.871000e-01 assign (segid " " and resid 163 and name HN) (segid " " and resid 162 and name HA) 2.202 0.606 0.606 weight 1.000 ! spec=n15n...hn-2, no=99, id=16, vol=2.836700e+00 assign (segid " " and resid 163 and name HN) (segid " " and resid 162 and name HB2) 3.064 1.174 1.174 weight 1.000 ! spec=n15n...hn-2, no=100, id=17, vol=3.904000e-01 assign (segid " " and resid 163 and name HN) (segid " " and resid 163 and name HB2) 2.829 1.000 1.000 weight 1.000 ! spec=n15n...hn-2, no=101, id=18, vol=6.313000e-01 assign (segid " " and resid 163 and name HN) (segid " " and resid 163 and name HB1) 2.800 0.980 0.980 weight 1.000 ! spec=n15n...hn-2, no=102, id=19, vol=6.704000e-01 assign (segid " " and resid 190 and name HN) (segid " " and resid 189 and name HA) 1.941 0.471 0.471 weight 1.000 ! spec=n15n...hn-2, no=105, id=21, vol=6.042100e+00 assign (segid " " and resid 190 and name HN) (segid " " and resid 190 and name HA) 2.474 0.765 0.765 weight 1.000 ! spec=n15n...hn-2, no=107, id=23, vol=1.410600e+00 assign (segid " " and resid 190 and name HN) (segid " " and resid 189 and name HG2) 2.997 1.123 1.123 weight 1.000 ! spec=n15n...hn-2, no=108, id=24, vol=4.457000e-01 assign (segid " " and resid 190 and name HN) (segid " " and resid 189 and name HB1) 2.824 0.997 3.176 weight 1.000 ! spec=n15n...hn-2, no=109, id=25, vol=6.374000e-01 assign (segid " " and resid 190 and name HN) (segid " " and resid 189 and name HB2) 2.689 0.904 3.311 weight 1.000 ! spec=n15n...hn-2, no=110, id=26, vol=8.547000e-01 assign (segid " " and resid 190 and name HN) (segid " " and resid 190 and name HB2) 2.429 0.737 0.737 weight 1.000 ! spec=n15n...hn-2, no=111, id=27, vol=1.575400e+00 assign (segid " " and resid 190 and name HN) (segid " " and resid 190 and name HG2) 2.642 0.873 0.873 weight 1.000 ! spec=n15n...hn-2, no=112, id=28, vol=9.503000e-01 assign (segid " " and resid 186 and name HE1) (segid " " and resid 186 and name HZ2) 2.934 1.076 1.076 weight 1.000 ! spec=n15n...hn-2, no=118, id=30, vol=5.066000e-01 assign (segid " " and resid 186 and name HE1) (segid " " and resid 186 and name HD1) 2.712 0.919 0.919 weight 1.000 ! spec=n15n...hn-2, no=119, id=31, vol=8.126000e-01 assign (segid " " and resid 186 and name HE1) (segid " " and resid 168 and name HA) 2.926 1.070 1.070 weight 1.000 ! spec=n15n...hn-2, no=120, id=32, vol=5.154000e-01 assign (segid " " and resid 186 and name HE1) (segid " " and resid 171 and name HB2) 3.069 1.178 1.178 weight 1.000 ! spec=n15n...hn-2, no=121, id=33, vol=3.867000e-01 assign (segid " " and resid 186 and name HE1) (segid " " and resid 188 and name HG11) 2.849 1.015 1.015 weight 1.000 ! spec=n15n...hn-2, no=122, id=34, vol=6.042000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 151 and name HA2) 2.586 0.836 0.836 weight 1.000 ! spec=n15n...hn-2, no=125, id=36, vol=1.081500e+00 assign (segid " " and resid 152 and name HN) (segid " " and resid 152 and name HA) 2.754 0.948 0.948 weight 1.000 ! spec=n15n...hn-2, no=126, id=37, vol=7.409000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 151 and name HA1) 3.059 1.169 1.169 weight 1.000 ! spec=n15n...hn-2, no=127, id=38, vol=3.948000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 120 and name HG2) 3.064 1.174 1.174 weight 1.000 ! spec=n15n...hn-2, no=128, id=39, vol=3.907000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 120 and name HG1) 3.030 1.147 1.147 weight 1.000 ! spec=n15n...hn-2, no=129, id=40, vol=4.181000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 152 and name HB1) 2.290 0.656 0.656 weight 1.000 ! spec=n15n...hn-2, no=130, id=41, vol=2.241200e+00 assign (segid " " and resid 152 and name HN) (segid " " and resid 155 and name HD11) 3.101 1.202 1.202 weight 1.000 ! spec=n15n...hn-2, no=131, id=42, vol=3.633000e-01 assign (segid " " and resid 187 and name HN) (segid " " and resid 186 and name HA) 2.297 0.659 0.659 weight 1.000 ! spec=n15n...hn-2, no=141, id=44, vol=2.202100e+00 assign (segid " " and resid 187 and name HN) (segid " " and resid 187 and name HA) 2.888 1.042 1.042 weight 1.000 ! spec=n15n...hn-2, no=142, id=45, vol=5.573000e-01 assign (segid " " and resid 187 and name HN) (segid " " and resid 187 and name HB) 2.440 0.744 0.744 weight 1.000 ! spec=n15n...hn-2, no=143, id=46, vol=1.533800e+00 assign (segid " " and resid 187 and name HN) (segid " " and resid 187 and name HG12) 2.948 1.086 1.086 weight 1.000 ! spec=n15n...hn-2, no=144, id=47, vol=4.929000e-01 assign (segid " " and resid 187 and name HN) (segid " " and resid 187 and name HG11) 2.633 0.867 0.867 weight 1.000 ! spec=n15n...hn-2, no=145, id=48, vol=9.694000e-01 assign (segid " " and resid 187 and name HN) (segid " " and resid 187 and name HD11) 2.762 0.953 0.953 weight 1.000 ! spec=n15n...hn-2, no=146, id=49, vol=7.284000e-01 assign (segid " " and resid 98 and name HN) (segid " " and resid 97 and name HN) 2.953 1.090 1.090 weight 1.000 ! spec=n15n...hn-2, no=148, id=51, vol=4.879000e-01 assign (segid " " and resid 98 and name HN) (segid " " and resid 98 and name HA) 2.692 0.906 0.906 weight 1.000 ! spec=n15n...hn-2, no=151, id=52, vol=8.499000e-01 assign (segid " " and resid 98 and name HN) (segid " " and resid 97 and name HA) 2.353 0.692 3.647 weight 1.000 ! spec=n15n...hn-2, no=152, id=53, vol=1.902900e+00 assign (segid " " and resid 98 and name HN) (segid " " and resid 98 and name HG2) 2.836 1.005 1.005 weight 1.000 ! spec=n15n...hn-2, no=153, id=54, vol=6.219000e-01 assign (segid " " and resid 98 and name HN) (segid " " and resid 98 and name HB2) 2.615 0.854 0.854 weight 1.000 ! spec=n15n...hn-2, no=154, id=55, vol=1.012000e+00 assign (segid " " and resid 98 and name HN) (segid " " and resid 97 and name HB) 2.868 1.028 1.028 weight 1.000 ! spec=n15n...hn-2, no=155, id=56, vol=5.806000e-01 assign (segid " " and resid 189 and name HN) (segid " " and resid 188 and name HA) 2.110 0.556 0.556 weight 1.000 ! spec=n15n...hn-2, no=166, id=59, vol=3.668200e+00 assign (segid " " and resid 189 and name HN) (segid " " and resid 189 and name HG2) 2.820 0.994 0.994 weight 1.000 ! spec=n15n...hn-2, no=167, id=60, vol=6.429000e-01 assign (segid " " and resid 189 and name HN) (segid " " and resid 189 and name HB2) 2.695 0.908 0.908 weight 1.000 ! spec=n15n...hn-2, no=168, id=61, vol=8.442000e-01 assign (segid " " and resid 189 and name HN) (segid " " and resid 189 and name HB1) 2.496 0.779 0.779 weight 1.000 ! spec=n15n...hn-2, no=169, id=62, vol=1.337300e+00 assign (segid " " and resid 189 and name HN) (segid " " and resid 188 and name HB) 2.855 1.019 1.019 weight 1.000 ! spec=n15n...hn-2, no=170, id=63, vol=5.966000e-01 assign (segid " " and resid 189 and name HN) (segid " " and resid 187 and name HG21) 3.152 1.242 1.242 weight 1.000 ! spec=n15n...hn-2, no=171, id=64, vol=3.297000e-01 assign (segid " " and resid 189 and name HN) (segid " " and resid 188 and name HG11) 2.626 0.862 3.374 weight 1.000 ! spec=n15n...hn-2, no=172, id=65, vol=9.864000e-01 assign (segid " " and resid 133 and name HN) (segid " " and resid 132 and name HA) 2.889 1.044 1.044 weight 1.000 ! spec=n15n...hn-2, no=174, id=67, vol=5.556000e-01 assign (segid " " and resid 133 and name HN) (segid " " and resid 133 and name HA) 2.998 1.123 1.123 weight 1.000 ! spec=n15n...hn-2, no=175, id=68, vol=4.454000e-01 assign (segid " " and resid 133 and name HN) (segid " " and resid 133 and name HB2) 3.095 1.197 1.197 weight 1.000 ! spec=n15n...hn-2, no=176, id=69, vol=3.678000e-01 assign (segid " " and resid 133 and name HN) (segid " " and resid 132 and name HB) 3.031 1.148 1.148 weight 1.000 ! spec=n15n...hn-2, no=177, id=70, vol=4.169000e-01 assign (segid " " and resid 165 and name HN) (segid " " and resid 164 and name HA) 2.111 0.557 0.557 weight 1.000 ! spec=n15n...hn-2, no=181, id=72, vol=3.654600e+00 assign (segid " " and resid 165 and name HN) (segid " " and resid 165 and name HA) 2.612 0.853 0.853 weight 1.000 ! spec=n15n...hn-2, no=182, id=73, vol=1.017200e+00 assign (segid " " and resid 165 and name HN) (segid " " and resid 165 and name HG2) 2.764 0.955 0.955 weight 1.000 ! spec=n15n...hn-2, no=183, id=74, vol=7.255000e-01 assign (segid " " and resid 165 and name HN) (segid " " and resid 165 and name HB2) 2.210 0.610 0.610 weight 1.000 ! spec=n15n...hn-2, no=184, id=75, vol=2.776400e+00 assign (segid " " and resid 165 and name HN) (segid " " and resid 100 and name HG) 2.811 0.987 0.987 weight 1.000 ! spec=n15n...hn-2, no=186, id=76, vol=6.558000e-01 assign (segid " " and resid 167 and name HN) (segid " " and resid 167 and name HD1) 2.752 0.947 0.947 weight 1.000 ! spec=n15n...hn-2, no=188, id=77, vol=7.435000e-01 assign (segid " " and resid 167 and name HN) (segid " " and resid 166 and name HA) 2.996 1.122 1.122 weight 1.000 ! spec=n15n...hn-2, no=189, id=78, vol=4.473000e-01 assign (segid " " and resid 167 and name HN) (segid " " and resid 167 and name HA) 2.723 0.927 0.927 weight 1.000 ! spec=n15n...hn-2, no=190, id=79, vol=7.927000e-01 assign (segid " " and resid 167 and name HN) (segid " " and resid 167 and name HB1) 2.749 0.945 0.945 weight 1.000 ! spec=n15n...hn-2, no=191, id=80, vol=7.491000e-01 assign (segid " " and resid 167 and name HN) (segid " " and resid 167 and name HB2) 2.605 0.849 3.395 weight 1.000 ! spec=n15n...hn-2, no=192, id=81, vol=1.033400e+00 assign (segid " " and resid 167 and name HN) (segid " " and resid 168 and name HD2) 2.700 0.911 0.911 weight 1.000 ! spec=n15n...hn-2, no=193, id=82, vol=8.339000e-01 assign (segid " " and resid 167 and name HN) (segid " " and resid 168 and name HD1) 2.705 0.914 0.914 weight 1.000 ! spec=n15n...hn-2, no=194, id=83, vol=8.256000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 139 and name HN) 3.117 1.215 2.883 weight 1.000 ! spec=n15n...hn-2, no=201, id=86, vol=3.522000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 141 and name HA) 2.993 1.120 1.120 weight 1.000 ! spec=n15n...hn-2, no=202, id=87, vol=4.500000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 142 and name HA) 2.730 0.932 0.932 weight 1.000 ! spec=n15n...hn-2, no=203, id=88, vol=7.806000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 139 and name HA) 3.138 1.231 1.231 weight 1.000 ! spec=n15n...hn-2, no=204, id=89, vol=3.385000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 141 and name HB2) 2.540 0.806 0.806 weight 1.000 ! spec=n15n...hn-2, no=205, id=90, vol=1.204400e+00 assign (segid " " and resid 142 and name HN) (segid " " and resid 142 and name HB) 2.324 0.675 0.675 weight 1.000 ! spec=n15n...hn-2, no=206, id=91, vol=2.051700e+00 assign (segid " " and resid 142 and name HN) (segid " " and resid 142 and name HG11) 2.697 0.909 3.303 weight 1.000 ! spec=n15n...hn-2, no=207, id=92, vol=8.408000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 142 and name HD11) 2.428 0.737 0.737 weight 1.000 ! spec=n15n...hn-2, no=208, id=93, vol=1.577400e+00 assign (segid " " and resid 95 and name HN) (segid " " and resid 94 and name HA) 2.394 0.717 0.717 weight 1.000 ! spec=n15n...hn-2, no=210, id=94, vol=1.715500e+00 assign (segid " " and resid 95 and name HN) (segid " " and resid 94 and name HB2) 3.156 1.245 1.245 weight 1.000 ! spec=n15n...hn-2, no=211, id=95, vol=3.269000e-01 assign (segid " " and resid 96 and name HN) (segid " " and resid 97 and name HN) 2.958 1.093 3.042 weight 1.000 ! spec=n15n...hn-2, no=213, id=96, vol=4.829000e-01 assign (segid " " and resid 96 and name HN) (segid " " and resid 95 and name HA) 2.229 0.621 0.621 weight 1.000 ! spec=n15n...hn-2, no=215, id=97, vol=2.633200e+00 assign (segid " " and resid 96 and name HN) (segid " " and resid 95 and name HD2) 3.300 1.661 1.661 weight 1.000 ! spec=n15n...hn-2, no=216, id=98, vol=2.183500e+00 assign (segid " " and resid 96 and name HN) (segid " " and resid 96 and name HG2) 2.888 1.043 1.043 weight 1.000 ! spec=n15n...hn-2, no=217, id=99, vol=5.566000e-01 assign (segid " " and resid 174 and name HN) (segid " " and resid 174 and name HA) 2.457 0.754 0.754 weight 1.000 ! spec=n15n...hn-2, no=227, id=101, vol=1.470200e+00 assign (segid " " and resid 174 and name HN) (segid " " and resid 173 and name HB2) 2.699 0.911 0.911 weight 1.000 ! spec=n15n...hn-2, no=228, id=102, vol=8.356000e-01 assign (segid " " and resid 174 and name HN) (segid " " and resid 173 and name HB1) 2.739 0.938 0.938 weight 1.000 ! spec=n15n...hn-2, no=229, id=103, vol=7.650000e-01 assign (segid " " and resid 174 and name HN) (segid " " and resid 174 and name HB1) 2.121 0.562 0.562 weight 1.000 ! spec=n15n...hn-2, no=230, id=104, vol=3.551300e+00 assign (segid " " and resid 188 and name HN) (segid " " and resid 188 and name HA) 2.630 0.865 0.865 weight 1.000 ! spec=n15n...hn-2, no=234, id=106, vol=9.764000e-01 assign (segid " " and resid 188 and name HN) (segid " " and resid 187 and name HA) 2.086 0.544 0.544 weight 1.000 ! spec=n15n...hn-2, no=236, id=107, vol=3.922700e+00 assign (segid " " and resid 188 and name HN) (segid " " and resid 188 and name HB) 2.629 0.864 0.864 weight 1.000 ! spec=n15n...hn-2, no=237, id=108, vol=9.784000e-01 assign (segid " " and resid 188 and name HN) (segid " " and resid 187 and name HG21) 2.543 0.808 0.808 weight 1.000 ! spec=n15n...hn-2, no=238, id=109, vol=1.195600e+00 assign (segid " " and resid 188 and name HN) (segid " " and resid 188 and name HG11) 2.425 0.735 0.735 weight 1.000 ! spec=n15n...hn-2, no=239, id=110, vol=1.591200e+00 assign (segid " " and resid 111 and name HN) (segid " " and resid 112 and name HA) 3.056 1.167 2.944 weight 1.000 ! spec=n15n...hn-2, no=243, id=112, vol=3.970000e-01 assign (segid " " and resid 111 and name HN) (segid " " and resid 108 and name HA) 2.476 0.766 3.524 weight 1.000 ! spec=n15n...hn-2, no=244, id=113, vol=1.402500e+00 assign (segid " " and resid 111 and name HN) (segid " " and resid 112 and name HD2) 2.492 0.776 0.776 weight 1.000 ! spec=n15n...hn-2, no=245, id=114, vol=1.351100e+00 assign (segid " " and resid 111 and name HN) (segid " " and resid 111 and name HG2) 2.264 0.641 0.641 weight 1.000 ! spec=n15n...hn-2, no=246, id=115, vol=2.400000e+00 assign (segid " " and resid 182 and name HN) (segid " " and resid 182 and name HA) 3.045 1.159 1.159 weight 1.000 ! spec=n15n...hn-2, no=247, id=116, vol=4.058000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 182 and name HE1) 3.109 1.209 1.209 weight 1.000 ! spec=n15n...hn-2, no=251, id=119, vol=3.577000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 114 and name HA) 2.808 0.986 0.986 weight 1.000 ! spec=n15n...hn-2, no=253, id=121, vol=6.588000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 114 and name HB2) 2.653 0.880 0.880 weight 1.000 ! spec=n15n...hn-2, no=254, id=122, vol=9.265000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 114 and name HB1) 2.451 0.751 0.751 weight 1.000 ! spec=n15n...hn-2, no=255, id=123, vol=1.490700e+00 assign (segid " " and resid 177 and name HN) (segid " " and resid 176 and name HN) 2.576 0.830 0.830 weight 1.000 ! spec=n15n...hn-2, no=257, id=124, vol=1.105300e+00 assign (segid " " and resid 177 and name HN) (segid " " and resid 177 and name HA) 2.505 0.785 0.785 weight 1.000 ! spec=n15n...hn-2, no=262, id=127, vol=1.307700e+00 assign (segid " " and resid 97 and name HN) (segid " " and resid 97 and name HA) 2.431 0.739 0.739 weight 1.000 ! spec=n15n...hn-2, no=263, id=128, vol=1.567300e+00 assign (segid " " and resid 97 and name HN) (segid " " and resid 96 and name HA) 2.046 0.523 0.523 weight 1.000 ! spec=n15n...hn-2, no=264, id=129, vol=4.403500e+00 assign (segid " " and resid 177 and name HN) (segid " " and resid 176 and name HG2) 3.036 1.152 1.152 weight 1.000 ! spec=n15n...hn-2, no=265, id=130, vol=4.125000e-01 assign (segid " " and resid 177 and name HN) (segid " " and resid 176 and name HB2) 2.723 0.927 0.927 weight 1.000 ! spec=n15n...hn-2, no=266, id=131, vol=7.935000e-01 assign (segid " " and resid 177 and name HN) (segid " " and resid 176 and name HB1) 2.941 1.081 1.081 weight 1.000 ! spec=n15n...hn-2, no=267, id=132, vol=4.992000e-01 assign (segid " " and resid 177 and name HN) (segid " " and resid 177 and name HB2) 2.170 0.589 0.589 weight 1.000 ! spec=n15n...hn-2, no=268, id=133, vol=3.094500e+00 assign (segid " " and resid 177 and name HN) (segid " " and resid 176 and name HG1) 2.713 0.920 0.920 weight 1.000 ! spec=n15n...hn-2, no=269, id=134, vol=8.099000e-01 assign (segid " " and resid 97 and name HN) (segid " " and resid 97 and name HB) 2.249 0.632 3.751 weight 1.000 ! spec=n15n...hn-2, no=270, id=135, vol=2.496800e+00 assign (segid " " and resid 97 and name HN) (segid " " and resid 96 and name HB2) 2.422 0.734 0.734 weight 1.000 ! spec=n15n...hn-2, no=271, id=136, vol=1.599600e+00 assign (segid " " and resid 97 and name HN) (segid " " and resid 96 and name HD1) 3.013 1.135 1.135 weight 1.000 ! spec=n15n...hn-2, no=272, id=137, vol=4.319000e-01 assign (segid " " and resid 177 and name HN) (segid " " and resid 177 and name HD2) 2.966 1.100 1.100 weight 1.000 ! spec=n15n...hn-2, no=273, id=138, vol=4.750000e-01 assign (segid " " and resid 97 and name HN) (segid " " and resid 96 and name HG1) 3.106 1.206 1.206 weight 1.000 ! spec=n15n...hn-2, no=275, id=140, vol=3.602000e-01 assign (segid " " and resid 97 and name HN) (segid " " and resid 97 and name HG12) 2.686 0.902 0.902 weight 1.000 ! spec=n15n...hn-2, no=276, id=141, vol=8.602000e-01 assign (segid " " and resid 97 and name HN) (segid " " and resid 97 and name HD11) 2.673 0.893 0.893 weight 1.000 ! spec=n15n...hn-2, no=277, id=142, vol=8.856000e-01 assign (segid " " and resid 150 and name HN) (segid " " and resid 151 and name HN) 2.151 0.578 0.578 weight 1.000 ! spec=n15n...hn-2, no=278, id=143, vol=3.262300e+00 assign (segid " " and resid 150 and name HN) (segid " " and resid 149 and name HA) 2.680 0.898 0.898 weight 1.000 ! spec=n15n...hn-2, no=283, id=144, vol=8.727000e-01 assign (segid " " and resid 150 and name HN) (segid " " and resid 150 and name HA) 2.358 0.695 0.695 weight 1.000 ! spec=n15n...hn-2, no=284, id=145, vol=1.880000e+00 assign (segid " " and resid 150 and name HN) (segid " " and resid 149 and name HB2) 2.440 0.744 0.744 weight 1.000 ! spec=n15n...hn-2, no=285, id=146, vol=1.531000e+00 assign (segid " " and resid 150 and name HN) (segid " " and resid 149 and name HB1) 2.633 0.867 0.867 weight 1.000 ! spec=n15n...hn-2, no=286, id=147, vol=9.704000e-01 assign (segid " " and resid 150 and name HN) (segid " " and resid 150 and name HB1) 2.021 0.511 0.511 weight 1.000 ! spec=n15n...hn-2, no=287, id=148, vol=4.745100e+00 assign (segid " " and resid 150 and name HN) (segid " " and resid 142 and name HG21) 3.136 1.230 1.230 weight 1.000 ! spec=n15n...hn-2, no=288, id=149, vol=3.396000e-01 assign (segid " " and resid 124 and name HN) (segid " " and resid 123 and name HN) 2.267 0.642 0.642 weight 1.000 ! spec=n15n...hn-2, no=290, id=151, vol=2.383300e+00 assign (segid " " and resid 186 and name HN) (segid " " and resid 185 and name HN) 2.238 0.626 0.626 weight 1.000 ! spec=n15n...hn-2, no=294, id=152, vol=2.571500e+00 assign (segid " " and resid 186 and name HN) (segid " " and resid 186 and name HA) 2.850 1.015 1.015 weight 1.000 ! spec=n15n...hn-2, no=295, id=153, vol=6.030000e-01 assign (segid " " and resid 186 and name HN) (segid " " and resid 187 and name HA) 2.802 0.981 3.198 weight 1.000 ! spec=n15n...hn-2, no=296, id=154, vol=6.681000e-01 assign (segid " " and resid 186 and name HN) (segid " " and resid 186 and name HB2) 2.548 0.811 0.811 weight 1.000 ! spec=n15n...hn-2, no=297, id=155, vol=1.181800e+00 assign (segid " " and resid 186 and name HN) (segid " " and resid 186 and name HB1) 2.635 0.868 0.868 weight 1.000 ! spec=n15n...hn-2, no=298, id=156, vol=9.665000e-01 assign (segid " " and resid 186 and name HN) (segid " " and resid 185 and name HB1) 2.946 1.085 1.085 weight 1.000 ! spec=n15n...hn-2, no=300, id=158, vol=4.949000e-01 assign (segid " " and resid 182 and name HN) (segid " " and resid 182 and name HB2) 2.912 1.060 1.060 weight 1.000 ! spec=n15n...hn-2, no=303, id=160, vol=5.299000e-01 assign (segid " " and resid 182 and name HN) (segid " " and resid 182 and name HB1) 2.892 1.046 1.046 weight 1.000 ! spec=n15n...hn-2, no=304, id=161, vol=5.525000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 172 and name HN) 2.667 0.889 0.889 weight 1.000 ! spec=n15n...hn-2, no=307, id=163, vol=8.984000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 170 and name HA) 2.613 0.854 0.854 weight 1.000 ! spec=n15n...hn-2, no=308, id=164, vol=1.015200e+00 assign (segid " " and resid 171 and name HN) (segid " " and resid 171 and name HA) 2.680 0.898 0.898 weight 1.000 ! spec=n15n...hn-2, no=309, id=165, vol=8.722000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 171 and name HB2) 2.656 0.882 0.882 weight 1.000 ! spec=n15n...hn-2, no=310, id=166, vol=9.211000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 171 and name HB1) 2.585 0.835 0.835 weight 1.000 ! spec=n15n...hn-2, no=311, id=167, vol=1.084600e+00 assign (segid " " and resid 171 and name HN) (segid " " and resid 123 and name HG12) 3.042 1.157 2.958 weight 1.000 ! spec=n15n...hn-2, no=312, id=168, vol=4.080000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 171 and name HD11) 2.861 1.023 3.139 weight 1.000 ! spec=n15n...hn-2, no=313, id=169, vol=5.896000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 144 and name HN) 2.885 1.040 1.040 weight 1.000 ! spec=n15n...hn-2, no=317, id=172, vol=5.612000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 146 and name HA) 2.659 0.884 0.884 weight 1.000 ! spec=n15n...hn-2, no=318, id=173, vol=9.154000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 145 and name HA) 3.078 1.184 1.184 weight 1.000 ! spec=n15n...hn-2, no=319, id=174, vol=3.805000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 147 and name HA1) 3.106 1.206 2.894 weight 1.000 ! spec=n15n...hn-2, no=320, id=175, vol=3.601000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 145 and name HB) 2.702 0.913 0.913 weight 1.000 ! spec=n15n...hn-2, no=321, id=176, vol=8.300000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 142 and name HA) 2.940 1.080 1.080 weight 1.000 ! spec=n15n...hn-2, no=322, id=177, vol=5.011000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 146 and name HB2) 2.684 0.901 0.901 weight 1.000 ! spec=n15n...hn-2, no=323, id=178, vol=8.646000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 146 and name HB1) 2.446 0.748 0.748 weight 1.000 ! spec=n15n...hn-2, no=324, id=179, vol=1.509100e+00 assign (segid " " and resid 146 and name HN) (segid " " and resid 146 and name HG2) 2.887 1.042 3.113 weight 1.000 ! spec=n15n...hn-2, no=325, id=180, vol=5.581000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 146 and name HD2) 2.767 0.957 0.957 weight 1.000 ! spec=n15n...hn-2, no=327, id=182, vol=7.199000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 145 and name HG21) 2.674 0.894 3.326 weight 1.000 ! spec=n15n...hn-2, no=328, id=183, vol=8.851000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 142 and name HD11) 2.834 1.004 3.166 weight 1.000 ! spec=n15n...hn-2, no=329, id=184, vol=6.239000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 104 and name HA) 2.672 0.892 0.892 weight 1.000 ! spec=n15n...hn-2, no=333, id=187, vol=8.889000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 101 and name HA) 2.980 1.110 1.110 weight 1.000 ! spec=n15n...hn-2, no=334, id=188, vol=4.616000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 104 and name HB2) 2.681 0.899 0.899 weight 1.000 ! spec=n15n...hn-2, no=336, id=189, vol=8.700000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 104 and name HB1) 2.771 0.959 0.959 weight 1.000 ! spec=n15n...hn-2, no=337, id=190, vol=7.148000e-01 assign (segid " " and resid 163 and name HN) (segid " " and resid 164 and name HN) 2.352 0.692 0.692 weight 1.000 ! spec=n15n...hn-2, no=339, id=192, vol=1.908700e+00 assign (segid " " and resid 99 and name HN) (segid " " and resid 100 and name HN) 2.723 0.927 0.927 weight 1.000 ! spec=n15n...hn-2, no=340, id=193, vol=7.927000e-01 assign (segid " " and resid 164 and name HN) (segid " " and resid 167 and name HD1) 2.931 1.074 1.074 weight 1.000 ! spec=n15n...hn-2, no=342, id=194, vol=5.100000e-01 assign (segid " " and resid 164 and name HN) (segid " " and resid 163 and name HA) 2.960 1.095 1.095 weight 1.000 ! spec=n15n...hn-2, no=344, id=195, vol=4.805000e-01 assign (segid " " and resid 164 and name HN) (segid " " and resid 164 and name HA) 2.670 0.891 0.891 weight 1.000 ! spec=n15n...hn-2, no=345, id=196, vol=8.913000e-01 assign (segid " " and resid 99 and name HN) (segid " " and resid 98 and name HA) 2.443 0.746 3.557 weight 1.000 ! spec=n15n...hn-2, no=347, id=198, vol=1.522400e+00 assign (segid " " and resid 164 and name HN) (segid " " and resid 164 and name HB2) 2.369 0.701 0.701 weight 1.000 ! spec=n15n...hn-2, no=348, id=199, vol=1.830600e+00 assign (segid " " and resid 164 and name HN) (segid " " and resid 164 and name HD2) 2.907 1.056 3.093 weight 1.000 ! spec=n15n...hn-2, no=349, id=200, vol=5.362000e-01 assign (segid " " and resid 99 and name HN) (segid " " and resid 99 and name HB2) 2.403 0.722 3.597 weight 1.000 ! spec=n15n...hn-2, no=350, id=201, vol=1.678500e+00 assign (segid " " and resid 99 and name HN) (segid " " and resid 99 and name HG2) 3.054 1.166 1.166 weight 1.000 ! spec=n15n...hn-2, no=352, id=203, vol=3.983000e-01 assign (segid " " and resid 155 and name HN) (segid " " and resid 156 and name HN) 2.603 0.847 0.847 weight 1.000 ! spec=n15n...hn-2, no=354, id=204, vol=1.039800e+00 assign (segid " " and resid 155 and name HN) (segid " " and resid 154 and name HA) 2.951 1.088 1.088 weight 1.000 ! spec=n15n...hn-2, no=357, id=206, vol=4.897000e-01 assign (segid " " and resid 155 and name HN) (segid " " and resid 155 and name HA) 2.413 0.728 0.728 weight 1.000 ! spec=n15n...hn-2, no=358, id=207, vol=1.635800e+00 assign (segid " " and resid 155 and name HN) (segid " " and resid 154 and name HB1) 2.824 0.997 0.997 weight 1.000 ! spec=n15n...hn-2, no=360, id=208, vol=6.378000e-01 assign (segid " " and resid 155 and name HN) (segid " " and resid 154 and name HB2) 2.683 0.900 0.900 weight 1.000 ! spec=n15n...hn-2, no=361, id=209, vol=8.662000e-01 assign (segid " " and resid 155 and name HN) (segid " " and resid 155 and name HG) 2.878 1.035 1.035 weight 1.000 ! spec=n15n...hn-2, no=362, id=210, vol=5.690000e-01 assign (segid " " and resid 155 and name HN) (segid " " and resid 155 and name HB2) 2.467 0.761 0.761 weight 1.000 ! spec=n15n...hn-2, no=363, id=211, vol=1.433500e+00 assign (segid " " and resid 155 and name HN) (segid " " and resid 155 and name HD11) 2.420 0.732 3.580 weight 1.000 ! spec=n15n...hn-2, no=364, id=212, vol=1.608100e+00 assign (segid " " and resid 155 and name HN) (segid " " and resid 139 and name HG21) 2.772 0.961 0.961 weight 1.000 ! spec=n15n...hn-2, no=365, id=213, vol=7.118000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 141 and name HN) 2.431 0.739 0.739 weight 1.000 ! spec=n15n...hn-2, no=366, id=214, vol=1.566400e+00 assign (segid " " and resid 141 and name HN) (segid " " and resid 141 and name HA) 2.378 0.707 0.707 weight 1.000 ! spec=n15n...hn-2, no=369, id=216, vol=1.785800e+00 assign (segid " " and resid 141 and name HN) (segid " " and resid 138 and name HA) 2.744 0.941 0.941 weight 1.000 ! spec=n15n...hn-2, no=370, id=217, vol=7.571000e-01 assign (segid " " and resid 141 and name HN) (segid " " and resid 140 and name HA) 2.724 0.927 0.927 weight 1.000 ! spec=n15n...hn-2, no=371, id=218, vol=7.915000e-01 assign (segid " " and resid 141 and name HN) (segid " " and resid 141 and name HB2) 2.094 0.548 0.548 weight 1.000 ! spec=n15n...hn-2, no=373, id=220, vol=3.832600e+00 assign (segid " " and resid 141 and name HN) (segid " " and resid 141 and name HG2) 3.699 1.911 1.911 weight 1.000 ! spec=n15n...hn-2, no=374, id=221, vol=8.363000e-01 assign (segid " " and resid 141 and name HN) (segid " " and resid 140 and name HB2) 2.496 0.779 0.779 weight 1.000 ! spec=n15n...hn-2, no=376, id=222, vol=1.335400e+00 assign (segid " " and resid 141 and name HN) (segid " " and resid 140 and name HB1) 2.859 1.022 1.022 weight 1.000 ! spec=n15n...hn-2, no=378, id=223, vol=5.920000e-01 assign (segid " " and resid 141 and name HN) (segid " " and resid 140 and name HD11) 2.761 0.953 3.239 weight 1.000 ! spec=n15n...hn-2, no=379, id=224, vol=7.305000e-01 assign (segid " " and resid 138 and name HN) (segid " " and resid 139 and name HN) 2.498 0.780 0.780 weight 1.000 ! spec=n15n...hn-2, no=384, id=226, vol=1.331200e+00 assign (segid " " and resid 138 and name HN) (segid " " and resid 138 and name HA) 2.423 0.734 0.734 weight 1.000 ! spec=n15n...hn-2, no=389, id=227, vol=1.595600e+00 assign (segid " " and resid 159 and name HN) (segid " " and resid 155 and name HA) 2.956 1.093 1.093 weight 1.000 ! spec=n15n...hn-2, no=390, id=228, vol=4.842000e-01 assign (segid " " and resid 138 and name HN) (segid " " and resid 137 and name HA) 2.962 1.097 1.097 weight 1.000 ! spec=n15n...hn-2, no=391, id=229, vol=4.785000e-01 assign (segid " " and resid 159 and name HN) (segid " " and resid 159 and name HA) 2.736 0.936 0.936 weight 1.000 ! spec=n15n...hn-2, no=392, id=230, vol=7.704000e-01 assign (segid " " and resid 159 and name HN) (segid " " and resid 158 and name HB2) 2.822 0.995 0.995 weight 1.000 ! spec=n15n...hn-2, no=393, id=231, vol=6.407000e-01 assign (segid " " and resid 159 and name HN) (segid " " and resid 158 and name HB1) 2.945 1.084 1.084 weight 1.000 ! spec=n15n...hn-2, no=394, id=232, vol=4.953000e-01 assign (segid " " and resid 138 and name HN) (segid " " and resid 138 and name HG2) 2.654 0.880 3.346 weight 1.000 ! spec=n15n...hn-2, no=395, id=233, vol=9.253000e-01 assign (segid " " and resid 138 and name HN) (segid " " and resid 138 and name HB2) 2.227 0.620 0.620 weight 1.000 ! spec=n15n...hn-2, no=396, id=234, vol=2.652100e+00 assign (segid " " and resid 138 and name HN) (segid " " and resid 138 and name HB1) 2.141 0.573 0.573 weight 1.000 ! spec=n15n...hn-2, no=398, id=236, vol=3.352100e+00 assign (segid " " and resid 159 and name HN) (segid " " and resid 159 and name HB2) 2.697 0.910 0.910 weight 1.000 ! spec=n15n...hn-2, no=399, id=237, vol=8.392000e-01 assign (segid " " and resid 159 and name HN) (segid " " and resid 159 and name HG) 2.559 0.819 0.819 weight 1.000 ! spec=n15n...hn-2, no=400, id=238, vol=1.150100e+00 assign (segid " " and resid 159 and name HN) (segid " " and resid 159 and name HD11) 2.576 0.830 0.830 weight 1.000 ! spec=n15n...hn-2, no=403, id=241, vol=1.105300e+00 assign (segid " " and resid 159 and name HN) (segid " " and resid 159 and name HB1) 2.805 0.984 0.984 weight 1.000 ! spec=n15n...hn-2, no=404, id=242, vol=6.637000e-01 assign (segid " " and resid 106 and name HN) (segid " " and resid 107 and name HN) 2.583 0.834 0.834 weight 1.000 ! spec=n15n...hn-2, no=405, id=243, vol=1.088500e+00 assign (segid " " and resid 138 and name HN) (segid " " and resid 141 and name HN) 3.080 1.186 2.920 weight 1.000 ! spec=n15n...hn-2, no=406, id=244, vol=3.789000e-01 assign (segid " " and resid 106 and name HN) (segid " " and resid 105 and name HN) 2.497 0.780 0.780 weight 1.000 ! spec=n15n...hn-2, no=407, id=245, vol=1.332800e+00 assign (segid " " and resid 138 and name HN) (segid " " and resid 136 and name HN) 3.163 1.251 1.251 weight 1.000 ! spec=n15n...hn-2, no=410, id=246, vol=3.227000e-01 assign (segid " " and resid 106 and name HN) (segid " " and resid 106 and name HA) 2.471 0.763 0.763 weight 1.000 ! spec=n15n...hn-2, no=411, id=247, vol=1.421500e+00 assign (segid " " and resid 106 and name HN) (segid " " and resid 105 and name HA) 2.937 1.078 1.078 weight 1.000 ! spec=n15n...hn-2, no=412, id=248, vol=5.039000e-01 assign (segid " " and resid 138 and name HN) (segid " " and resid 137 and name HG2) 3.029 1.147 1.147 weight 1.000 ! spec=n15n...hn-2, no=413, id=249, vol=4.188000e-01 assign (segid " " and resid 106 and name HN) (segid " " and resid 106 and name HB2) 2.429 0.738 0.738 weight 1.000 ! spec=n15n...hn-2, no=415, id=251, vol=1.573900e+00 assign (segid " " and resid 138 and name HN) (segid " " and resid 139 and name HB) 3.041 1.156 1.156 weight 1.000 ! spec=n15n...hn-2, no=416, id=252, vol=4.088000e-01 assign (segid " " and resid 106 and name HN) (segid " " and resid 106 and name HB1) 2.342 0.686 0.686 weight 1.000 ! spec=n15n...hn-2, no=417, id=253, vol=1.958500e+00 assign (segid " " and resid 106 and name HN) (segid " " and resid 106 and name HD21) 2.895 1.048 3.105 weight 1.000 ! spec=n15n...hn-2, no=418, id=254, vol=5.487000e-01 assign (segid " " and resid 106 and name HN) (segid " " and resid 105 and name HD11) 3.071 1.179 1.179 weight 1.000 ! spec=n15n...hn-2, no=419, id=255, vol=3.851000e-01 assign (segid " " and resid 106 and name HN) (segid " " and resid 106 and name HD11) 2.939 1.080 3.061 weight 1.000 ! spec=n15n...hn-2, no=420, id=256, vol=5.016000e-01 assign (segid " " and resid 124 and name HN) (segid " " and resid 122 and name HN) 2.707 0.916 0.916 weight 1.000 ! spec=n15n...hn-2, no=422, id=257, vol=8.221000e-01 assign (segid " " and resid 124 and name HN) (segid " " and resid 123 and name HA) 3.031 1.148 1.148 weight 1.000 ! spec=n15n...hn-2, no=423, id=258, vol=4.173000e-01 assign (segid " " and resid 124 and name HN) (segid " " and resid 122 and name HB2) 3.150 1.240 1.240 weight 1.000 ! spec=n15n...hn-2, no=425, id=260, vol=3.311000e-01 assign (segid " " and resid 124 and name HN) (segid " " and resid 124 and name HB) 2.211 0.611 0.611 weight 1.000 ! spec=n15n...hn-2, no=426, id=261, vol=2.764500e+00 assign (segid " " and resid 124 and name HN) (segid " " and resid 123 and name HB) 3.071 1.179 1.179 weight 1.000 ! spec=n15n...hn-2, no=427, id=262, vol=3.856000e-01 assign (segid " " and resid 124 and name HN) (segid " " and resid 123 and name HG12) 2.732 0.933 3.268 weight 1.000 ! spec=n15n...hn-2, no=428, id=263, vol=7.781000e-01 assign (segid " " and resid 124 and name HN) (segid " " and resid 124 and name HD11) 2.689 0.904 0.904 weight 1.000 ! spec=n15n...hn-2, no=429, id=264, vol=8.560000e-01 assign (segid " " and resid 124 and name HN) (segid " " and resid 124 and name HG21) 2.333 0.680 3.667 weight 1.000 ! spec=n15n...hn-2, no=430, id=265, vol=2.004700e+00 assign (segid " " and resid 124 and name HN) (segid " " and resid 123 and name HG21) 2.688 0.903 3.312 weight 1.000 ! spec=n15n...hn-2, no=431, id=266, vol=8.561000e-01 assign (segid " " and resid 131 and name HN) (segid " " and resid 130 and name HN) 2.083 0.542 0.542 weight 1.000 ! spec=n15n...hn-2, no=432, id=267, vol=3.959800e+00 assign (segid " " and resid 131 and name HN) (segid " " and resid 130 and name HA) 2.804 0.983 0.983 weight 1.000 ! spec=n15n...hn-2, no=437, id=270, vol=6.651000e-01 assign (segid " " and resid 131 and name HN) (segid " " and resid 131 and name HA) 2.598 0.844 0.844 weight 1.000 ! spec=n15n...hn-2, no=439, id=272, vol=1.051100e+00 assign (segid " " and resid 131 and name HN) (segid " " and resid 130 and name HB2) 2.917 1.063 1.063 weight 1.000 ! spec=n15n...hn-2, no=441, id=274, vol=5.252000e-01 assign (segid " " and resid 131 and name HN) (segid " " and resid 130 and name HB1) 3.061 1.171 1.171 weight 1.000 ! spec=n15n...hn-2, no=442, id=275, vol=3.930000e-01 assign (segid " " and resid 131 and name HN) (segid " " and resid 131 and name HB2) 2.430 0.738 0.738 weight 1.000 ! spec=n15n...hn-2, no=443, id=276, vol=1.570800e+00 assign (segid " " and resid 131 and name HN) (segid " " and resid 131 and name HB1) 2.484 0.771 0.771 weight 1.000 ! spec=n15n...hn-2, no=444, id=277, vol=1.376500e+00 assign (segid " " and resid 131 and name HN) (segid " " and resid 131 and name HD11) 2.630 0.865 0.865 weight 1.000 ! spec=n15n...hn-2, no=445, id=278, vol=9.768000e-01 assign (segid " " and resid 186 and name HN) (segid " " and resid 185 and name HA) 2.934 1.076 1.076 weight 1.000 ! spec=n15n...hn-2, no=446, id=279, vol=5.071000e-01 assign (segid " " and resid 140 and name HN) (segid " " and resid 139 and name HN) 2.499 0.781 0.781 weight 1.000 ! spec=n15n...hn-2, no=450, id=280, vol=1.325900e+00 assign (segid " " and resid 141 and name HN) (segid " " and resid 140 and name HN) 2.388 0.713 0.713 weight 1.000 ! spec=n15n...hn-2, no=451, id=281, vol=1.743800e+00 assign (segid " " and resid 140 and name HN) (segid " " and resid 138 and name HN) 2.986 1.114 1.114 weight 1.000 ! spec=n15n...hn-2, no=453, id=282, vol=4.564000e-01 assign (segid " " and resid 140 and name HN) (segid " " and resid 140 and name HA) 2.360 0.696 0.696 weight 1.000 ! spec=n15n...hn-2, no=454, id=283, vol=1.869400e+00 assign (segid " " and resid 140 and name HN) (segid " " and resid 139 and name HA) 3.122 1.219 1.219 weight 1.000 ! spec=n15n...hn-2, no=455, id=284, vol=3.488000e-01 assign (segid " " and resid 140 and name HN) (segid " " and resid 140 and name HG) 2.231 0.622 3.769 weight 1.000 ! spec=n15n...hn-2, no=457, id=286, vol=2.623200e+00 assign (segid " " and resid 140 and name HN) (segid " " and resid 140 and name HB1) 2.578 0.831 0.831 weight 1.000 ! spec=n15n...hn-2, no=458, id=287, vol=1.101400e+00 assign (segid " " and resid 140 and name HN) (segid " " and resid 140 and name HD11) 2.302 0.663 3.698 weight 1.000 ! spec=n15n...hn-2, no=459, id=288, vol=2.169900e+00 assign (segid " " and resid 140 and name HN) (segid " " and resid 139 and name HG21) 2.669 0.890 0.890 weight 1.000 ! spec=n15n...hn-2, no=460, id=289, vol=8.951000e-01 assign (segid " " and resid 155 and name HN) (segid " " and resid 154 and name HN) 2.213 0.612 0.612 weight 1.000 ! spec=n15n...hn-2, no=466, id=290, vol=2.750700e+00 assign (segid " " and resid 154 and name HN) (segid " " and resid 154 and name HA) 2.468 0.761 0.761 weight 1.000 ! spec=n15n...hn-2, no=468, id=291, vol=1.431900e+00 assign (segid " " and resid 154 and name HN) (segid " " and resid 155 and name HA) 3.090 1.194 2.910 weight 1.000 ! spec=n15n...hn-2, no=469, id=292, vol=3.712000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 153 and name HA) 3.059 1.170 1.170 weight 1.000 ! spec=n15n...hn-2, no=470, id=293, vol=3.944000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 151 and name HA1) 3.107 1.207 1.207 weight 1.000 ! spec=n15n...hn-2, no=471, id=294, vol=3.592000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 153 and name HB2) 2.222 0.617 3.778 weight 1.000 ! spec=n15n...hn-2, no=472, id=295, vol=2.685700e+00 assign (segid " " and resid 154 and name HN) (segid " " and resid 154 and name HB1) 2.388 0.713 0.713 weight 1.000 ! spec=n15n...hn-2, no=473, id=296, vol=1.744800e+00 assign (segid " " and resid 154 and name HN) (segid " " and resid 152 and name HB1) 3.098 1.199 2.902 weight 1.000 ! spec=n15n...hn-2, no=474, id=297, vol=3.660000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 155 and name HB2) 2.916 1.063 1.063 weight 1.000 ! spec=n15n...hn-2, no=475, id=298, vol=5.257000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 142 and name HG21) 2.744 0.941 3.256 weight 1.000 ! spec=n15n...hn-2, no=476, id=299, vol=7.569000e-01 assign (segid " " and resid 121 and name HN) (segid " " and resid 122 and name HN) 2.477 0.767 0.767 weight 1.000 ! spec=n15n...hn-2, no=480, id=301, vol=1.400200e+00 assign (segid " " and resid 122 and name HN) (segid " " and resid 123 and name HN) 2.350 0.691 0.691 weight 1.000 ! spec=n15n...hn-2, no=481, id=302, vol=1.917400e+00 assign (segid " " and resid 118 and name HN) (segid " " and resid 117 and name HA) 2.844 1.011 1.011 weight 1.000 ! spec=n15n...hn-2, no=482, id=303, vol=6.107000e-01 assign (segid " " and resid 122 and name HN) (segid " " and resid 122 and name HA) 2.755 0.949 0.949 weight 1.000 ! spec=n15n...hn-2, no=483, id=304, vol=7.392000e-01 assign (segid " " and resid 122 and name HN) (segid " " and resid 121 and name HA) 2.984 1.113 1.113 weight 1.000 ! spec=n15n...hn-2, no=484, id=305, vol=4.580000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 118 and name HA) 2.784 0.969 0.969 weight 1.000 ! spec=n15n...hn-2, no=485, id=306, vol=6.949000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 115 and name HA) 3.131 1.225 1.225 weight 1.000 ! spec=n15n...hn-2, no=486, id=307, vol=3.434000e-01 assign (segid " " and resid 122 and name HN) (segid " " and resid 121 and name HB) 2.866 1.026 3.134 weight 1.000 ! spec=n15n...hn-2, no=487, id=308, vol=5.838000e-01 assign (segid " " and resid 122 and name HN) (segid " " and resid 122 and name HB2) 2.284 0.652 0.652 weight 1.000 ! spec=n15n...hn-2, no=488, id=309, vol=2.278200e+00 assign (segid " " and resid 118 and name HN) (segid " " and resid 117 and name HB2) 3.024 1.143 1.143 weight 1.000 ! spec=n15n...hn-2, no=489, id=310, vol=4.225000e-01 assign (segid " " and resid 122 and name HN) (segid " " and resid 119 and name HB) 3.018 1.138 1.138 weight 1.000 ! spec=n15n...hn-2, no=490, id=311, vol=4.282000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 118 and name HB) 2.271 0.645 0.645 weight 1.000 ! spec=n15n...hn-2, no=492, id=313, vol=2.356500e+00 assign (segid " " and resid 118 and name HN) (segid " " and resid 118 and name HG12) 2.689 0.904 0.904 weight 1.000 ! spec=n15n...hn-2, no=495, id=316, vol=8.555000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 118 and name HG21) 2.853 1.017 3.147 weight 1.000 ! spec=n15n...hn-2, no=496, id=317, vol=6.000000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 118 and name HD11) 2.904 1.054 1.054 weight 1.000 ! spec=n15n...hn-2, no=497, id=318, vol=5.386000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 118 and name HG11) 3.022 1.142 1.142 weight 1.000 ! spec=n15n...hn-2, no=498, id=319, vol=4.241000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 170 and name HN) 2.722 0.926 0.926 weight 1.000 ! spec=n15n...hn-2, no=500, id=320, vol=7.955000e-01 assign (segid " " and resid 170 and name HN) (segid " " and resid 169 and name HA) 3.119 1.216 1.216 weight 1.000 ! spec=n15n...hn-2, no=504, id=323, vol=3.510000e-01 assign (segid " " and resid 170 and name HN) (segid " " and resid 170 and name HA) 2.505 0.784 0.784 weight 1.000 ! spec=n15n...hn-2, no=505, id=324, vol=1.308100e+00 assign (segid " " and resid 170 and name HN) (segid " " and resid 170 and name HB) 2.705 0.914 0.914 weight 1.000 ! spec=n15n...hn-2, no=506, id=325, vol=8.259000e-01 assign (segid " " and resid 170 and name HN) (segid " " and resid 169 and name HB2) 2.566 0.823 0.823 weight 1.000 ! spec=n15n...hn-2, no=507, id=326, vol=1.133500e+00 assign (segid " " and resid 170 and name HN) (segid " " and resid 170 and name HG21) 2.865 1.026 1.026 weight 1.000 ! spec=n15n...hn-2, no=508, id=327, vol=5.849000e-01 assign (segid " " and resid 139 and name HN) (segid " " and resid 136 and name HA) 2.968 1.101 1.101 weight 1.000 ! spec=n15n...hn-2, no=514, id=331, vol=4.731000e-01 assign (segid " " and resid 139 and name HN) (segid " " and resid 139 and name HA) 2.717 0.923 0.923 weight 1.000 ! spec=n15n...hn-2, no=515, id=332, vol=8.040000e-01 assign (segid " " and resid 139 and name HN) (segid " " and resid 138 and name HB2) 2.773 0.961 0.961 weight 1.000 ! spec=n15n...hn-2, no=516, id=333, vol=7.106000e-01 assign (segid " " and resid 139 and name HN) (segid " " and resid 138 and name HB1) 2.688 0.903 0.903 weight 1.000 ! spec=n15n...hn-2, no=518, id=334, vol=8.578000e-01 assign (segid " " and resid 139 and name HN) (segid " " and resid 139 and name HB) 2.196 0.603 0.603 weight 1.000 ! spec=n15n...hn-2, no=519, id=335, vol=2.879700e+00 assign (segid " " and resid 139 and name HN) (segid " " and resid 139 and name HG12) 2.408 0.725 0.725 weight 1.000 ! spec=n15n...hn-2, no=520, id=336, vol=1.656800e+00 assign (segid " " and resid 109 and name HN) (segid " " and resid 109 and name HA) 2.403 0.722 0.722 weight 1.000 ! spec=n15n...hn-2, no=524, id=338, vol=1.680500e+00 assign (segid " " and resid 109 and name HN) (segid " " and resid 108 and name HA) 2.971 1.104 1.104 weight 1.000 ! spec=n15n...hn-2, no=525, id=339, vol=4.697000e-01 assign (segid " " and resid 109 and name HN) (segid " " and resid 110 and name HB2) 3.134 1.227 1.227 weight 1.000 ! spec=n15n...hn-2, no=526, id=340, vol=3.415000e-01 assign (segid " " and resid 109 and name HN) (segid " " and resid 109 and name HB2) 3.140 1.573 1.573 weight 1.000 ! spec=n15n...hn-2, no=527, id=341, vol=3.363900e+00 assign (segid " " and resid 109 and name HN) (segid " " and resid 109 and name HG2) 3.047 1.160 1.160 weight 1.000 ! spec=n15n...hn-2, no=528, id=342, vol=4.040000e-01 assign (segid " " and resid 109 and name HN) (segid " " and resid 108 and name HB2) 2.412 0.727 0.727 weight 1.000 ! spec=n15n...hn-2, no=529, id=343, vol=1.640900e+00 assign (segid " " and resid 126 and name HN) (segid " " and resid 127 and name HN) 2.315 0.670 0.670 weight 1.000 ! spec=n15n...hn-2, no=539, id=345, vol=2.097700e+00 assign (segid " " and resid 126 and name HN) (segid " " and resid 123 and name HA) 3.097 1.199 1.199 weight 1.000 ! spec=n15n...hn-2, no=540, id=346, vol=3.667000e-01 assign (segid " " and resid 126 and name HN) (segid " " and resid 126 and name HA) 2.619 0.857 0.857 weight 1.000 ! spec=n15n...hn-2, no=542, id=348, vol=1.001400e+00 assign (segid " " and resid 126 and name HN) (segid " " and resid 125 and name HB2) 2.903 1.054 1.054 weight 1.000 ! spec=n15n...hn-2, no=543, id=349, vol=5.399000e-01 assign (segid " " and resid 126 and name HN) (segid " " and resid 126 and name HB2) 2.500 0.781 3.500 weight 1.000 ! spec=n15n...hn-2, no=545, id=351, vol=1.325400e+00 assign (segid " " and resid 126 and name HN) (segid " " and resid 126 and name HB1) 2.330 0.679 0.679 weight 1.000 ! spec=n15n...hn-2, no=546, id=352, vol=2.021000e+00 assign (segid " " and resid 126 and name HN) (segid " " and resid 127 and name HB1) 3.028 1.146 1.146 weight 1.000 ! spec=n15n...hn-2, no=547, id=353, vol=4.190000e-01 assign (segid " " and resid 122 and name HN) (segid " " and resid 124 and name HD11) 3.001 1.125 2.999 weight 1.000 ! spec=n15n...hn-2, no=553, id=356, vol=4.430000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 186 and name HH2) 3.010 1.133 1.133 weight 1.000 ! spec=n15n...hn-2, no=558, id=359, vol=4.343000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 186 and name HZ2) 3.039 1.154 1.154 weight 1.000 ! spec=n15n...hn-2, no=559, id=360, vol=4.104000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 186 and name HZ3) 3.093 1.196 1.196 weight 1.000 ! spec=n15n...hn-2, no=560, id=361, vol=3.690000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 107 and name HA) 2.737 0.936 0.936 weight 1.000 ! spec=n15n...hn-2, no=561, id=362, vol=7.691000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 107 and name HB2) 2.583 0.834 0.834 weight 1.000 ! spec=n15n...hn-2, no=563, id=364, vol=1.088600e+00 assign (segid " " and resid 107 and name HN) (segid " " and resid 105 and name HB2) 2.932 1.075 3.068 weight 1.000 ! spec=n15n...hn-2, no=564, id=365, vol=5.089000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 106 and name HB2) 2.438 0.743 0.743 weight 1.000 ! spec=n15n...hn-2, no=565, id=366, vol=1.539700e+00 assign (segid " " and resid 107 and name HN) (segid " " and resid 106 and name HB1) 2.943 1.082 1.082 weight 1.000 ! spec=n15n...hn-2, no=566, id=367, vol=4.978000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 106 and name HD21) 2.942 1.082 3.058 weight 1.000 ! spec=n15n...hn-2, no=567, id=368, vol=4.982000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 107 and name HD11) 3.000 1.125 3.000 weight 1.000 ! spec=n15n...hn-2, no=568, id=369, vol=4.432000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 107 and name HD21) 3.153 1.243 1.243 weight 1.000 ! spec=n15n...hn-2, no=569, id=370, vol=3.288000e-01 assign (segid " " and resid 143 and name HN) (segid " " and resid 143 and name HA) 2.581 0.833 0.833 weight 1.000 ! spec=n15n...hn-2, no=572, id=372, vol=1.092700e+00 assign (segid " " and resid 143 and name HN) (segid " " and resid 140 and name HA) 2.987 1.115 1.115 weight 1.000 ! spec=n15n...hn-2, no=573, id=373, vol=4.553000e-01 assign (segid " " and resid 143 and name HN) (segid " " and resid 142 and name HA) 3.097 1.199 1.199 weight 1.000 ! spec=n15n...hn-2, no=574, id=374, vol=3.664000e-01 assign (segid " " and resid 143 and name HN) (segid " " and resid 143 and name HB2) 2.531 0.801 0.801 weight 1.000 ! spec=n15n...hn-2, no=575, id=375, vol=1.230800e+00 assign (segid " " and resid 143 and name HN) (segid " " and resid 143 and name HB1) 2.653 0.879 0.879 weight 1.000 ! spec=n15n...hn-2, no=577, id=377, vol=9.282000e-01 assign (segid " " and resid 143 and name HN) (segid " " and resid 142 and name HB) 2.559 0.818 0.818 weight 1.000 ! spec=n15n...hn-2, no=578, id=378, vol=1.151900e+00 assign (segid " " and resid 143 and name HN) (segid " " and resid 120 and name HB2) 3.033 1.150 1.150 weight 1.000 ! spec=n15n...hn-2, no=579, id=379, vol=4.151000e-01 assign (segid " " and resid 143 and name HN) (segid " " and resid 142 and name HG21) 2.601 0.845 0.845 weight 1.000 ! spec=n15n...hn-2, no=580, id=380, vol=1.045000e+00 assign (segid " " and resid 143 and name HN) (segid " " and resid 139 and name HG21) 2.939 1.079 1.079 weight 1.000 ! spec=n15n...hn-2, no=581, id=381, vol=5.020000e-01 assign (segid " " and resid 149 and name HN) (segid " " and resid 148 and name HN) 2.637 0.869 0.869 weight 1.000 ! spec=n15n...hn-2, no=582, id=382, vol=9.617000e-01 assign (segid " " and resid 149 and name HN) (segid " " and resid 150 and name HN) 2.327 0.677 0.677 weight 1.000 ! spec=n15n...hn-2, no=588, id=384, vol=2.033700e+00 assign (segid " " and resid 149 and name HN) (segid " " and resid 147 and name HA2) 3.107 1.206 1.206 weight 1.000 ! spec=n15n...hn-2, no=589, id=385, vol=3.596000e-01 assign (segid " " and resid 149 and name HN) (segid " " and resid 149 and name HA) 2.294 0.658 0.658 weight 1.000 ! spec=n15n...hn-2, no=590, id=386, vol=2.218500e+00 assign (segid " " and resid 149 and name HN) (segid " " and resid 148 and name HG2) 3.151 1.241 1.241 weight 1.000 ! spec=n15n...hn-2, no=591, id=387, vol=3.305000e-01 assign (segid " " and resid 149 and name HN) (segid " " and resid 149 and name HG2) 2.657 0.883 0.883 weight 1.000 ! spec=n15n...hn-2, no=592, id=388, vol=9.186000e-01 assign (segid " " and resid 149 and name HN) (segid " " and resid 148 and name HB2) 2.843 1.010 3.157 weight 1.000 ! spec=n15n...hn-2, no=593, id=389, vol=6.122000e-01 assign (segid " " and resid 149 and name HN) (segid " " and resid 149 and name HB2) 2.307 0.665 0.665 weight 1.000 ! spec=n15n...hn-2, no=594, id=390, vol=2.142300e+00 assign (segid " " and resid 149 and name HN) (segid " " and resid 149 and name HB1) 2.474 0.765 3.526 weight 1.000 ! spec=n15n...hn-2, no=595, id=391, vol=1.411500e+00 assign (segid " " and resid 149 and name HN) (segid " " and resid 150 and name HB1) 2.957 1.093 3.043 weight 1.000 ! spec=n15n...hn-2, no=596, id=392, vol=4.838000e-01 assign (segid " " and resid 101 and name HN) (segid " " and resid 100 and name HN) 2.433 0.740 0.740 weight 1.000 ! spec=n15n...hn-2, no=597, id=393, vol=1.557500e+00 assign (segid " " and resid 101 and name HN) (segid " " and resid 100 and name HA) 2.955 1.092 1.092 weight 1.000 ! spec=n15n...hn-2, no=600, id=395, vol=4.852000e-01 assign (segid " " and resid 101 and name HN) (segid " " and resid 101 and name HA) 2.497 0.779 0.779 weight 1.000 ! spec=n15n...hn-2, no=601, id=396, vol=1.334200e+00 assign (segid " " and resid 101 and name HN) (segid " " and resid 101 and name HB2) 2.398 0.719 0.719 weight 1.000 ! spec=n15n...hn-2, no=602, id=397, vol=1.698100e+00 assign (segid " " and resid 101 and name HN) (segid " " and resid 101 and name HG2) 2.452 0.752 0.752 weight 1.000 ! spec=n15n...hn-2, no=603, id=398, vol=1.486500e+00 assign (segid " " and resid 101 and name HN) (segid " " and resid 101 and name HB1) 2.373 0.704 3.627 weight 1.000 ! spec=n15n...hn-2, no=605, id=399, vol=1.809100e+00 assign (segid " " and resid 101 and name HN) (segid " " and resid 100 and name HB1) 2.762 0.954 0.954 weight 1.000 ! spec=n15n...hn-2, no=606, id=400, vol=7.277000e-01 assign (segid " " and resid 101 and name HN) (segid " " and resid 100 and name HB2) 2.706 0.915 0.915 weight 1.000 ! spec=n15n...hn-2, no=607, id=401, vol=8.233000e-01 assign (segid " " and resid 156 and name HN) (segid " " and resid 153 and name HA) 2.940 1.081 1.081 weight 1.000 ! spec=n15n...hn-2, no=615, id=404, vol=5.001000e-01 assign (segid " " and resid 156 and name HN) (segid " " and resid 156 and name HA) 2.647 0.876 0.876 weight 1.000 ! spec=n15n...hn-2, no=616, id=405, vol=9.408000e-01 assign (segid " " and resid 156 and name HN) (segid " " and resid 156 and name HB) 2.392 0.715 0.715 weight 1.000 ! spec=n15n...hn-2, no=619, id=408, vol=1.727500e+00 assign (segid " " and resid 156 and name HN) (segid " " and resid 155 and name HB2) 2.981 1.110 1.110 weight 1.000 ! spec=n15n...hn-2, no=620, id=409, vol=4.611000e-01 assign (segid " " and resid 156 and name HN) (segid " " and resid 155 and name HD11) 2.813 0.989 0.989 weight 1.000 ! spec=n15n...hn-2, no=621, id=410, vol=6.530000e-01 assign (segid " " and resid 156 and name HN) (segid " " and resid 156 and name HG11) 2.826 0.998 3.174 weight 1.000 ! spec=n15n...hn-2, no=622, id=411, vol=6.346000e-01 assign (segid " " and resid 156 and name HN) (segid " " and resid 156 and name HG21) 2.286 0.653 0.653 weight 1.000 ! spec=n15n...hn-2, no=623, id=412, vol=2.265200e+00 assign (segid " " and resid 104 and name HN) (segid " " and resid 103 and name HN) 2.501 0.782 0.782 weight 1.000 ! spec=n15n...hn-2, no=624, id=413, vol=1.319500e+00 assign (segid " " and resid 103 and name HN) (segid " " and resid 102 and name HN) 2.453 0.752 0.752 weight 1.000 ! spec=n15n...hn-2, no=625, id=414, vol=1.483700e+00 assign (segid " " and resid 103 and name HN) (segid " " and resid 103 and name HD1) 2.614 0.854 0.854 weight 1.000 ! spec=n15n...hn-2, no=629, id=415, vol=1.013000e+00 assign (segid " " and resid 103 and name HN) (segid " " and resid 99 and name HA) 3.149 1.240 1.240 weight 1.000 ! spec=n15n...hn-2, no=630, id=416, vol=3.314000e-01 assign (segid " " and resid 103 and name HN) (segid " " and resid 103 and name HA) 2.584 0.835 0.835 weight 1.000 ! spec=n15n...hn-2, no=631, id=417, vol=1.085100e+00 assign (segid " " and resid 103 and name HN) (segid " " and resid 102 and name HA) 2.974 1.105 1.105 weight 1.000 ! spec=n15n...hn-2, no=633, id=418, vol=4.675000e-01 assign (segid " " and resid 103 and name HN) (segid " " and resid 103 and name HB2) 2.723 0.927 0.927 weight 1.000 ! spec=n15n...hn-2, no=634, id=419, vol=7.927000e-01 assign (segid " " and resid 103 and name HN) (segid " " and resid 103 and name HB1) 2.675 0.894 0.894 weight 1.000 ! spec=n15n...hn-2, no=635, id=420, vol=8.822000e-01 assign (segid " " and resid 103 and name HN) (segid " " and resid 102 and name HB2) 2.531 0.801 0.801 weight 1.000 ! spec=n15n...hn-2, no=636, id=421, vol=1.230200e+00 assign (segid " " and resid 103 and name HN) (segid " " and resid 102 and name HB1) 2.736 0.936 0.936 weight 1.000 ! spec=n15n...hn-2, no=637, id=422, vol=7.707000e-01 assign (segid " " and resid 157 and name HN) (segid " " and resid 156 and name HA) 3.053 1.165 1.165 weight 1.000 ! spec=n15n...hn-2, no=638, id=423, vol=3.994000e-01 assign (segid " " and resid 135 and name HN) (segid " " and resid 134 and name HA) 3.014 1.135 1.135 weight 1.000 ! spec=n15n...hn-2, no=641, id=425, vol=4.316000e-01 assign (segid " " and resid 135 and name HN) (segid " " and resid 135 and name HB2) 2.525 0.797 0.797 weight 1.000 ! spec=n15n...hn-2, no=642, id=426, vol=1.246400e+00 assign (segid " " and resid 135 and name HN) (segid " " and resid 134 and name HB2) 2.464 0.759 0.759 weight 1.000 ! spec=n15n...hn-2, no=643, id=427, vol=1.445100e+00 assign (segid " " and resid 135 and name HN) (segid " " and resid 132 and name HG12) 2.480 0.769 0.769 weight 1.000 ! spec=n15n...hn-2, no=644, id=428, vol=1.389800e+00 assign (segid " " and resid 135 and name HN) (segid " " and resid 132 and name HD11) 2.985 1.114 1.114 weight 1.000 ! spec=n15n...hn-2, no=645, id=429, vol=4.573000e-01 assign (segid " " and resid 134 and name HN) (segid " " and resid 134 and name HA) 2.679 0.897 0.897 weight 1.000 ! spec=n15n...hn-2, no=648, id=431, vol=8.741000e-01 assign (segid " " and resid 134 and name HN) (segid " " and resid 133 and name HB2) 2.693 0.906 3.307 weight 1.000 ! spec=n15n...hn-2, no=649, id=432, vol=8.478000e-01 assign (segid " " and resid 134 and name HN) (segid " " and resid 133 and name HB1) 2.692 0.906 0.906 weight 1.000 ! spec=n15n...hn-2, no=650, id=433, vol=8.490000e-01 assign (segid " " and resid 134 and name HN) (segid " " and resid 134 and name HG2) 2.904 1.054 1.054 weight 1.000 ! spec=n15n...hn-2, no=651, id=434, vol=5.390000e-01 assign (segid " " and resid 134 and name HN) (segid " " and resid 134 and name HB2) 2.408 0.725 0.725 weight 1.000 ! spec=n15n...hn-2, no=652, id=435, vol=1.656500e+00 assign (segid " " and resid 134 and name HN) (segid " " and resid 132 and name HG12) 2.966 1.099 1.099 weight 1.000 ! spec=n15n...hn-2, no=653, id=436, vol=4.751000e-01 assign (segid " " and resid 134 and name HN) (segid " " and resid 132 and name HG21) 2.956 1.093 3.044 weight 1.000 ! spec=n15n...hn-2, no=654, id=437, vol=4.841000e-01 assign (segid " " and resid 176 and name HN) (segid " " and resid 176 and name HA) 2.516 0.792 0.792 weight 1.000 ! spec=n15n...hn-2, no=658, id=440, vol=1.273200e+00 assign (segid " " and resid 176 and name HN) (segid " " and resid 175 and name HA) 3.011 1.133 1.133 weight 1.000 ! spec=n15n...hn-2, no=659, id=441, vol=4.336000e-01 assign (segid " " and resid 176 and name HN) (segid " " and resid 176 and name HG2) 2.714 0.921 0.921 weight 1.000 ! spec=n15n...hn-2, no=660, id=442, vol=8.083000e-01 assign (segid " " and resid 176 and name HN) (segid " " and resid 176 and name HB2) 2.457 0.755 0.755 weight 1.000 ! spec=n15n...hn-2, no=661, id=443, vol=1.469900e+00 assign (segid " " and resid 176 and name HN) (segid " " and resid 176 and name HG1) 2.563 0.821 0.821 weight 1.000 ! spec=n15n...hn-2, no=662, id=444, vol=1.140100e+00 assign (segid " " and resid 176 and name HN) (segid " " and resid 175 and name HB2) 2.400 0.720 0.720 weight 1.000 ! spec=n15n...hn-2, no=663, id=445, vol=1.691100e+00 assign (segid " " and resid 129 and name HN) (segid " " and resid 131 and name HA) 3.016 1.137 2.984 weight 1.000 ! spec=n15n...hn-2, no=669, id=450, vol=4.298000e-01 assign (segid " " and resid 129 and name HN) (segid " " and resid 129 and name HA) 2.504 0.784 0.784 weight 1.000 ! spec=n15n...hn-2, no=670, id=451, vol=1.312500e+00 assign (segid " " and resid 129 and name HN) (segid " " and resid 129 and name HG2) 2.645 0.874 3.355 weight 1.000 ! spec=n15n...hn-2, no=671, id=452, vol=9.446000e-01 assign (segid " " and resid 129 and name HN) (segid " " and resid 129 and name HB2) 2.578 0.830 0.830 weight 1.000 ! spec=n15n...hn-2, no=672, id=453, vol=1.102300e+00 assign (segid " " and resid 129 and name HN) (segid " " and resid 129 and name HB1) 2.392 0.715 0.715 weight 1.000 ! spec=n15n...hn-2, no=673, id=454, vol=1.725100e+00 assign (segid " " and resid 176 and name HN) (segid " " and resid 175 and name HB1) 3.067 1.176 1.176 weight 1.000 ! spec=n15n...hn-2, no=674, id=455, vol=3.886000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 153 and name HN) 2.631 0.865 0.865 weight 1.000 ! spec=n15n...hn-2, no=675, id=456, vol=9.739000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 153 and name HN) 2.573 0.827 0.827 weight 1.000 ! spec=n15n...hn-2, no=678, id=457, vol=1.115400e+00 assign (segid " " and resid 180 and name HN) (segid " " and resid 178 and name HN) 3.158 1.247 1.247 weight 1.000 ! spec=n15n...hn-2, no=679, id=458, vol=3.260000e-01 assign (segid " " and resid 153 and name HN) (segid " " and resid 149 and name HA) 3.110 1.209 1.209 weight 1.000 ! spec=n15n...hn-2, no=680, id=459, vol=3.575000e-01 assign (segid " " and resid 153 and name HN) (segid " " and resid 150 and name HA) 2.888 1.042 1.042 weight 1.000 ! spec=n15n...hn-2, no=681, id=460, vol=5.573000e-01 assign (segid " " and resid 153 and name HN) (segid " " and resid 153 and name HA) 2.584 0.834 0.834 weight 1.000 ! spec=n15n...hn-2, no=682, id=461, vol=1.086800e+00 assign (segid " " and resid 153 and name HN) (segid " " and resid 153 and name HG2) 2.655 0.881 0.881 weight 1.000 ! spec=n15n...hn-2, no=683, id=462, vol=9.221000e-01 assign (segid " " and resid 153 and name HN) (segid " " and resid 153 and name HB2) 2.162 0.584 0.584 weight 1.000 ! spec=n15n...hn-2, no=684, id=463, vol=3.169000e+00 assign (segid " " and resid 153 and name HN) (segid " " and resid 152 and name HB1) 2.547 0.811 3.453 weight 1.000 ! spec=n15n...hn-2, no=685, id=464, vol=1.184700e+00 assign (segid " " and resid 100 and name HN) (segid " " and resid 100 and name HA) 2.642 0.873 0.873 weight 1.000 ! spec=n15n...hn-2, no=689, id=467, vol=9.498000e-01 assign (segid " " and resid 100 and name HN) (segid " " and resid 99 and name HA) 2.562 0.821 0.821 weight 1.000 ! spec=n15n...hn-2, no=690, id=468, vol=1.143000e+00 assign (segid " " and resid 100 and name HN) (segid " " and resid 101 and name HB2) 3.177 1.261 1.261 weight 1.000 ! spec=n15n...hn-2, no=691, id=469, vol=3.146000e-01 assign (segid " " and resid 100 and name HN) (segid " " and resid 100 and name HB2) 2.248 0.632 3.752 weight 1.000 ! spec=n15n...hn-2, no=692, id=470, vol=2.503000e+00 assign (segid " " and resid 100 and name HN) (segid " " and resid 100 and name HB1) 2.335 0.681 0.681 weight 1.000 ! spec=n15n...hn-2, no=693, id=471, vol=1.996000e+00 assign (segid " " and resid 100 and name HN) (segid " " and resid 100 and name HD21) 2.776 0.964 0.964 weight 1.000 ! spec=n15n...hn-2, no=694, id=472, vol=7.058000e-01 assign (segid " " and resid 100 and name HN) (segid " " and resid 100 and name HD11) 3.101 1.202 2.899 weight 1.000 ! spec=n15n...hn-2, no=695, id=473, vol=3.635000e-01 assign (segid " " and resid 105 and name HN) (segid " " and resid 108 and name HN) 2.824 0.997 3.176 weight 1.000 ! spec=n15n...hn-2, no=696, id=474, vol=6.378000e-01 assign (segid " " and resid 105 and name HN) (segid " " and resid 102 and name HN) 2.936 1.077 3.064 weight 1.000 ! spec=n15n...hn-2, no=699, id=476, vol=5.051000e-01 assign (segid " " and resid 105 and name HN) (segid " " and resid 105 and name HA) 2.587 0.837 0.837 weight 1.000 ! spec=n15n...hn-2, no=700, id=477, vol=1.077600e+00 assign (segid " " and resid 105 and name HN) (segid " " and resid 102 and name HA) 2.888 1.042 1.042 weight 1.000 ! spec=n15n...hn-2, no=701, id=478, vol=5.576000e-01 assign (segid " " and resid 105 and name HN) (segid " " and resid 104 and name HB2) 2.948 1.087 1.087 weight 1.000 ! spec=n15n...hn-2, no=703, id=479, vol=4.922000e-01 assign (segid " " and resid 105 and name HN) (segid " " and resid 105 and name HB2) 2.131 0.568 0.568 weight 1.000 ! spec=n15n...hn-2, no=704, id=480, vol=3.450600e+00 assign (segid " " and resid 105 and name HN) (segid " " and resid 104 and name HB1) 2.848 1.014 1.014 weight 1.000 ! spec=n15n...hn-2, no=705, id=481, vol=6.059000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 105 and name HN) 2.570 0.826 0.826 weight 1.000 ! spec=n15n...hn-2, no=708, id=483, vol=1.122200e+00 assign (segid " " and resid 102 and name HN) (segid " " and resid 100 and name HN) 2.882 1.038 1.038 weight 1.000 ! spec=n15n...hn-2, no=709, id=484, vol=5.646000e-01 assign (segid " " and resid 101 and name HN) (segid " " and resid 102 and name HN) 2.398 0.719 0.719 weight 1.000 ! spec=n15n...hn-2, no=710, id=485, vol=1.701200e+00 assign (segid " " and resid 105 and name HN) (segid " " and resid 104 and name HA) 3.030 1.147 1.147 weight 1.000 ! spec=n15n...hn-2, no=713, id=487, vol=4.179000e-01 assign (segid " " and resid 102 and name HN) (segid " " and resid 101 and name HA) 2.837 1.006 1.006 weight 1.000 ! spec=n15n...hn-2, no=714, id=488, vol=6.206000e-01 assign (segid " " and resid 102 and name HN) (segid " " and resid 102 and name HA) 2.486 0.773 0.773 weight 1.000 ! spec=n15n...hn-2, no=715, id=489, vol=1.369400e+00 assign (segid " " and resid 102 and name HN) (segid " " and resid 101 and name HG2) 3.036 1.152 2.964 weight 1.000 ! spec=n15n...hn-2, no=716, id=490, vol=4.131000e-01 assign (segid " " and resid 102 and name HN) (segid " " and resid 101 and name HB2) 2.740 0.938 0.938 weight 1.000 ! spec=n15n...hn-2, no=717, id=491, vol=7.640000e-01 assign (segid " " and resid 105 and name HN) (segid " " and resid 106 and name HB2) 3.073 1.181 1.181 weight 1.000 ! spec=n15n...hn-2, no=718, id=492, vol=3.836000e-01 assign (segid " " and resid 102 and name HN) (segid " " and resid 102 and name HG1) 2.209 0.610 0.610 weight 1.000 ! spec=n15n...hn-2, no=719, id=493, vol=2.780400e+00 assign (segid " " and resid 102 and name HN) (segid " " and resid 101 and name HB1) 2.645 0.875 0.875 weight 1.000 ! spec=n15n...hn-2, no=720, id=494, vol=9.434000e-01 assign (segid " " and resid 102 and name HN) (segid " " and resid 102 and name HG2) 2.593 0.841 0.841 weight 1.000 ! spec=n15n...hn-2, no=721, id=495, vol=1.062900e+00 assign (segid " " and resid 102 and name HN) (segid " " and resid 102 and name HB1) 2.538 0.805 0.805 weight 1.000 ! spec=n15n...hn-2, no=722, id=496, vol=1.209800e+00 assign (segid " " and resid 105 and name HN) (segid " " and resid 105 and name HD11) 2.649 0.877 3.351 weight 1.000 ! spec=n15n...hn-2, no=723, id=497, vol=9.359000e-01 assign (segid " " and resid 179 and name HN) (segid " " and resid 178 and name HA) 2.828 1.000 1.000 weight 1.000 ! spec=n15n...hn-2, no=729, id=500, vol=6.316000e-01 assign (segid " " and resid 179 and name HN) (segid " " and resid 179 and name HA) 2.144 0.575 0.575 weight 1.000 ! spec=n15n...hn-2, no=730, id=501, vol=3.326100e+00 assign (segid " " and resid 179 and name HN) (segid " " and resid 178 and name HB2) 3.135 1.229 1.229 weight 1.000 ! spec=n15n...hn-2, no=731, id=502, vol=3.403000e-01 assign (segid " " and resid 179 and name HN) (segid " " and resid 179 and name HB1) 2.726 0.929 0.929 weight 1.000 ! spec=n15n...hn-2, no=732, id=503, vol=7.870000e-01 assign (segid " " and resid 179 and name HN) (segid " " and resid 179 and name HG2) 2.524 0.796 0.796 weight 1.000 ! spec=n15n...hn-2, no=733, id=504, vol=1.251100e+00 assign (segid " " and resid 179 and name HN) (segid " " and resid 175 and name HA) 2.924 1.069 3.076 weight 1.000 ! spec=n15n...hn-2, no=734, id=505, vol=5.170000e-01 assign (segid " " and resid 179 and name HN) (segid " " and resid 176 and name HA) 2.876 1.034 1.034 weight 1.000 ! spec=n15n...hn-2, no=735, id=506, vol=5.710000e-01 assign (segid " " and resid 179 and name HN) (segid " " and resid 179 and name HB2) 2.845 1.012 3.155 weight 1.000 ! spec=n15n...hn-2, no=736, id=507, vol=6.101000e-01 assign (segid " " and resid 172 and name HN) (segid " " and resid 186 and name HE1) 2.811 0.988 0.988 weight 1.000 ! spec=n15n...hn-2, no=737, id=508, vol=6.556000e-01 assign (segid " " and resid 172 and name HN) (segid " " and resid 186 and name HD1) 3.132 1.226 1.226 weight 1.000 ! spec=n15n...hn-2, no=741, id=511, vol=3.426000e-01 assign (segid " " and resid 172 and name HN) (segid " " and resid 172 and name HA) 2.616 0.855 0.855 weight 1.000 ! spec=n15n...hn-2, no=742, id=512, vol=1.009400e+00 assign (segid " " and resid 172 and name HN) (segid " " and resid 172 and name HB2) 2.559 0.819 0.819 weight 1.000 ! spec=n15n...hn-2, no=744, id=514, vol=1.150500e+00 assign (segid " " and resid 172 and name HN) (segid " " and resid 171 and name HB2) 2.771 0.959 0.959 weight 1.000 ! spec=n15n...hn-2, no=745, id=515, vol=7.148000e-01 assign (segid " " and resid 172 and name HN) (segid " " and resid 172 and name HB1) 2.583 0.834 0.834 weight 1.000 ! spec=n15n...hn-2, no=746, id=516, vol=1.089000e+00 assign (segid " " and resid 172 and name HN) (segid " " and resid 172 and name HG1) 2.987 1.115 1.115 weight 1.000 ! spec=n15n...hn-2, no=747, id=517, vol=4.549000e-01 assign (segid " " and resid 172 and name HN) (segid " " and resid 188 and name HG11) 2.952 1.089 3.048 weight 1.000 ! spec=n15n...hn-2, no=749, id=519, vol=4.889000e-01 assign (segid " " and resid 170 and name HN) (segid " " and resid 169 and name HN) 2.437 0.742 0.742 weight 1.000 ! spec=n15n...hn-2, no=750, id=520, vol=1.542900e+00 assign (segid " " and resid 127 and name HN) (segid " " and resid 126 and name HA) 3.017 1.138 1.138 weight 1.000 ! spec=n15n...hn-2, no=754, id=522, vol=4.285000e-01 assign (segid " " and resid 127 and name HN) (segid " " and resid 127 and name HA) 2.640 0.871 0.871 weight 1.000 ! spec=n15n...hn-2, no=755, id=523, vol=9.546000e-01 assign (segid " " and resid 169 and name HN) (segid " " and resid 169 and name HA) 2.496 0.779 0.779 weight 1.000 ! spec=n15n...hn-2, no=756, id=524, vol=1.337400e+00 assign (segid " " and resid 127 and name HN) (segid " " and resid 124 and name HA) 2.956 1.092 1.092 weight 1.000 ! spec=n15n...hn-2, no=757, id=525, vol=4.846000e-01 assign (segid " " and resid 169 and name HN) (segid " " and resid 169 and name HE2) 2.774 0.962 0.962 weight 1.000 ! spec=n15n...hn-2, no=758, id=526, vol=7.100000e-01 assign (segid " " and resid 127 and name HN) (segid " " and resid 126 and name HB2) 3.087 1.192 1.192 weight 1.000 ! spec=n15n...hn-2, no=759, id=527, vol=3.732000e-01 assign (segid " " and resid 127 and name HN) (segid " " and resid 126 and name HB1) 3.118 1.215 1.215 weight 1.000 ! spec=n15n...hn-2, no=760, id=528, vol=3.517000e-01 assign (segid " " and resid 169 and name HN) (segid " " and resid 169 and name HB2) 2.188 0.598 0.598 weight 1.000 ! spec=n15n...hn-2, no=761, id=529, vol=2.947700e+00 assign (segid " " and resid 169 and name HN) (segid " " and resid 169 and name HG2) 2.916 1.063 1.063 weight 1.000 ! spec=n15n...hn-2, no=762, id=530, vol=5.260000e-01 assign (segid " " and resid 127 and name HN) (segid " " and resid 127 and name HB1) 2.410 0.726 0.726 weight 1.000 ! spec=n15n...hn-2, no=763, id=531, vol=1.651900e+00 assign (segid " " and resid 169 and name HN) (segid " " and resid 168 and name HB2) 2.900 1.051 1.051 weight 1.000 ! spec=n15n...hn-2, no=764, id=532, vol=5.440000e-01 assign (segid " " and resid 127 and name HN) (segid " " and resid 127 and name HD11) 2.560 0.819 3.440 weight 1.000 ! spec=n15n...hn-2, no=766, id=534, vol=1.148600e+00 assign (segid " " and resid 169 and name HN) (segid " " and resid 159 and name HD21) 3.094 1.197 2.906 weight 1.000 ! spec=n15n...hn-2, no=767, id=535, vol=3.683000e-01 assign (segid " " and resid 117 and name HN) (segid " " and resid 117 and name HA) 2.708 0.916 0.916 weight 1.000 ! spec=n15n...hn-2, no=771, id=537, vol=8.202000e-01 assign (segid " " and resid 117 and name HN) (segid " " and resid 117 and name HD2) 3.027 1.146 2.973 weight 1.000 ! spec=n15n...hn-2, no=773, id=539, vol=4.199000e-01 assign (segid " " and resid 117 and name HN) (segid " " and resid 115 and name HB2) 2.795 0.977 3.205 weight 1.000 ! spec=n15n...hn-2, no=774, id=540, vol=6.776000e-01 assign (segid " " and resid 117 and name HN) (segid " " and resid 117 and name HB2) 2.758 0.951 0.951 weight 1.000 ! spec=n15n...hn-2, no=775, id=541, vol=7.348000e-01 assign (segid " " and resid 117 and name HN) (segid " " and resid 117 and name HG2) 2.775 0.963 0.963 weight 1.000 ! spec=n15n...hn-2, no=776, id=542, vol=7.075000e-01 assign (segid " " and resid 117 and name HN) (segid " " and resid 116 and name HG21) 3.097 1.199 1.199 weight 1.000 ! spec=n15n...hn-2, no=778, id=544, vol=3.663000e-01 assign (segid " " and resid 157 and name HN) (segid " " and resid 158 and name HN) 2.457 0.755 0.755 weight 1.000 ! spec=n15n...hn-2, no=779, id=545, vol=1.468500e+00 assign (segid " " and resid 156 and name HN) (segid " " and resid 157 and name HN) 2.507 0.785 0.785 weight 1.000 ! spec=n15n...hn-2, no=780, id=546, vol=1.303200e+00 assign (segid " " and resid 157 and name HN) (segid " " and resid 154 and name HA) 2.943 1.082 1.082 weight 1.000 ! spec=n15n...hn-2, no=782, id=547, vol=4.978000e-01 assign (segid " " and resid 157 and name HN) (segid " " and resid 153 and name HA) 2.977 1.108 3.023 weight 1.000 ! spec=n15n...hn-2, no=784, id=549, vol=4.642000e-01 assign (segid " " and resid 157 and name HN) (segid " " and resid 157 and name HA) 2.493 0.777 0.777 weight 1.000 ! spec=n15n...hn-2, no=785, id=550, vol=1.345100e+00 assign (segid " " and resid 157 and name HN) (segid " " and resid 157 and name HG2) 2.669 0.891 0.891 weight 1.000 ! spec=n15n...hn-2, no=786, id=551, vol=8.938000e-01 assign (segid " " and resid 157 and name HN) (segid " " and resid 157 and name HB2) 2.303 0.663 0.663 weight 1.000 ! spec=n15n...hn-2, no=787, id=552, vol=2.166300e+00 assign (segid " " and resid 157 and name HN) (segid " " and resid 157 and name HG1) 2.439 0.743 0.743 weight 1.000 ! spec=n15n...hn-2, no=788, id=553, vol=1.537400e+00 assign (segid " " and resid 157 and name HN) (segid " " and resid 156 and name HG11) 2.749 0.944 0.944 weight 1.000 ! spec=n15n...hn-2, no=790, id=554, vol=7.497000e-01 assign (segid " " and resid 135 and name HN) (segid " " and resid 135 and name HA) 2.738 0.937 0.937 weight 1.000 ! spec=n15n...hn-2, no=792, id=556, vol=7.679000e-01 assign (segid " " and resid 126 and name HN) (segid " " and resid 125 and name HN) 2.445 0.747 0.747 weight 1.000 ! spec=n15n...hn-2, no=794, id=557, vol=1.514700e+00 assign (segid " " and resid 124 and name HN) (segid " " and resid 125 and name HN) 2.658 0.883 0.883 weight 1.000 ! spec=n15n...hn-2, no=795, id=558, vol=9.173000e-01 assign (segid " " and resid 125 and name HN) (segid " " and resid 121 and name HA) 2.586 0.836 3.414 weight 1.000 ! spec=n15n...hn-2, no=797, id=560, vol=1.079800e+00 assign (segid " " and resid 125 and name HN) (segid " " and resid 124 and name HA) 2.952 1.089 1.089 weight 1.000 ! spec=n15n...hn-2, no=799, id=562, vol=4.885000e-01 assign (segid " " and resid 125 and name HN) (segid " " and resid 124 and name HG21) 2.445 0.747 0.747 weight 1.000 ! spec=n15n...hn-2, no=800, id=563, vol=1.514100e+00 assign (segid " " and resid 172 and name HN) (segid " " and resid 173 and name HN) 2.594 0.841 0.841 weight 1.000 ! spec=n15n...hn-2, no=802, id=564, vol=1.060500e+00 assign (segid " " and resid 179 and name HN) (segid " " and resid 180 and name HN) 2.464 0.759 0.759 weight 1.000 ! spec=n15n...hn-2, no=803, id=565, vol=1.445900e+00 assign (segid " " and resid 174 and name HN) (segid " " and resid 173 and name HN) 2.425 0.735 0.735 weight 1.000 ! spec=n15n...hn-2, no=804, id=566, vol=1.590300e+00 assign (segid " " and resid 180 and name HN) (segid " " and resid 180 and name HA) 2.656 0.882 0.882 weight 1.000 ! spec=n15n...hn-2, no=805, id=567, vol=9.206000e-01 assign (segid " " and resid 173 and name HN) (segid " " and resid 173 and name HA) 2.461 0.757 0.757 weight 1.000 ! spec=n15n...hn-2, no=806, id=568, vol=1.455400e+00 assign (segid " " and resid 180 and name HN) (segid " " and resid 176 and name HA) 3.102 1.203 1.203 weight 1.000 ! spec=n15n...hn-2, no=807, id=569, vol=3.625000e-01 assign (segid " " and resid 180 and name HN) (segid " " and resid 179 and name HA) 2.389 0.714 0.714 weight 1.000 ! spec=n15n...hn-2, no=808, id=570, vol=1.738000e+00 assign (segid " " and resid 173 and name HN) (segid " " and resid 172 and name HB2) 2.660 0.884 0.884 weight 1.000 ! spec=n15n...hn-2, no=809, id=571, vol=9.131000e-01 assign (segid " " and resid 180 and name HN) (segid " " and resid 180 and name HB2) 2.400 0.720 0.720 weight 1.000 ! spec=n15n...hn-2, no=810, id=572, vol=1.692100e+00 assign (segid " " and resid 180 and name HN) (segid " " and resid 180 and name HB1) 2.438 0.743 0.743 weight 1.000 ! spec=n15n...hn-2, no=811, id=573, vol=1.540900e+00 assign (segid " " and resid 173 and name HN) (segid " " and resid 173 and name HB2) 2.383 0.710 0.710 weight 1.000 ! spec=n15n...hn-2, no=813, id=575, vol=1.763800e+00 assign (segid " " and resid 173 and name HN) (segid " " and resid 173 and name HG) 2.408 0.725 1.725 weight 1.000 ! spec=n15n...hn-2, no=814, id=576, vol=1.656600e+00 assign (segid " " and resid 180 and name HN) (segid " " and resid 179 and name HB1) 2.919 1.065 1.065 weight 1.000 ! spec=n15n...hn-2, no=815, id=577, vol=5.224000e-01 assign (segid " " and resid 180 and name HN) (segid " " and resid 179 and name HB2) 3.110 1.209 1.209 weight 1.000 ! spec=n15n...hn-2, no=816, id=578, vol=3.576000e-01 assign (segid " " and resid 173 and name HN) (segid " " and resid 173 and name HB1) 2.524 0.796 3.476 weight 1.000 ! spec=n15n...hn-2, no=817, id=579, vol=1.250400e+00 assign (segid " " and resid 180 and name HN) (segid " " and resid 175 and name HB1) 3.144 1.236 1.236 weight 1.000 ! spec=n15n...hn-2, no=818, id=580, vol=3.347000e-01 assign (segid " " and resid 173 and name HN) (segid " " and resid 172 and name HG2) 2.833 1.003 1.003 weight 1.000 ! spec=n15n...hn-2, no=819, id=581, vol=6.250000e-01 assign (segid " " and resid 173 and name HN) (segid " " and resid 170 and name HG21) 3.143 1.235 2.857 weight 1.000 ! spec=n15n...hn-2, no=820, id=582, vol=3.353000e-01 assign (segid " " and resid 180 and name HN) (segid " " and resid 175 and name HD21) 2.942 1.082 1.082 weight 1.000 ! spec=n15n...hn-2, no=821, id=583, vol=4.985000e-01 assign (segid " " and resid 173 and name HN) (segid " " and resid 173 and name HD11) 2.567 0.823 3.433 weight 1.000 ! spec=n15n...hn-2, no=822, id=584, vol=1.131100e+00 assign (segid " " and resid 159 and name HN) (segid " " and resid 160 and name HN) 2.469 0.762 0.762 weight 1.000 ! spec=n15n...hn-2, no=826, id=585, vol=1.428100e+00 assign (segid " " and resid 160 and name HN) (segid " " and resid 161 and name HN) 2.559 0.818 0.818 weight 1.000 ! spec=n15n...hn-2, no=827, id=586, vol=1.151700e+00 assign (segid " " and resid 160 and name HN) (segid " " and resid 160 and name HA) 2.625 0.861 0.861 weight 1.000 ! spec=n15n...hn-2, no=828, id=587, vol=9.878000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 157 and name HA) 3.060 1.170 1.170 weight 1.000 ! spec=n15n...hn-2, no=829, id=588, vol=3.938000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 160 and name HB2) 2.221 0.617 0.617 weight 1.000 ! spec=n15n...hn-2, no=830, id=589, vol=2.694500e+00 assign (segid " " and resid 160 and name HN) (segid " " and resid 160 and name HB1) 2.554 0.815 0.815 weight 1.000 ! spec=n15n...hn-2, no=831, id=590, vol=1.164300e+00 assign (segid " " and resid 160 and name HN) (segid " " and resid 159 and name HB2) 2.858 1.021 1.021 weight 1.000 ! spec=n15n...hn-2, no=832, id=591, vol=5.927000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 160 and name HD21) 2.745 0.942 0.942 weight 1.000 ! spec=n15n...hn-2, no=833, id=592, vol=7.562000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 107 and name HD11) 3.083 1.188 1.188 weight 1.000 ! spec=n15n...hn-2, no=835, id=594, vol=3.765000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 159 and name HB1) 3.091 1.194 1.194 weight 1.000 ! spec=n15n...hn-2, no=836, id=595, vol=3.710000e-01 assign (segid " " and resid 111 and name HN) (segid " " and resid 110 and name HN) 2.500 0.781 0.781 weight 1.000 ! spec=n15n...hn-2, no=839, id=596, vol=1.324300e+00 assign (segid " " and resid 110 and name HN) (segid " " and resid 110 and name HA) 2.980 1.110 1.110 weight 1.000 ! spec=n15n...hn-2, no=840, id=597, vol=4.613000e-01 assign (segid " " and resid 110 and name HN) (segid " " and resid 107 and name HA) 3.094 1.197 1.197 weight 1.000 ! spec=n15n...hn-2, no=841, id=598, vol=3.686000e-01 assign (segid " " and resid 110 and name HN) (segid " " and resid 110 and name HB2) 2.458 0.756 0.756 weight 1.000 ! spec=n15n...hn-2, no=843, id=600, vol=1.464100e+00 assign (segid " " and resid 110 and name HN) (segid " " and resid 109 and name HB2) 2.312 0.668 0.668 weight 1.000 ! spec=n15n...hn-2, no=844, id=601, vol=2.115100e+00 assign (segid " " and resid 110 and name HN) (segid " " and resid 110 and name HD11) 2.948 1.086 3.052 weight 1.000 ! spec=n15n...hn-2, no=845, id=602, vol=4.925000e-01 assign (segid " " and resid 110 and name HN) (segid " " and resid 110 and name HD21) 2.741 0.939 0.939 weight 1.000 ! spec=n15n...hn-2, no=846, id=603, vol=7.616000e-01 assign (segid " " and resid 137 and name HN) (segid " " and resid 136 and name HN) 2.493 0.777 0.777 weight 1.000 ! spec=n15n...hn-2, no=849, id=604, vol=1.346800e+00 assign (segid " " and resid 137 and name HN) (segid " " and resid 137 and name HA) 2.424 0.734 0.734 weight 1.000 ! spec=n15n...hn-2, no=851, id=606, vol=1.595100e+00 assign (segid " " and resid 137 and name HN) (segid " " and resid 136 and name HB2) 2.562 0.821 0.821 weight 1.000 ! spec=n15n...hn-2, no=852, id=607, vol=1.142500e+00 assign (segid " " and resid 137 and name HN) (segid " " and resid 136 and name HB1) 2.710 0.918 0.918 weight 1.000 ! spec=n15n...hn-2, no=853, id=608, vol=8.154000e-01 assign (segid " " and resid 137 and name HN) (segid " " and resid 137 and name HG2) 2.549 0.812 0.812 weight 1.000 ! spec=n15n...hn-2, no=854, id=609, vol=1.177300e+00 assign (segid " " and resid 137 and name HN) (segid " " and resid 137 and name HB2) 2.168 0.588 0.588 weight 1.000 ! spec=n15n...hn-2, no=856, id=611, vol=3.111500e+00 assign (segid " " and resid 114 and name HN) (segid " " and resid 113 and name HN) 2.427 0.736 0.736 weight 1.000 ! spec=n15n...hn-2, no=857, id=612, vol=1.581600e+00 assign (segid " " and resid 113 and name HN) (segid " " and resid 113 and name HA) 2.546 0.810 0.810 weight 1.000 ! spec=n15n...hn-2, no=860, id=613, vol=1.186400e+00 assign (segid " " and resid 113 and name HN) (segid " " and resid 112 and name HD2) 2.666 0.888 0.888 weight 1.000 ! spec=n15n...hn-2, no=861, id=614, vol=9.011000e-01 assign (segid " " and resid 113 and name HN) (segid " " and resid 112 and name HB2) 2.648 0.876 0.876 weight 1.000 ! spec=n15n...hn-2, no=863, id=616, vol=9.377000e-01 assign (segid " " and resid 113 and name HN) (segid " " and resid 110 and name HB2) 3.022 1.141 2.978 weight 1.000 ! spec=n15n...hn-2, no=864, id=617, vol=4.245000e-01 assign (segid " " and resid 113 and name HN) (segid " " and resid 112 and name HB1) 2.766 0.956 3.234 weight 1.000 ! spec=n15n...hn-2, no=865, id=618, vol=7.225000e-01 assign (segid " " and resid 113 and name HN) (segid " " and resid 113 and name HB1) 2.601 0.846 0.846 weight 1.000 ! spec=n15n...hn-2, no=866, id=619, vol=1.043600e+00 assign (segid " " and resid 135 and name HN) (segid " " and resid 136 and name HN) 2.457 0.754 0.754 weight 1.000 ! spec=n15n...hn-2, no=870, id=621, vol=1.470700e+00 assign (segid " " and resid 136 and name HN) (segid " " and resid 133 and name HA) 3.138 1.231 1.231 weight 1.000 ! spec=n15n...hn-2, no=871, id=622, vol=3.383000e-01 assign (segid " " and resid 136 and name HN) (segid " " and resid 135 and name HA) 3.152 1.242 1.242 weight 1.000 ! spec=n15n...hn-2, no=872, id=623, vol=3.297000e-01 assign (segid " " and resid 136 and name HN) (segid " " and resid 136 and name HA) 2.710 0.918 0.918 weight 1.000 ! spec=n15n...hn-2, no=873, id=624, vol=8.157000e-01 assign (segid " " and resid 136 and name HN) (segid " " and resid 136 and name HB2) 2.539 0.806 0.806 weight 1.000 ! spec=n15n...hn-2, no=874, id=625, vol=1.205700e+00 assign (segid " " and resid 136 and name HN) (segid " " and resid 136 and name HB1) 2.725 0.928 0.928 weight 1.000 ! spec=n15n...hn-2, no=875, id=626, vol=7.901000e-01 assign (segid " " and resid 136 and name HN) (segid " " and resid 135 and name HB2) 2.809 0.986 0.986 weight 1.000 ! spec=n15n...hn-2, no=876, id=627, vol=6.578000e-01 assign (segid " " and resid 136 and name HN) (segid " " and resid 135 and name HB1) 2.839 1.007 1.007 weight 1.000 ! spec=n15n...hn-2, no=877, id=628, vol=6.180000e-01 assign (segid " " and resid 129 and name HN) (segid " " and resid 128 and name HN) 2.593 0.841 0.841 weight 1.000 ! spec=n15n...hn-2, no=878, id=629, vol=1.062800e+00 assign (segid " " and resid 128 and name HN) (segid " " and resid 130 and name HN) 3.087 1.191 2.913 weight 1.000 ! spec=n15n...hn-2, no=879, id=630, vol=3.735000e-01 assign (segid " " and resid 128 and name HN) (segid " " and resid 127 and name HA) 2.755 0.948 0.948 weight 1.000 ! spec=n15n...hn-2, no=881, id=631, vol=7.400000e-01 assign (segid " " and resid 128 and name HN) (segid " " and resid 128 and name HA) 2.925 1.069 1.069 weight 1.000 ! spec=n15n...hn-2, no=882, id=632, vol=5.165000e-01 assign (segid " " and resid 128 and name HN) (segid " " and resid 128 and name HB2) 2.144 0.575 0.575 weight 1.000 ! spec=n15n...hn-2, no=883, id=633, vol=3.325900e+00 assign (segid " " and resid 128 and name HN) (segid " " and resid 127 and name HB1) 3.019 1.140 1.140 weight 1.000 ! spec=n15n...hn-2, no=884, id=634, vol=4.267000e-01 assign (segid " " and resid 148 and name HN) (segid " " and resid 147 and name HA2) 2.457 0.755 0.755 weight 1.000 ! spec=n15n...hn-2, no=887, id=636, vol=1.469300e+00 assign (segid " " and resid 148 and name HN) (segid " " and resid 148 and name HA) 2.617 0.856 0.856 weight 1.000 ! spec=n15n...hn-2, no=888, id=637, vol=1.005700e+00 assign (segid " " and resid 148 and name HN) (segid " " and resid 147 and name HA1) 2.457 0.755 0.755 weight 1.000 ! spec=n15n...hn-2, no=889, id=638, vol=1.469400e+00 assign (segid " " and resid 148 and name HN) (segid " " and resid 148 and name HB2) 2.628 0.864 0.864 weight 1.000 ! spec=n15n...hn-2, no=891, id=640, vol=9.806000e-01 assign (segid " " and resid 148 and name HN) (segid " " and resid 148 and name HB1) 2.805 0.984 0.984 weight 1.000 ! spec=n15n...hn-2, no=892, id=641, vol=6.636000e-01 assign (segid " " and resid 176 and name HN) (segid " " and resid 175 and name HN) 2.488 0.774 0.774 weight 1.000 ! spec=n15n...hn-2, no=894, id=642, vol=1.363800e+00 assign (segid " " and resid 174 and name HN) (segid " " and resid 175 and name HN) 2.562 0.821 0.821 weight 1.000 ! spec=n15n...hn-2, no=896, id=643, vol=1.142000e+00 assign (segid " " and resid 175 and name HN) (segid " " and resid 174 and name HA) 2.859 1.022 1.022 weight 1.000 ! spec=n15n...hn-2, no=897, id=644, vol=5.915000e-01 assign (segid " " and resid 175 and name HN) (segid " " and resid 173 and name HA) 3.066 1.175 1.175 weight 1.000 ! spec=n15n...hn-2, no=898, id=645, vol=3.891000e-01 assign (segid " " and resid 175 and name HN) (segid " " and resid 175 and name HA) 2.690 0.904 0.904 weight 1.000 ! spec=n15n...hn-2, no=899, id=646, vol=8.536000e-01 assign (segid " " and resid 175 and name HN) (segid " " and resid 175 and name HG) 2.422 0.733 1.733 weight 1.000 ! spec=n15n...hn-2, no=900, id=647, vol=1.602800e+00 assign (segid " " and resid 175 and name HN) (segid " " and resid 175 and name HB2) 2.485 0.772 0.772 weight 1.000 ! spec=n15n...hn-2, no=901, id=648, vol=1.372100e+00 assign (segid " " and resid 132 and name HN) (segid " " and resid 132 and name HB) 2.651 0.879 0.879 weight 1.000 ! spec=n15n...hn-2, no=902, id=649, vol=9.305000e-01 assign (segid " " and resid 175 and name HN) (segid " " and resid 174 and name HB1) 2.381 0.709 3.619 weight 1.000 ! spec=n15n...hn-2, no=903, id=650, vol=1.773700e+00 assign (segid " " and resid 175 and name HN) (segid " " and resid 175 and name HB1) 2.556 0.816 0.816 weight 1.000 ! spec=n15n...hn-2, no=904, id=651, vol=1.160300e+00 assign (segid " " and resid 132 and name HN) (segid " " and resid 132 and name HG21) 2.535 0.803 3.465 weight 1.000 ! spec=n15n...hn-2, no=905, id=652, vol=1.218400e+00 assign (segid " " and resid 175 and name HN) (segid " " and resid 175 and name HD21) 2.724 0.928 3.276 weight 1.000 ! spec=n15n...hn-2, no=906, id=653, vol=7.908000e-01 assign (segid " " and resid 132 and name HN) (segid " " and resid 132 and name HA) 2.743 0.941 0.941 weight 1.000 ! spec=n15n...hn-2, no=909, id=655, vol=7.584000e-01 assign (segid " " and resid 132 and name HN) (segid " " and resid 131 and name HA) 2.279 0.649 0.649 weight 1.000 ! spec=n15n...hn-2, no=910, id=656, vol=2.304800e+00 assign (segid " " and resid 132 and name HN) (segid " " and resid 132 and name HG12) 2.265 0.641 0.641 weight 1.000 ! spec=n15n...hn-2, no=911, id=657, vol=2.395900e+00 assign (segid " " and resid 160 and name HN) (segid " " and resid 160 and name HD11) 2.791 0.974 0.974 weight 1.000 ! spec=n15n...hn-2, no=913, id=659, vol=6.833000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 108 and name HN) 2.695 0.908 0.908 weight 1.000 ! spec=n15n...hn-2, no=915, id=660, vol=8.439000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 106 and name HA) 3.025 1.144 1.144 weight 1.000 ! spec=n15n...hn-2, no=918, id=661, vol=4.222000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 105 and name HA) 2.849 1.015 1.015 weight 1.000 ! spec=n15n...hn-2, no=919, id=662, vol=6.047000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 108 and name HA) 2.552 0.814 0.814 weight 1.000 ! spec=n15n...hn-2, no=920, id=663, vol=1.169300e+00 assign (segid " " and resid 108 and name HN) (segid " " and resid 107 and name HB2) 2.779 0.966 0.966 weight 1.000 ! spec=n15n...hn-2, no=921, id=664, vol=7.015000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 108 and name HB2) 2.161 0.584 0.584 weight 1.000 ! spec=n15n...hn-2, no=922, id=665, vol=3.171300e+00 assign (segid " " and resid 108 and name HN) (segid " " and resid 107 and name HB1) 2.768 0.958 0.958 weight 1.000 ! spec=n15n...hn-2, no=923, id=666, vol=7.186000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 105 and name HB2) 3.144 1.235 2.856 weight 1.000 ! spec=n15n...hn-2, no=924, id=667, vol=3.349000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 108 and name HG1) 2.697 0.909 0.909 weight 1.000 ! spec=n15n...hn-2, no=925, id=668, vol=8.399000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 108 and name HG2) 3.150 1.240 1.240 weight 1.000 ! spec=n15n...hn-2, no=926, id=669, vol=3.311000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 160 and name HD11) 2.875 1.033 1.033 weight 1.000 ! spec=n15n...hn-2, no=927, id=670, vol=5.723000e-01 assign (segid " " and resid 158 and name HN) (segid " " and resid 158 and name HA) 2.421 0.732 0.732 weight 1.000 ! spec=n15n...hn-2, no=933, id=672, vol=1.607300e+00 assign (segid " " and resid 158 and name HN) (segid " " and resid 157 and name HA) 2.905 1.055 1.055 weight 1.000 ! spec=n15n...hn-2, no=934, id=673, vol=5.376000e-01 assign (segid " " and resid 158 and name HN) (segid " " and resid 158 and name HB1) 2.500 0.781 3.500 weight 1.000 ! spec=n15n...hn-2, no=935, id=674, vol=1.323900e+00 assign (segid " " and resid 158 and name HN) (segid " " and resid 158 and name HB2) 2.551 0.814 0.814 weight 1.000 ! spec=n15n...hn-2, no=936, id=675, vol=1.172800e+00 assign (segid " " and resid 158 and name HN) (segid " " and resid 157 and name HB2) 2.586 0.836 0.836 weight 1.000 ! spec=n15n...hn-2, no=937, id=676, vol=1.080100e+00 assign (segid " " and resid 185 and name HN) (segid " " and resid 184 and name HN) 2.578 0.831 0.831 weight 1.000 ! spec=n15n...hn-2, no=939, id=678, vol=1.102200e+00 assign (segid " " and resid 185 and name HN) (segid " " and resid 185 and name HA) 2.756 0.949 0.949 weight 1.000 ! spec=n15n...hn-2, no=942, id=680, vol=7.384000e-01 assign (segid " " and resid 185 and name HN) (segid " " and resid 184 and name HB2) 2.981 1.110 1.110 weight 1.000 ! spec=n15n...hn-2, no=943, id=681, vol=4.611000e-01 assign (segid " " and resid 185 and name HN) (segid " " and resid 185 and name HG) 2.524 0.796 0.796 weight 1.000 ! spec=n15n...hn-2, no=944, id=682, vol=1.249600e+00 assign (segid " " and resid 185 and name HN) (segid " " and resid 185 and name HB1) 2.689 0.904 0.904 weight 1.000 ! spec=n15n...hn-2, no=945, id=683, vol=8.548000e-01 assign (segid " " and resid 185 and name HN) (segid " " and resid 185 and name HD21) 2.755 0.949 0.949 weight 1.000 ! spec=n15n...hn-2, no=946, id=684, vol=7.387000e-01 assign (segid " " and resid 129 and name HN) (segid " " and resid 130 and name HN) 2.403 0.722 0.722 weight 1.000 ! spec=n15n...hn-2, no=947, id=685, vol=1.677100e+00 assign (segid " " and resid 130 and name HN) (segid " " and resid 130 and name HA) 2.739 0.938 0.938 weight 1.000 ! spec=n15n...hn-2, no=951, id=688, vol=7.648000e-01 assign (segid " " and resid 130 and name HN) (segid " " and resid 129 and name HA) 2.835 1.005 1.005 weight 1.000 ! spec=n15n...hn-2, no=952, id=689, vol=6.226000e-01 assign (segid " " and resid 130 and name HN) (segid " " and resid 130 and name HB2) 2.632 0.866 0.866 weight 1.000 ! spec=n15n...hn-2, no=954, id=691, vol=9.724000e-01 assign (segid " " and resid 130 and name HN) (segid " " and resid 130 and name HB1) 2.839 1.007 1.007 weight 1.000 ! spec=n15n...hn-2, no=955, id=692, vol=6.175000e-01 assign (segid " " and resid 130 and name HN) (segid " " and resid 129 and name HB1) 3.164 1.252 1.252 weight 1.000 ! spec=n15n...hn-2, no=957, id=694, vol=3.220000e-01 assign (segid " " and resid 184 and name HN) (segid " " and resid 184 and name HA) 2.534 0.803 0.803 weight 1.000 ! spec=n15n...hn-2, no=965, id=698, vol=1.221500e+00 assign (segid " " and resid 184 and name HN) (segid " " and resid 184 and name HG2) 2.592 0.840 0.840 weight 1.000 ! spec=n15n...hn-2, no=966, id=699, vol=1.064800e+00 assign (segid " " and resid 184 and name HN) (segid " " and resid 184 and name HB2) 2.433 0.740 0.740 weight 1.000 ! spec=n15n...hn-2, no=967, id=700, vol=1.558900e+00 assign (segid " " and resid 185 and name HN) (segid " " and resid 182 and name HA) 3.142 1.234 1.234 weight 1.000 ! spec=n15n...hn-2, no=969, id=701, vol=3.360000e-01 assign (segid " " and resid 185 and name HN) (segid " " and resid 184 and name HA) 2.980 1.110 1.110 weight 1.000 ! spec=n15n...hn-2, no=970, id=702, vol=4.618000e-01 assign (segid " " and resid 162 and name HN) (segid " " and resid 131 and name HA) 3.117 1.214 2.883 weight 1.000 ! spec=n15n...hn-2, no=973, id=703, vol=3.528000e-01 assign (segid " " and resid 162 and name HN) (segid " " and resid 161 and name HA) 2.856 1.020 1.020 weight 1.000 ! spec=n15n...hn-2, no=974, id=704, vol=5.954000e-01 assign (segid " " and resid 162 and name HN) (segid " " and resid 162 and name HA) 2.590 0.838 0.838 weight 1.000 ! spec=n15n...hn-2, no=975, id=705, vol=1.071900e+00 assign (segid " " and resid 162 and name HN) (segid " " and resid 162 and name HB2) 2.380 0.708 0.708 weight 1.000 ! spec=n15n...hn-2, no=976, id=706, vol=1.780700e+00 assign (segid " " and resid 162 and name HN) (segid " " and resid 162 and name HB1) 2.400 0.720 0.720 weight 1.000 ! spec=n15n...hn-2, no=977, id=707, vol=1.691700e+00 assign (segid " " and resid 162 and name HN) (segid " " and resid 159 and name HA) 2.875 1.033 1.033 weight 1.000 ! spec=n15n...hn-2, no=978, id=708, vol=5.729000e-01 assign (segid " " and resid 180 and name HD21) (segid " " and resid 180 and name HB2) 2.971 1.104 1.104 weight 1.000 ! spec=n15n...hn-2, no=982, id=711, vol=4.696000e-01 assign (segid " " and resid 177 and name HN) (segid " " and resid 178 and name HN) 2.662 0.886 0.886 weight 1.000 ! spec=n15n...hn-2, no=988, id=712, vol=9.088000e-01 assign (segid " " and resid 179 and name HN) (segid " " and resid 178 and name HN) 2.445 0.747 0.747 weight 1.000 ! spec=n15n...hn-2, no=989, id=713, vol=1.513700e+00 assign (segid " " and resid 178 and name HN) (segid " " and resid 178 and name HG2) 2.715 0.921 0.921 weight 1.000 ! spec=n15n...hn-2, no=991, id=714, vol=8.073000e-01 assign (segid " " and resid 178 and name HN) (segid " " and resid 178 and name HG1) 2.840 1.008 1.008 weight 1.000 ! spec=n15n...hn-2, no=992, id=715, vol=6.157000e-01 assign (segid " " and resid 178 and name HN) (segid " " and resid 177 and name HB2) 2.536 0.804 0.804 weight 1.000 ! spec=n15n...hn-2, no=993, id=716, vol=1.214300e+00 assign (segid " " and resid 178 and name HN) (segid " " and resid 178 and name HB1) 2.592 0.840 0.840 weight 1.000 ! spec=n15n...hn-2, no=994, id=717, vol=1.066800e+00 assign (segid " " and resid 178 and name HN) (segid " " and resid 178 and name HA) 2.764 0.955 0.955 weight 1.000 ! spec=n15n...hn-2, no=995, id=718, vol=7.253000e-01 assign (segid " " and resid 161 and name HN) (segid " " and resid 162 and name HB1) 3.099 1.200 1.200 weight 1.000 ! spec=n15n...hn-2, no=1001, id=719, vol=3.652000e-01 assign (segid " " and resid 180 and name HD21) (segid " " and resid 180 and name HD22) 2.121 0.562 0.562 weight 1.000 ! spec=n15n...hn-2, no=1002, id=720, vol=3.553800e+00 assign (segid " " and resid 180 and name HD22) (segid " " and resid 180 and name HB2) 2.858 1.021 1.021 weight 1.000 ! spec=n15n...hn-2, no=1003, id=721, vol=5.931000e-01 assign (segid " " and resid 180 and name HD22) (segid " " and resid 180 and name HB1) 3.176 1.261 1.261 weight 1.000 ! spec=n15n...hn-2, no=1004, id=722, vol=3.149000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 112 and name HA) 3.110 1.209 1.209 weight 1.000 ! spec=n15n...hn-2, no=1006, id=723, vol=3.576000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 114 and name HA) 3.024 1.143 1.143 weight 1.000 ! spec=n15n...hn-2, no=1007, id=724, vol=4.224000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 115 and name HN) 2.695 0.908 0.908 weight 1.000 ! spec=n15n...hn-2, no=1008, id=725, vol=8.436000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 114 and name HD1) 3.061 1.171 1.171 weight 1.000 ! spec=n15n...hn-2, no=1011, id=727, vol=3.933000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 115 and name HA) 2.649 0.877 0.877 weight 1.000 ! spec=n15n...hn-2, no=1012, id=728, vol=9.365000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 114 and name HB2) 2.675 0.894 0.894 weight 1.000 ! spec=n15n...hn-2, no=1013, id=729, vol=8.828000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 114 and name HB1) 2.799 0.979 0.979 weight 1.000 ! spec=n15n...hn-2, no=1014, id=730, vol=6.725000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 115 and name HB2) 2.615 0.855 0.855 weight 1.000 ! spec=n15n...hn-2, no=1015, id=731, vol=1.011400e+00 assign (segid " " and resid 115 and name HN) (segid " " and resid 115 and name HB1) 2.705 0.915 0.915 weight 1.000 ! spec=n15n...hn-2, no=1016, id=732, vol=8.249000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 115 and name HD2) 2.539 0.806 0.806 weight 1.000 ! spec=n15n...hn-2, no=1018, id=734, vol=1.205400e+00 assign (segid " " and resid 161 and name HN) (segid " " and resid 161 and name HA) 2.482 0.770 0.770 weight 1.000 ! spec=n15n...hn-2, no=1025, id=735, vol=1.382500e+00 assign (segid " " and resid 161 and name HN) (segid " " and resid 158 and name HA) 2.772 0.961 0.961 weight 1.000 ! spec=n15n...hn-2, no=1026, id=736, vol=7.121000e-01 assign (segid " " and resid 161 and name HN) (segid " " and resid 161 and name HD2) 3.013 1.135 1.135 weight 1.000 ! spec=n15n...hn-2, no=1027, id=737, vol=4.317000e-01 assign (segid " " and resid 161 and name HN) (segid " " and resid 160 and name HB2) 2.321 0.674 0.674 weight 1.000 ! spec=n15n...hn-2, no=1029, id=738, vol=2.066300e+00 assign (segid " " and resid 161 and name HN) (segid " " and resid 160 and name HB1) 2.986 1.114 1.114 weight 1.000 ! spec=n15n...hn-2, no=1031, id=740, vol=4.564000e-01 assign (segid " " and resid 161 and name HN) (segid " " and resid 159 and name HN) 3.040 1.155 1.155 weight 1.000 ! spec=n15n...hn-2, no=1033, id=742, vol=4.095000e-01 assign (segid " " and resid 166 and name HD21) (segid " " and resid 166 and name HB2) 2.893 1.047 1.047 weight 1.000 ! spec=n15n...hn-2, no=1055, id=744, vol=5.509000e-01 assign (segid " " and resid 166 and name HD21) (segid " " and resid 166 and name HB1) 3.141 1.233 1.233 weight 1.000 ! spec=n15n...hn-2, no=1056, id=745, vol=3.366000e-01 assign (segid " " and resid 166 and name HD21) (segid " " and resid 166 and name HD22) 1.865 0.435 0.435 weight 1.000 ! spec=n15n...hn-2, no=1067, id=746, vol=7.684500e+00 assign (segid " " and resid 166 and name HD22) (segid " " and resid 166 and name HB2) 3.093 1.196 1.196 weight 1.000 ! spec=n15n...hn-2, no=1069, id=747, vol=3.689000e-01 assign (segid " " and resid 165 and name HN) (segid " " and resid 166 and name HN) 2.528 0.799 0.799 weight 1.000 ! spec=n15n...hn-2, no=1070, id=748, vol=1.239100e+00 assign (segid " " and resid 166 and name HN) (segid " " and resid 166 and name HA) 2.596 0.843 0.843 weight 1.000 ! spec=n15n...hn-2, no=1072, id=749, vol=1.055600e+00 assign (segid " " and resid 166 and name HN) (segid " " and resid 164 and name HA) 3.083 1.188 1.188 weight 1.000 ! spec=n15n...hn-2, no=1074, id=750, vol=3.763000e-01 assign (segid " " and resid 166 and name HN) (segid " " and resid 165 and name HA) 2.855 1.019 1.019 weight 1.000 ! spec=n15n...hn-2, no=1075, id=751, vol=5.974000e-01 assign (segid " " and resid 166 and name HN) (segid " " and resid 166 and name HB2) 2.575 0.829 0.829 weight 1.000 ! spec=n15n...hn-2, no=1076, id=752, vol=1.107900e+00 assign (segid " " and resid 166 and name HN) (segid " " and resid 166 and name HB1) 2.661 0.885 0.885 weight 1.000 ! spec=n15n...hn-2, no=1077, id=753, vol=9.106000e-01 assign (segid " " and resid 143 and name HN) (segid " " and resid 144 and name HN) 2.447 0.748 0.748 weight 1.000 ! spec=n15n...hn-2, no=1080, id=756, vol=1.507100e+00 assign (segid " " and resid 144 and name HN) (segid " " and resid 145 and name HN) 2.384 0.711 0.711 weight 1.000 ! spec=n15n...hn-2, no=1081, id=757, vol=1.758800e+00 assign (segid " " and resid 144 and name HN) (segid " " and resid 144 and name HB2) 2.184 0.596 0.596 weight 1.000 ! spec=n15n...hn-2, no=1085, id=758, vol=2.976300e+00 assign (segid " " and resid 144 and name HN) (segid " " and resid 144 and name HA) 2.382 0.709 0.709 weight 1.000 ! spec=n15n...hn-2, no=1086, id=759, vol=1.771800e+00 assign (segid " " and resid 144 and name HN) (segid " " and resid 143 and name HA) 2.613 0.854 0.854 weight 1.000 ! spec=n15n...hn-2, no=1087, id=760, vol=1.015400e+00 assign (segid " " and resid 144 and name HN) (segid " " and resid 140 and name HA) 3.095 1.197 1.197 weight 1.000 ! spec=n15n...hn-2, no=1088, id=761, vol=3.677000e-01 assign (segid " " and resid 144 and name HN) (segid " " and resid 143 and name HB2) 2.582 0.833 0.833 weight 1.000 ! spec=n15n...hn-2, no=1089, id=762, vol=1.090700e+00 assign (segid " " and resid 144 and name HN) (segid " " and resid 143 and name HB1) 2.754 0.948 0.948 weight 1.000 ! spec=n15n...hn-2, no=1090, id=763, vol=7.414000e-01 assign (segid " " and resid 144 and name HN) (segid " " and resid 145 and name HG21) 3.109 1.209 1.209 weight 1.000 ! spec=n15n...hn-2, no=1091, id=764, vol=3.577000e-01 assign (segid " " and resid 182 and name HN) (segid " " and resid 183 and name HN) 2.629 0.864 0.864 weight 1.000 ! spec=n15n...hn-2, no=1110, id=765, vol=9.798000e-01 assign (segid " " and resid 184 and name HN) (segid " " and resid 183 and name HN) 2.719 0.924 0.924 weight 1.000 ! spec=n15n...hn-2, no=1112, id=766, vol=8.009000e-01 assign (segid " " and resid 183 and name HN) (segid " " and resid 181 and name HA) 2.901 1.052 3.099 weight 1.000 ! spec=n15n...hn-2, no=1114, id=768, vol=5.421000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 145 and name HN) 2.290 0.656 0.656 weight 1.000 ! spec=n15n...hn-2, no=1115, id=769, vol=2.239900e+00 assign (segid " " and resid 145 and name HN) (segid " " and resid 147 and name HA2) 2.883 1.039 3.117 weight 1.000 ! spec=n15n...hn-2, no=1122, id=772, vol=5.625000e-01 assign (segid " " and resid 145 and name HN) (segid " " and resid 145 and name HA) 2.484 0.771 0.771 weight 1.000 ! spec=n15n...hn-2, no=1123, id=773, vol=1.377400e+00 assign (segid " " and resid 145 and name HN) (segid " " and resid 145 and name HB) 2.637 0.870 0.870 weight 1.000 ! spec=n15n...hn-2, no=1124, id=774, vol=9.604000e-01 assign (segid " " and resid 145 and name HN) (segid " " and resid 144 and name HA) 2.805 0.984 0.984 weight 1.000 ! spec=n15n...hn-2, no=1125, id=775, vol=6.634000e-01 assign (segid " " and resid 145 and name HN) (segid " " and resid 142 and name HA) 2.858 1.021 1.021 weight 1.000 ! spec=n15n...hn-2, no=1126, id=776, vol=5.927000e-01 assign (segid " " and resid 145 and name HN) (segid " " and resid 144 and name HB2) 2.552 0.814 0.814 weight 1.000 ! spec=n15n...hn-2, no=1127, id=777, vol=1.171300e+00 assign (segid " " and resid 145 and name HN) (segid " " and resid 145 and name HG21) 2.385 0.711 0.711 weight 1.000 ! spec=n15n...hn-2, no=1128, id=778, vol=1.758000e+00 assign (segid " " and resid 123 and name HN) (segid " " and resid 123 and name HA) 2.869 1.029 1.029 weight 1.000 ! spec=n15n...hn-2, no=1151, id=780, vol=5.801000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 122 and name HA) 3.109 1.208 1.208 weight 1.000 ! spec=n15n...hn-2, no=1152, id=781, vol=3.581000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 120 and name HA) 2.971 1.103 1.103 weight 1.000 ! spec=n15n...hn-2, no=1153, id=782, vol=4.705000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 122 and name HB2) 2.729 0.931 0.931 weight 1.000 ! spec=n15n...hn-2, no=1154, id=783, vol=7.824000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 123 and name HB) 2.833 1.004 1.004 weight 1.000 ! spec=n15n...hn-2, no=1155, id=784, vol=6.247000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 123 and name HG12) 2.789 0.972 3.211 weight 1.000 ! spec=n15n...hn-2, no=1156, id=785, vol=6.872000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 124 and name HD11) 3.051 1.164 2.949 weight 1.000 ! spec=n15n...hn-2, no=1157, id=786, vol=4.008000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 123 and name HG21) 2.557 0.817 0.817 weight 1.000 ! spec=n15n...hn-2, no=1158, id=787, vol=1.156700e+00 assign (segid " " and resid 123 and name HN) (segid " " and resid 124 and name HG22) 2.785 0.970 3.215 weight 1.000 ! spec=n15n...hn-2, no=1159, id=788, vol=6.924000e-01 or (segid " " and resid 123 and name HN) (segid " " and resid 124 and name HG21) or (segid " " and resid 123 and name HN) (segid " " and resid 124 and name HG23) assign (segid " " and resid 123 and name HN) (segid " " and resid 123 and name HD11) 3.065 1.174 1.174 weight 1.000 ! spec=n15n...hn-2, no=1160, id=789, vol=3.899000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 147 and name HN) 2.080 0.541 0.541 weight 1.000 ! spec=n15n...hn-2, no=1161, id=790, vol=3.986900e+00 assign (segid " " and resid 147 and name HN) (segid " " and resid 148 and name HN) 2.996 1.122 3.004 weight 1.000 ! spec=n15n...hn-2, no=1162, id=791, vol=4.466000e-01 assign (segid " " and resid 145 and name HN) (segid " " and resid 147 and name HN) 2.772 0.960 0.960 weight 1.000 ! spec=n15n...hn-2, no=1163, id=792, vol=7.131000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 144 and name HN) 2.779 0.965 3.221 weight 1.000 ! spec=n15n...hn-2, no=1164, id=793, vol=7.020000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 147 and name HA2) 2.447 0.748 0.748 weight 1.000 ! spec=n15n...hn-2, no=1167, id=794, vol=1.506300e+00 assign (segid " " and resid 147 and name HN) (segid " " and resid 146 and name HA) 2.751 0.946 0.946 weight 1.000 ! spec=n15n...hn-2, no=1168, id=795, vol=7.460000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 145 and name HA) 3.136 1.229 2.864 weight 1.000 ! spec=n15n...hn-2, no=1169, id=796, vol=3.400000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 143 and name HA) 2.533 0.802 0.802 weight 1.000 ! spec=n15n...hn-2, no=1170, id=797, vol=1.222600e+00 assign (segid " " and resid 147 and name HN) (segid " " and resid 147 and name HA1) 2.274 0.646 0.646 weight 1.000 ! spec=n15n...hn-2, no=1171, id=798, vol=2.338600e+00 assign (segid " " and resid 147 and name HN) (segid " " and resid 148 and name HA) 3.171 1.257 2.829 weight 1.000 ! spec=n15n...hn-2, no=1172, id=799, vol=3.178000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 146 and name HB2) 2.735 0.935 0.935 weight 1.000 ! spec=n15n...hn-2, no=1174, id=800, vol=7.726000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 146 and name HB1) 2.669 0.890 0.890 weight 1.000 ! spec=n15n...hn-2, no=1175, id=801, vol=8.952000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 146 and name HD2) 3.163 1.250 1.250 weight 1.000 ! spec=n15n...hn-2, no=1177, id=802, vol=3.229000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 150 and name HB1) 2.817 0.992 0.992 weight 1.000 ! spec=n15n...hn-2, no=1178, id=803, vol=6.471000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 142 and name HG21) 3.024 1.143 1.143 weight 1.000 ! spec=n15n...hn-2, no=1179, id=804, vol=4.229000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 151 and name HN) 2.439 0.744 0.744 weight 1.000 ! spec=n15n...hn-2, no=1184, id=805, vol=1.536200e+00 assign (segid " " and resid 151 and name HN) (segid " " and resid 151 and name HA2) 2.262 0.639 0.639 weight 1.000 ! spec=n15n...hn-2, no=1189, id=807, vol=2.414300e+00 assign (segid " " and resid 151 and name HN) (segid " " and resid 150 and name HA) 2.784 0.969 0.969 weight 1.000 ! spec=n15n...hn-2, no=1190, id=808, vol=6.947000e-01 assign (segid " " and resid 151 and name HN) (segid " " and resid 151 and name HA1) 2.462 0.758 0.758 weight 1.000 ! spec=n15n...hn-2, no=1191, id=809, vol=1.452000e+00 assign (segid " " and resid 151 and name HN) (segid " " and resid 152 and name HB1) 3.141 1.234 2.859 weight 1.000 ! spec=n15n...hn-2, no=1192, id=810, vol=3.364000e-01 assign (segid " " and resid 151 and name HN) (segid " " and resid 150 and name HB1) 2.417 0.730 0.730 weight 1.000 ! spec=n15n...hn-2, no=1193, id=811, vol=1.621000e+00 assign (segid " " and resid 151 and name HN) (segid " " and resid 142 and name HG21) 2.584 0.835 0.835 weight 1.000 ! spec=n15n...hn-2, no=1194, id=812, vol=1.086100e+00 assign (segid " " and resid 167 and name HE1) (segid " " and resid 167 and name HD1) 2.923 1.068 1.068 weight 1.000 ! spec=n15n...hn-2, no=1200, id=813, vol=5.180000e-01 assign (segid " " and resid 167 and name HE1) (segid " " and resid 167 and name HZ2) 3.090 1.193 1.193 weight 1.000 ! spec=n15n...hn-2, no=1202, id=814, vol=3.716000e-01 assign (segid " " and resid 167 and name HE1) (segid " " and resid 100 and name HD11) 2.999 1.124 1.124 weight 1.000 ! spec=n15n...hn-2, no=1203, id=815, vol=4.443000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 116 and name HN) 2.739 0.938 0.938 weight 1.000 ! spec=n15n...hn-2, no=1225, id=816, vol=7.660000e-01 assign (segid " " and resid 117 and name HN) (segid " " and resid 116 and name HN) 2.329 0.678 0.678 weight 1.000 ! spec=n15n...hn-2, no=1226, id=817, vol=2.026600e+00 assign (segid " " and resid 116 and name HN) (segid " " and resid 113 and name HA) 3.045 1.159 1.159 weight 1.000 ! spec=n15n...hn-2, no=1229, id=818, vol=4.056000e-01 assign (segid " " and resid 116 and name HN) (segid " " and resid 115 and name HA) 3.084 1.189 1.189 weight 1.000 ! spec=n15n...hn-2, no=1232, id=820, vol=3.756000e-01 assign (segid " " and resid 116 and name HN) (segid " " and resid 115 and name HB2) 3.050 1.163 1.163 weight 1.000 ! spec=n15n...hn-2, no=1233, id=821, vol=4.017000e-01 assign (segid " " and resid 116 and name HN) (segid " " and resid 115 and name HB1) 2.977 1.108 1.108 weight 1.000 ! spec=n15n...hn-2, no=1234, id=822, vol=4.648000e-01 assign (segid " " and resid 116 and name HN) (segid " " and resid 115 and name HD2) 2.874 1.033 1.033 weight 1.000 ! spec=n15n...hn-2, no=1235, id=823, vol=5.735000e-01 assign (segid " " and resid 116 and name HN) (segid " " and resid 116 and name HG21) 2.593 0.840 0.840 weight 1.000 ! spec=n15n...hn-2, no=1236, id=824, vol=1.064100e+00 assign (segid " " and resid 189 and name HN) (segid " " and resid 103 and name HE1) 3.204 1.284 1.284 weight 1.000 ! spec=n15n...hn-2, no=1263, id=825, vol=2.986000e-01 assign (segid " " and resid 165 and name HN) (segid " " and resid 164 and name HG1) 3.218 1.294 1.294 weight 1.000 ! spec=n15n...hn-2, no=1266, id=827, vol=2.912000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 113 and name HB1) 3.252 1.322 1.322 weight 1.000 ! spec=n15n...hn-2, no=1267, id=828, vol=2.735000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 113 and name HA) 3.279 1.344 1.344 weight 1.000 ! spec=n15n...hn-2, no=1268, id=829, vol=2.602000e-01 assign (segid " " and resid 186 and name HN) (segid " " and resid 185 and name HD21) 3.201 1.281 1.281 weight 1.000 ! spec=n15n...hn-2, no=1269, id=830, vol=3.007000e-01 assign (segid " " and resid 182 and name HN) (segid " " and resid 182 and name HD1) 3.323 1.380 1.380 weight 1.000 ! spec=n15n...hn-2, no=1271, id=831, vol=2.403000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 170 and name HB) 3.270 1.337 1.337 weight 1.000 ! spec=n15n...hn-2, no=1272, id=832, vol=2.642000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 171 and name HD21) 3.239 1.311 1.311 weight 1.000 ! spec=n15n...hn-2, no=1273, id=833, vol=2.801000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 103 and name HB1) 3.167 1.254 1.254 weight 1.000 ! spec=n15n...hn-2, no=1274, id=834, vol=3.205000e-01 assign (segid " " and resid 99 and name HN) (segid " " and resid 99 and name HA) 2.756 0.949 0.949 weight 1.000 ! spec=n15n...hn-2, no=1277, id=837, vol=7.382000e-01 assign (segid " " and resid 164 and name HN) (segid " " and resid 162 and name HA) 2.779 0.965 0.965 weight 1.000 ! spec=n15n...hn-2, no=1278, id=838, vol=7.022000e-01 assign (segid " " and resid 99 and name HN) (segid " " and resid 99 and name HD2) 2.866 1.027 1.027 weight 1.000 ! spec=n15n...hn-2, no=1280, id=839, vol=5.834000e-01 assign (segid " " and resid 155 and name HN) (segid " " and resid 156 and name HG21) 3.208 1.287 1.287 weight 1.000 ! spec=n15n...hn-2, no=1281, id=840, vol=2.964000e-01 assign (segid " " and resid 141 and name HN) (segid " " and resid 139 and name HN) 2.885 1.040 1.040 weight 1.000 ! spec=n15n...hn-2, no=1282, id=841, vol=5.610000e-01 assign (segid " " and resid 141 and name HN) (segid " " and resid 139 and name HA) 3.329 1.385 1.385 weight 1.000 ! spec=n15n...hn-2, no=1283, id=842, vol=2.375000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 151 and name HA2) 3.192 1.274 1.274 weight 1.000 ! spec=n15n...hn-2, no=1285, id=843, vol=3.056000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 154 and name HG2) 2.989 1.116 3.011 weight 1.000 ! spec=n15n...hn-2, no=1286, id=844, vol=4.537000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 116 and name HN) 3.197 1.278 1.278 weight 1.000 ! spec=n15n...hn-2, no=1288, id=846, vol=3.025000e-01 assign (segid " " and resid 122 and name HN) (segid " " and resid 121 and name HG21) 3.193 1.274 1.274 weight 1.000 ! spec=n15n...hn-2, no=1291, id=849, vol=3.052000e-01 assign (segid " " and resid 109 and name HN) (segid " " and resid 108 and name HD2) 3.207 1.285 2.793 weight 1.000 ! spec=n15n...hn-2, no=1292, id=850, vol=2.973000e-01 assign (segid " " and resid 126 and name HN) (segid " " and resid 173 and name HD11) 3.293 1.356 1.356 weight 1.000 ! spec=n15n...hn-2, no=1294, id=852, vol=2.534000e-01 assign (segid " " and resid 149 and name HN) (segid " " and resid 149 and name HG1) 3.088 1.192 1.192 weight 1.000 ! spec=n15n...hn-2, no=1295, id=853, vol=3.728000e-01 assign (segid " " and resid 156 and name HN) (segid " " and resid 155 and name HA) 2.922 1.067 1.067 weight 1.000 ! spec=n15n...hn-2, no=1296, id=854, vol=5.195000e-01 assign (segid " " and resid 135 and name HN) (segid " " and resid 135 and name HG2) 2.629 0.864 0.864 weight 1.000 ! spec=n15n...hn-2, no=1297, id=855, vol=9.799000e-01 assign (segid " " and resid 135 and name HN) (segid " " and resid 132 and name HG21) 3.205 1.284 2.795 weight 1.000 ! spec=n15n...hn-2, no=1298, id=856, vol=2.982000e-01 assign (segid " " and resid 134 and name HN) (segid " " and resid 132 and name HD11) 3.326 1.383 1.383 weight 1.000 ! spec=n15n...hn-2, no=1301, id=857, vol=2.389000e-01 assign (segid " " and resid 176 and name HN) (segid " " and resid 174 and name HN) 3.246 1.317 1.317 weight 1.000 ! spec=n15n...hn-2, no=1302, id=858, vol=2.764000e-01 assign (segid " " and resid 100 and name HN) (segid " " and resid 98 and name HA) 2.919 1.065 1.065 weight 1.000 ! spec=n15n...hn-2, no=1306, id=860, vol=5.221000e-01 assign (segid " " and resid 105 and name HN) (segid " " and resid 101 and name HA) 3.228 1.303 1.303 weight 1.000 ! spec=n15n...hn-2, no=1307, id=861, vol=2.855000e-01 assign (segid " " and resid 102 and name HN) (segid " " and resid 100 and name HA) 3.186 1.269 1.269 weight 1.000 ! spec=n15n...hn-2, no=1308, id=862, vol=3.089000e-01 assign (segid " " and resid 127 and name HN) (segid " " and resid 127 and name HG) 2.594 0.841 3.406 weight 1.000 ! spec=n15n...hn-2, no=1309, id=863, vol=1.061800e+00 assign (segid " " and resid 117 and name HN) (segid " " and resid 115 and name HA) 3.287 1.351 2.713 weight 1.000 ! spec=n15n...hn-2, no=1310, id=864, vol=2.561000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 155 and name HA) 3.222 1.298 2.778 weight 1.000 ! spec=n15n...hn-2, no=1312, id=866, vol=2.887000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 159 and name HA) 3.237 1.309 1.309 weight 1.000 ! spec=n15n...hn-2, no=1313, id=867, vol=2.812000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 156 and name HA) 3.300 1.361 1.361 weight 1.000 ! spec=n15n...hn-2, no=1314, id=868, vol=2.504000e-01 assign (segid " " and resid 110 and name HN) (segid " " and resid 109 and name HG2) 3.194 1.275 1.275 weight 1.000 ! spec=n15n...hn-2, no=1315, id=869, vol=3.045000e-01 assign (segid " " and resid 113 and name HN) (segid " " and resid 115 and name HN) 3.209 1.288 2.791 weight 1.000 ! spec=n15n...hn-2, no=1316, id=870, vol=2.958000e-01 assign (segid " " and resid 136 and name HN) (segid " " and resid 135 and name HG2) 2.941 1.081 3.059 weight 1.000 ! spec=n15n...hn-2, no=1317, id=871, vol=4.999000e-01 assign (segid " " and resid 128 and name HN) (segid " " and resid 127 and name HD11) 3.205 1.284 2.795 weight 1.000 ! spec=n15n...hn-2, no=1319, id=873, vol=2.983000e-01 assign (segid " " and resid 132 and name HN) (segid " " and resid 131 and name HB2) 2.552 0.814 3.448 weight 1.000 ! spec=n15n...hn-2, no=1322, id=876, vol=1.169700e+00 assign (segid " " and resid 108 and name HN) (segid " " and resid 107 and name HG) 3.265 1.332 1.332 weight 1.000 ! spec=n15n...hn-2, no=1323, id=877, vol=2.671000e-01 assign (segid " " and resid 178 and name HN) (segid " " and resid 178 and name HB2) 2.796 0.977 0.977 weight 1.000 ! spec=n15n...hn-2, no=1325, id=879, vol=6.764000e-01 assign (segid " " and resid 161 and name HN) (segid " " and resid 160 and name HD21) 3.180 1.264 2.820 weight 1.000 ! spec=n15n...hn-2, no=1326, id=880, vol=3.126000e-01 assign (segid " " and resid 180 and name HD22) (segid " " and resid 175 and name HD21) 3.273 1.339 1.339 weight 1.000 ! spec=n15n...hn-2, no=1327, id=881, vol=2.632000e-01 assign (segid " " and resid 166 and name HN) (segid " " and resid 129 and name HG2) 3.186 1.269 2.814 weight 1.000 ! spec=n15n...hn-2, no=1328, id=882, vol=3.092000e-01 assign (segid " " and resid 144 and name HN) (segid " " and resid 142 and name HA) 3.317 1.376 1.376 weight 1.000 ! spec=n15n...hn-2, no=1330, id=883, vol=2.426000e-01 assign (segid " " and resid 183 and name HN) (segid " " and resid 175 and name HD21) 3.170 1.256 1.256 weight 1.000 ! spec=n15n...hn-2, no=1331, id=884, vol=3.188000e-01 assign (segid " " and resid 183 and name HN) (segid " " and resid 182 and name HB1) 3.207 1.286 1.286 weight 1.000 ! spec=n15n...hn-2, no=1333, id=885, vol=2.969000e-01 assign (segid " " and resid 183 and name HN) (segid " " and resid 182 and name HB2) 3.225 1.300 1.300 weight 1.000 ! spec=n15n...hn-2, no=1335, id=886, vol=2.876000e-01 assign (segid " " and resid 183 and name HN) (segid " " and resid 175 and name HB1) 3.386 1.433 1.433 weight 1.000 ! spec=n15n...hn-2, no=1336, id=887, vol=2.146000e-01 assign (segid " " and resid 145 and name HN) (segid " " and resid 142 and name HD11) 3.286 1.350 1.350 weight 1.000 ! spec=n15n...hn-2, no=1337, id=888, vol=2.567000e-01 assign (segid " " and resid 145 and name HN) (segid " " and resid 146 and name HB1) 3.233 1.307 2.767 weight 1.000 ! spec=n15n...hn-2, no=1338, id=889, vol=2.831000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 151 and name HN) 3.182 1.266 1.266 weight 1.000 ! spec=n15n...hn-2, no=1340, id=890, vol=3.115000e-01 assign (segid " " and resid 151 and name HN) (segid " " and resid 154 and name HN) 3.312 1.371 1.371 weight 1.000 ! spec=n15n...hn-2, no=1341, id=891, vol=2.449000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 171 and name HG) 3.426 1.467 1.467 weight 1.000 ! spec=n15n...hn-2, no=1343, id=893, vol=2.000000e-01 assign (segid " " and resid 109 and name HN) (segid " " and resid 109 and name HD2) 3.276 1.342 1.342 weight 1.000 ! spec=n15n...hn-2, no=1344, id=894, vol=2.615000e-01 assign (segid " " and resid 119 and name HN) (segid " " and resid 118 and name HD11) 3.221 1.297 1.297 weight 1.000 ! spec=n15n...hn-2, no=1345, id=895, vol=2.897000e-01 assign (segid " " and resid 119 and name HN) (segid " " and resid 119 and name HD11) 3.316 1.374 1.374 weight 1.000 ! spec=n15n...hn-2, no=1346, id=896, vol=2.432000e-01 assign (segid " " and resid 119 and name HN) (segid " " and resid 119 and name HG21) 3.348 1.401 1.401 weight 1.000 ! spec=n15n...hn-2, no=1347, id=897, vol=2.297000e-01 assign (segid " " and resid 121 and name HN) (segid " " and resid 122 and name HB2) 3.411 1.454 1.454 weight 1.000 ! spec=n15n...hn-2, no=1348, id=898, vol=2.053000e-01 assign (segid " " and resid 121 and name HN) (segid " " and resid 119 and name HB) 3.286 1.350 1.350 weight 1.000 ! spec=n15n...hn-2, no=1351, id=901, vol=2.569000e-01 assign (segid " " and resid 186 and name HE1) (segid " " and resid 171 and name HD21) 3.197 1.278 2.803 weight 1.000 ! spec=n15n...hn-2, no=1354, id=903, vol=3.028000e-01 assign (segid " " and resid 186 and name HE1) (segid " " and resid 171 and name HB1) 3.279 1.344 1.344 weight 1.000 ! spec=n15n...hn-2, no=1355, id=904, vol=2.603000e-01 assign (segid " " and resid 186 and name HE1) (segid " " and resid 172 and name HB1) 3.242 1.314 1.314 weight 1.000 ! spec=n15n...hn-2, no=1356, id=905, vol=2.783000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 115 and name HB1) 3.265 1.333 1.333 weight 1.000 ! spec=n15n...hn-2, no=1357, id=906, vol=2.668000e-01 assign (segid " " and resid 187 and name HN) (segid " " and resid 188 and name HG11) 3.297 1.358 1.358 weight 1.000 ! spec=n15n...hn-2, no=1358, id=907, vol=2.519000e-01 assign (segid " " and resid 133 and name HN) (segid " " and resid 132 and name HG21) 3.374 1.423 1.423 weight 1.000 ! spec=n15n...hn-2, no=1359, id=908, vol=2.191000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 139 and name HB) 2.423 0.734 3.577 weight 1.000 ! spec=n15n...hn-2, no=1362, id=910, vol=1.599100e+00 assign (segid " " and resid 125 and name HN) (segid " " and resid 124 and name HG11) 3.298 1.360 2.702 weight 1.000 ! spec=n15n...hn-2, no=1363, id=911, vol=2.512000e-01 assign (segid " " and resid 170 and name HN) (segid " " and resid 171 and name HA) 3.262 1.330 2.738 weight 1.000 ! spec=n15n...hn-2, no=1366, id=912, vol=2.681000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 125 and name HN) 3.595 1.615 1.615 weight 1.000 ! spec=n15n...hn-2, no=1367, id=913, vol=1.498000e-01 assign (segid " " and resid 161 and name HE) (segid " " and resid 161 and name HG1) 3.270 1.336 1.336 weight 1.000 ! spec=n15n...hn-2, no=1368, id=914, vol=2.645000e-01 assign (segid " " and resid 183 and name HN) (segid " " and resid 182 and name HD1) 3.306 1.367 2.694 weight 1.000 ! spec=n15n...hn-2, no=1370, id=915, vol=2.474000e-01 assign (segid " " and resid 166 and name HD22) (segid " " and resid 166 and name HB1) 3.253 1.323 1.323 weight 1.000 ! spec=n15n...hn-2, no=1372, id=917, vol=2.728000e-01 assign (segid " " and resid 180 and name HD21) (segid " " and resid 180 and name HB1) 3.432 1.473 1.473 weight 1.000 ! spec=n15n...hn-2, no=1380, id=918, vol=1.977000e-01 assign (segid " " and resid 130 and name HN) (segid " " and resid 131 and name HB2) 3.231 1.305 1.305 weight 1.000 ! spec=n15n...hn-2, no=1383, id=921, vol=2.844000e-01 assign (segid " " and resid 130 and name HN) (segid " " and resid 129 and name HB2) 3.341 1.395 1.395 weight 1.000 ! spec=n15n...hn-2, no=1384, id=922, vol=2.325000e-01 assign (segid " " and resid 153 and name HN) (segid " " and resid 152 and name HA) 3.255 1.325 1.325 weight 1.000 ! spec=n15n...hn-2, no=1387, id=924, vol=2.716000e-01 assign (segid " " and resid 134 and name HN) (segid " " and resid 133 and name HA) 3.157 1.246 1.246 weight 1.000 ! spec=n15n...hn-2, no=1388, id=925, vol=3.267000e-01 assign (segid " " and resid 101 and name HN) (segid " " and resid 100 and name HD21) 3.254 1.323 1.323 weight 1.000 ! spec=n15n...hn-2, no=1389, id=926, vol=2.724000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 150 and name HN) 3.533 1.560 1.560 weight 1.000 ! spec=n15n...hn-2, no=1390, id=927, vol=1.663000e-01 assign (segid " " and resid 163 and name HN) (segid " " and resid 164 and name HG2) 3.561 1.585 2.439 weight 1.000 ! spec=n15n...hn-2, no=1391, id=928, vol=1.585000e-01 assign (segid " " and resid 168 and name HA) (segid " " and resid 188 and name HG12) 2.958 1.094 1.094 weight 1.000 ! spec=c13n...li-4, no=28, id=948, vol=4.303950e+01 or (segid " " and resid 168 and name HA) (segid " " and resid 188 and name HG11) or (segid " " and resid 168 and name HA) (segid " " and resid 188 and name HG13) or (segid " " and resid 168 and name HA) (segid " " and resid 159 and name HD22) or (segid " " and resid 168 and name HA) (segid " " and resid 159 and name HD21) or (segid " " and resid 168 and name HA) (segid " " and resid 159 and name HD23) or (segid " " and resid 168 and name HA) (segid " " and resid 159 and name HD12) or (segid " " and resid 168 and name HA) (segid " " and resid 159 and name HD11) or (segid " " and resid 168 and name HA) (segid " " and resid 159 and name HD13) assign (segid " " and resid 156 and name HA) (segid " " and resid 155 and name HD12) 2.997 1.123 1.123 weight 1.000 ! spec=c13n...li-4, no=40, id=957, vol=3.976400e+01 or (segid " " and resid 156 and name HA) (segid " " and resid 155 and name HD11) or (segid " " and resid 156 and name HA) (segid " " and resid 155 and name HD13) or (segid " " and resid 156 and name HA) (segid " " and resid 160 and name HD22) or (segid " " and resid 156 and name HA) (segid " " and resid 160 and name HD21) or (segid " " and resid 156 and name HA) (segid " " and resid 160 and name HD23) assign (segid " " and resid 112 and name HA) (segid " " and resid 110 and name HB2) 2.798 0.979 3.202 weight 1.000 ! spec=c13n...li-4, no=46, id=963, vol=6.003750e+01 or (segid " " and resid 112 and name HA) (segid " " and resid 113 and name HG1) assign (segid " " and resid 112 and name HA) (segid " " and resid 115 and name HB2) 2.342 0.686 3.658 weight 1.000 ! spec=c13n...li-4, no=48, id=965, vol=1.746729e+02 or (segid " " and resid 112 and name HA) (segid " " and resid 112 and name HG2) assign (segid " " and resid 139 and name HA) (segid " " and resid 139 and name HB) 2.240 0.627 0.627 weight 1.000 ! spec=c13n...li-4, no=70, id=985, vol=2.280149e+02 or (segid " " and resid 139 and name HA) (segid " " and resid 154 and name HB1) assign (segid " " and resid 143 and name HA) (segid " " and resid 148 and name HA) 2.518 0.792 0.792 weight 1.000 ! spec=c13n...li-4, no=87, id=997, vol=1.131887e+02 or (segid " " and resid 143 and name HA) (segid " " and resid 151 and name HA2) assign (segid " " and resid 144 and name HB2) (segid " " and resid 144 and name HA) 2.947 1.474 1.474 weight 1.000 ! spec=c13n...li-4, no=92, id=1002, vol=5.300327e+02 or (segid " " and resid 183 and name HB2) (segid " " and resid 172 and name HA) assign (segid " " and resid 183 and name HB2) (segid " " and resid 175 and name HG) 3.032 1.149 1.149 weight 1.000 ! spec=c13n...li-4, no=97, id=1005, vol=3.712640e+01 or (segid " " and resid 183 and name HB2) (segid " " and resid 176 and name HB2) assign (segid " " and resid 162 and name HB2) (segid " " and resid 161 and name HA) 2.395 0.717 3.605 weight 1.000 ! spec=c13n...li-4, no=107, id=1014, vol=1.528590e+02 or (segid " " and resid 162 and name HB2) (segid " " and resid 164 and name HA) or (segid " " and resid 136 and name HA) (segid " " and resid 127 and name HA) assign (segid " " and resid 124 and name HA) (segid " " and resid 124 and name HD12) 1.967 0.484 0.484 weight 1.000 ! spec=c13n...li-4, no=123, id=1028, vol=4.981180e+02 or (segid " " and resid 124 and name HA) (segid " " and resid 124 and name HD11) or (segid " " and resid 124 and name HA) (segid " " and resid 124 and name HD13) or (segid " " and resid 124 and name HA) (segid " " and resid 127 and name HD22) or (segid " " and resid 124 and name HA) (segid " " and resid 127 and name HD21) or (segid " " and resid 124 and name HA) (segid " " and resid 127 and name HD23) or (segid " " and resid 136 and name HA) (segid " " and resid 127 and name HD22) or (segid " " and resid 136 and name HA) (segid " " and resid 127 and name HD21) or (segid " " and resid 136 and name HA) (segid " " and resid 127 and name HD23) assign (segid " " and resid 158 and name HA) (segid " " and resid 131 and name HD21) 2.753 0.947 0.947 weight 1.000 ! spec=c13n...li-4, no=128, id=1033, vol=6.629410e+01 or (segid " " and resid 162 and name HB2) (segid " " and resid 131 and name HD11) assign (segid " " and resid 124 and name HA) (segid " " and resid 128 and name HB2) 2.336 0.682 3.664 weight 1.000 ! spec=c13n...li-4, no=135, id=1039, vol=1.772605e+02 or (segid " " and resid 136 and name HA) (segid " " and resid 135 and name HA) assign (segid " " and resid 162 and name HB1) (segid " " and resid 159 and name HG) 2.438 0.743 0.743 weight 1.000 ! spec=c13n...li-4, no=142, id=1044, vol=1.374597e+02 or (segid " " and resid 124 and name HA) (segid " " and resid 123 and name HG12) or (segid " " and resid 124 and name HA) (segid " " and resid 124 and name HG11) assign (segid " " and resid 167 and name HA) (segid " " and resid 162 and name HB2) 3.006 1.129 2.994 weight 1.000 ! spec=c13n...li-4, no=168, id=1062, vol=3.910270e+01 or (segid " " and resid 167 and name HA) (segid " " and resid 170 and name HA) assign (segid " " and resid 103 and name HA) (segid " " and resid 186 and name HZ2) 2.868 1.028 1.028 weight 1.000 ! spec=c13n...li-4, no=184, id=1077, vol=5.184280e+01 or (segid " " and resid 103 and name HA) (segid " " and resid 167 and name HH2) assign (segid " " and resid 104 and name HA) (segid " " and resid 104 and name HB2) 2.407 0.724 0.724 weight 1.000 ! spec=c13n...li-4, no=203, id=1093, vol=1.482109e+02 or (segid " " and resid 104 and name HA) (segid " " and resid 107 and name HB2) assign (segid " " and resid 104 and name HA) (segid " " and resid 105 and name HB2) 2.508 0.786 3.492 weight 1.000 ! spec=c13n...li-4, no=205, id=1095, vol=1.158970e+02 or (segid " " and resid 188 and name HA) (segid " " and resid 189 and name HB1) assign (segid " " and resid 188 and name HA) (segid " " and resid 187 and name HG22) 3.022 1.142 1.142 weight 1.000 ! spec=c13n...li-4, no=208, id=1098, vol=3.784760e+01 or (segid " " and resid 188 and name HA) (segid " " and resid 187 and name HG21) or (segid " " and resid 188 and name HA) (segid " " and resid 187 and name HG23) or (segid " " and resid 104 and name HA) (segid " " and resid 160 and name HD22) or (segid " " and resid 104 and name HA) (segid " " and resid 160 and name HD21) or (segid " " and resid 104 and name HA) (segid " " and resid 160 and name HD23) assign (segid " " and resid 97 and name HA) (segid " " and resid 98 and name HB2) 3.041 1.156 1.156 weight 1.000 ! spec=c13n...li-4, no=218, id=1106, vol=3.645050e+01 or (segid " " and resid 182 and name HA) (segid " " and resid 113 and name HB1) or (segid " " and resid 182 and name HA) (segid " " and resid 184 and name HB2) assign (segid " " and resid 97 and name HA) (segid " " and resid 97 and name HG11) 2.491 0.776 0.776 weight 1.000 ! spec=c13n...li-4, no=219, id=1107, vol=1.205453e+02 or (segid " " and resid 182 and name HA) (segid " " and resid 185 and name HG) assign (segid " " and resid 183 and name HA) (segid " " and resid 172 and name HG2) 2.835 1.004 1.004 weight 1.000 ! spec=c13n...li-4, no=230, id=1113, vol=5.558010e+01 or (segid " " and resid 183 and name HA) (segid " " and resid 172 and name HG1) or (segid " " and resid 183 and name HA) (segid " " and resid 172 and name HD2) assign (segid " " and resid 130 and name HA) (segid " " and resid 129 and name HA) 2.742 0.940 3.258 weight 1.000 ! spec=c13n...li-4, no=252, id=1125, vol=6.779750e+01 or (segid " " and resid 130 and name HA) (segid " " and resid 164 and name HA) assign (segid " " and resid 183 and name HB2) (segid " " and resid 172 and name HA) 2.663 0.886 0.886 weight 1.000 ! spec=c13n...li-4, no=281, id=1150, vol=8.089270e+01 or (segid " " and resid 172 and name HA) (segid " " and resid 183 and name HA) assign (segid " " and resid 109 and name HA) (segid " " and resid 109 and name HD2) 2.611 0.852 0.852 weight 1.000 ! spec=c13n...li-4, no=285, id=1153, vol=9.090850e+01 or (segid " " and resid 172 and name HA) (segid " " and resid 186 and name HB2) assign (segid " " and resid 113 and name HA) (segid " " and resid 113 and name HB2) 2.202 0.606 0.606 weight 1.000 ! spec=c13n...li-4, no=289, id=1157, vol=2.529858e+02 or (segid " " and resid 134 and name HA) (segid " " and resid 134 and name HG2) assign (segid " " and resid 109 and name HA) (segid " " and resid 109 and name HB1) 2.310 0.667 0.667 weight 1.000 ! spec=c13n...li-4, no=290, id=1158, vol=1.897155e+02 or (segid " " and resid 172 and name HA) (segid " " and resid 175 and name HB2) or (segid " " and resid 181 and name HA) (segid " " and resid 184 and name HG2) assign (segid " " and resid 101 and name HA) (segid " " and resid 101 and name HG2) 2.283 0.652 0.652 weight 1.000 ! spec=c13n...li-4, no=303, id=1170, vol=2.034067e+02 or (segid " " and resid 141 and name HA) (segid " " and resid 141 and name HG2) or (segid " " and resid 172 and name HA) (segid " " and resid 175 and name HB2) assign (segid " " and resid 141 and name HA) (segid " " and resid 141 and name HB2) 2.176 0.592 0.592 weight 1.000 ! spec=c13n...li-4, no=304, id=1171, vol=2.713127e+02 or (segid " " and resid 101 and name HA) (segid " " and resid 101 and name HB2) or (segid " " and resid 101 and name HA) (segid " " and resid 104 and name HB2) assign (segid " " and resid 176 and name HA) (segid " " and resid 176 and name HB1) 2.180 0.594 0.594 weight 1.000 ! spec=c13n...li-4, no=305, id=1172, vol=2.688158e+02 or (segid " " and resid 135 and name HA) (segid " " and resid 135 and name HG1) assign (segid " " and resid 173 and name HA) (segid " " and resid 176 and name HG1) 2.117 0.560 0.560 weight 1.000 ! spec=c13n...li-4, no=306, id=1173, vol=3.199366e+02 or (segid " " and resid 135 and name HA) (segid " " and resid 138 and name HB2) or (segid " " and resid 135 and name HA) (segid " " and resid 135 and name HB1) assign (segid " " and resid 172 and name HA) (segid " " and resid 175 and name HB2) 2.280 0.650 0.650 weight 1.000 ! spec=c13n...li-4, no=307, id=1174, vol=2.050535e+02 or (segid " " and resid 176 and name HA) (segid " " and resid 176 and name HB1) or (segid " " and resid 181 and name HA) (segid " " and resid 184 and name HG2) assign (segid " " and resid 172 and name HA) (segid " " and resid 175 and name HB2) 2.140 0.572 0.572 weight 1.000 ! spec=c13n...li-4, no=308, id=1175, vol=3.005382e+02 or (segid " " and resid 176 and name HA) (segid " " and resid 176 and name HB1) assign (segid " " and resid 172 and name HA) (segid " " and resid 172 and name HB1) 1.856 0.431 0.431 weight 1.000 ! spec=c13n...li-4, no=310, id=1177, vol=7.057713e+02 or (segid " " and resid 113 and name HA) (segid " " and resid 113 and name HB1) assign (segid " " and resid 113 and name HA) (segid " " and resid 117 and name HG1) 2.239 0.627 0.627 weight 1.000 ! spec=c13n...li-4, no=311, id=1178, vol=2.288838e+02 or (segid " " and resid 181 and name HA) (segid " " and resid 181 and name HG2) assign (segid " " and resid 138 and name HA) (segid " " and resid 138 and name HG2) 2.239 0.626 0.626 weight 1.000 ! spec=c13n...li-4, no=318, id=1183, vol=2.291303e+02 or (segid " " and resid 165 and name HA) (segid " " and resid 165 and name HG2) assign (segid " " and resid 138 and name HA) (segid " " and resid 138 and name HB2) 2.006 0.503 0.503 weight 1.000 ! spec=c13n...li-4, no=319, id=1184, vol=4.420384e+02 or (segid " " and resid 138 and name HA) (segid " " and resid 138 and name HG1) assign (segid " " and resid 135 and name HA) (segid " " and resid 135 and name HB2) 2.032 0.516 0.516 weight 1.000 ! spec=c13n...li-4, no=320, id=1185, vol=4.093732e+02 or (segid " " and resid 135 and name HA) (segid " " and resid 135 and name HG2) or (segid " " and resid 138 and name HA) (segid " " and resid 138 and name HG2) or (segid " " and resid 141 and name HA) (segid " " and resid 141 and name HG1) assign (segid " " and resid 135 and name HA) (segid " " and resid 138 and name HB2) 1.898 0.450 0.450 weight 1.000 ! spec=c13n...li-4, no=321, id=1186, vol=6.163740e+02 or (segid " " and resid 138 and name HA) (segid " " and resid 138 and name HG1) or (segid " " and resid 138 and name HA) (segid " " and resid 141 and name HB2) or (segid " " and resid 141 and name HA) (segid " " and resid 141 and name HB2) assign (segid " " and resid 138 and name HA) (segid " " and resid 138 and name HB1) 1.857 0.431 0.431 weight 1.000 ! spec=c13n...li-4, no=323, id=1188, vol=7.040778e+02 or (segid " " and resid 177 and name HA) (segid " " and resid 177 and name HB2) assign (segid " " and resid 165 and name HA) (segid " " and resid 100 and name HG) 2.043 0.522 0.522 weight 1.000 ! spec=c13n...li-4, no=324, id=1189, vol=3.964109e+02 or (segid " " and resid 169 and name HA) (segid " " and resid 169 and name HB2) assign (segid " " and resid 105 and name HA) (segid " " and resid 108 and name HB2) 2.146 0.576 0.576 weight 1.000 ! spec=c13n...li-4, no=325, id=1190, vol=2.954092e+02 or (segid " " and resid 173 and name HA) (segid " " and resid 173 and name HB2) assign (segid " " and resid 177 and name HA) (segid " " and resid 177 and name HD2) 2.305 0.664 0.664 weight 1.000 ! spec=c13n...li-4, no=328, id=1193, vol=1.921786e+02 or (segid " " and resid 169 and name HA) (segid " " and resid 172 and name HG2) assign (segid " " and resid 171 and name HA) (segid " " and resid 171 and name HB1) 2.136 0.571 0.571 weight 1.000 ! spec=c13n...li-4, no=332, id=1197, vol=3.032660e+02 or (segid " " and resid 105 and name HA) (segid " " and resid 105 and name HB1) assign (segid " " and resid 171 and name HA) (segid " " and resid 123 and name HG12) 3.031 1.148 1.148 weight 1.000 ! spec=c13n...li-4, no=334, id=1199, vol=3.718400e+01 or (segid " " and resid 171 and name HA) (segid " " and resid 170 and name HG21) or (segid " " and resid 171 and name HA) (segid " " and resid 170 and name HG22) or (segid " " and resid 171 and name HA) (segid " " and resid 170 and name HG23) assign (segid " " and resid 102 and name HA) (segid " " and resid 102 and name HG2) 1.933 0.467 0.467 weight 1.000 ! spec=c13n...li-4, no=349, id=1210, vol=5.535128e+02 or (segid " " and resid 115 and name HA) (segid " " and resid 115 and name HB2) assign (segid " " and resid 102 and name HA) (segid " " and resid 102 and name HB2) 1.892 0.447 0.447 weight 1.000 ! spec=c13n...li-4, no=350, id=1211, vol=6.291135e+02 or (segid " " and resid 102 and name HA) (segid " " and resid 105 and name HB2) assign (segid " " and resid 115 and name HA) (segid " " and resid 115 and name HB1) 2.245 0.630 0.630 weight 1.000 ! spec=c13n...li-4, no=352, id=1213, vol=2.254605e+02 or (segid " " and resid 155 and name HA) (segid " " and resid 155 and name HB1) assign (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HG22) 1.924 0.463 0.463 weight 1.000 ! spec=c13n...li-4, no=360, id=1221, vol=5.682333e+02 or (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HG21) or (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HG23) or (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HD12) or (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HD11) or (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HD13) assign (segid " " and resid 140 and name HA) (segid " " and resid 143 and name HB1) 2.601 0.845 0.845 weight 1.000 ! spec=c13n...li-4, no=370, id=1227, vol=9.321380e+01 or (segid " " and resid 155 and name HA) (segid " " and resid 158 and name HB2) assign (segid " " and resid 155 and name HA) (segid " " and resid 155 and name HB1) 2.237 0.625 0.625 weight 1.000 ! spec=c13n...li-4, no=374, id=1231, vol=2.302025e+02 or (segid " " and resid 140 and name HA) (segid " " and resid 120 and name HB2) or (segid " " and resid 140 and name HA) (segid " " and resid 140 and name HB2) assign (segid " " and resid 140 and name HA) (segid " " and resid 120 and name HB2) 2.422 0.733 0.733 weight 1.000 ! spec=c13n...li-4, no=375, id=1232, vol=1.429476e+02 or (segid " " and resid 140 and name HA) (segid " " and resid 140 and name HG) or (segid " " and resid 155 and name HA) (segid " " and resid 155 and name HB1) assign (segid " " and resid 140 and name HA) (segid " " and resid 140 and name HB1) 2.179 0.594 0.594 weight 1.000 ! spec=c13n...li-4, no=376, id=1233, vol=2.691378e+02 or (segid " " and resid 155 and name HA) (segid " " and resid 155 and name HG) assign (segid " " and resid 118 and name HA) (segid " " and resid 175 and name HD21) 2.846 1.012 1.012 weight 1.000 ! spec=c13n...li-4, no=379, id=1236, vol=5.429780e+01 or (segid " " and resid 118 and name HA) (segid " " and resid 123 and name HG21) assign (segid " " and resid 122 and name HA) (segid " " and resid 125 and name HA) 3.014 1.136 1.136 weight 1.000 ! spec=c13n...li-4, no=402, id=1256, vol=3.845610e+01 or (segid " " and resid 126 and name HA) (segid " " and resid 125 and name HA) assign (segid " " and resid 122 and name HA) (segid " " and resid 122 and name HB2) 2.125 0.565 0.565 weight 1.000 ! spec=c13n...li-4, no=406, id=1259, vol=3.128341e+02 or (segid " " and resid 126 and name HA) (segid " " and resid 126 and name HB2) assign (segid " " and resid 146 and name HA) (segid " " and resid 146 and name HG1) 2.456 0.754 0.754 weight 1.000 ! spec=c13n...li-4, no=420, id=1271, vol=1.314455e+02 or (segid " " and resid 146 and name HA) (segid " " and resid 150 and name HB2) or (segid " " and resid 146 and name HA) (segid " " and resid 150 and name HB1) or (segid " " and resid 146 and name HA) (segid " " and resid 150 and name HB3) assign (segid " " and resid 117 and name HA) (segid " " and resid 117 and name HD2) 2.465 0.760 0.760 weight 1.000 ! spec=c13n...li-4, no=425, id=1276, vol=1.284934e+02 or (segid " " and resid 117 and name HA) (segid " " and resid 117 and name HD1) assign (segid " " and resid 133 and name HA) (segid " " and resid 133 and name HB1) 2.058 0.529 3.942 weight 1.000 ! spec=c13n...li-4, no=442, id=1292, vol=3.796650e+02 or (segid " " and resid 133 and name HA) (segid " " and resid 136 and name HB1) assign (segid " " and resid 133 and name HA) (segid " " and resid 137 and name HG2) 2.411 0.726 0.726 weight 1.000 ! spec=c13n...li-4, no=445, id=1295, vol=1.469594e+02 or (segid " " and resid 148 and name HA) (segid " " and resid 148 and name HB2) assign (segid " " and resid 148 and name HA) (segid " " and resid 148 and name HB1) 2.231 0.622 0.622 weight 1.000 ! spec=c13n...li-4, no=448, id=1298, vol=2.335208e+02 or (segid " " and resid 148 and name HA) (segid " " and resid 120 and name HG2) assign (segid " " and resid 100 and name HA) (segid " " and resid 100 and name HB1) 2.127 0.566 0.566 weight 1.000 ! spec=c13n...li-4, no=451, id=1301, vol=3.109626e+02 or (segid " " and resid 100 and name HA) (segid " " and resid 100 and name HG) assign (segid " " and resid 189 and name HA) (segid " " and resid 189 and name HB2) 2.619 0.858 0.858 weight 1.000 ! spec=c13n...li-4, no=452, id=1302, vol=8.929890e+01 or (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HB2) assign (segid " " and resid 189 and name HA) (segid " " and resid 188 and name HB) 2.491 0.776 3.509 weight 1.000 ! spec=c13n...li-4, no=454, id=1304, vol=1.206301e+02 or (segid " " and resid 189 and name HA) (segid " " and resid 190 and name HB2) or (segid " " and resid 189 and name HA) (segid " " and resid 190 and name HB1) assign (segid " " and resid 98 and name HA) (segid " " and resid 98 and name HB2) 1.926 0.464 0.464 weight 1.000 ! spec=c13n...li-4, no=463, id=1310, vol=5.642692e+02 or (segid " " and resid 106 and name HA) (segid " " and resid 106 and name HB2) assign (segid " " and resid 154 and name HA) (segid " " and resid 157 and name HB2) 2.152 0.579 0.579 weight 1.000 ! spec=c13n...li-4, no=466, id=1313, vol=2.899686e+02 or (segid " " and resid 189 and name HA) (segid " " and resid 189 and name HG2) assign (segid " " and resid 190 and name HA) (segid " " and resid 190 and name HB2) 2.812 0.989 0.989 weight 1.000 ! spec=c13n...li-4, no=467, id=1314, vol=5.828220e+01 or (segid " " and resid 190 and name HA) (segid " " and resid 190 and name HB1) or (segid " " and resid 99 and name HA) (segid " " and resid 102 and name HB1) assign (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HB1) 2.405 0.723 0.723 weight 1.000 ! spec=c13n...li-4, no=470, id=1317, vol=1.490698e+02 or (segid " " and resid 189 and name HA) (segid " " and resid 189 and name HB1) or (segid " " and resid 96 and name HA) (segid " " and resid 96 and name HB2) or (segid " " and resid 96 and name HA) (segid " " and resid 96 and name HD2) assign (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HB1) 2.059 0.530 0.530 weight 1.000 ! spec=c13n...li-4, no=472, id=1319, vol=3.783888e+02 or (segid " " and resid 189 and name HA) (segid " " and resid 189 and name HB1) or (segid " " and resid 95 and name HA) (segid " " and resid 95 and name HB2) assign (segid " " and resid 99 and name HA) (segid " " and resid 99 and name HG2) 2.336 0.682 0.682 weight 1.000 ! spec=c13n...li-4, no=475, id=1322, vol=1.773565e+02 or (segid " " and resid 106 and name HA) (segid " " and resid 106 and name HB1) assign (segid " " and resid 189 and name HA) (segid " " and resid 190 and name HG2) 2.431 0.739 0.739 weight 1.000 ! spec=c13n...li-4, no=478, id=1325, vol=1.395814e+02 or (segid " " and resid 96 and name HA) (segid " " and resid 96 and name HG1) assign (segid " " and resid 154 and name HA) (segid " " and resid 156 and name HG22) 2.974 1.105 1.105 weight 1.000 ! spec=c13n...li-4, no=485, id=1332, vol=4.170930e+01 or (segid " " and resid 154 and name HA) (segid " " and resid 156 and name HG21) or (segid " " and resid 154 and name HA) (segid " " and resid 156 and name HG23) or (segid " " and resid 189 and name HA) (segid " " and resid 188 and name HG22) or (segid " " and resid 189 and name HA) (segid " " and resid 188 and name HG21) or (segid " " and resid 189 and name HA) (segid " " and resid 188 and name HG23) assign (segid " " and resid 99 and name HA) (segid " " and resid 102 and name HG1) 1.915 0.459 0.459 weight 1.000 ! spec=c13n...li-4, no=487, id=1334, vol=5.837739e+02 or (segid " " and resid 99 and name HA) (segid " " and resid 99 and name HB2) assign (segid " " and resid 105 and name HA) (segid " " and resid 105 and name HB2) 2.073 0.537 0.537 weight 1.000 ! spec=c13n...li-4, no=493, id=1339, vol=3.631350e+02 or (segid " " and resid 173 and name HA) (segid " " and resid 173 and name HG) assign (segid " " and resid 105 and name HA) (segid " " and resid 105 and name HB1) 2.140 0.572 0.572 weight 1.000 ! spec=c13n...li-4, no=495, id=1341, vol=3.003987e+02 or (segid " " and resid 173 and name HA) (segid " " and resid 173 and name HB1) assign (segid " " and resid 173 and name HA) (segid " " and resid 173 and name HD11) 1.770 0.392 4.230 weight 1.000 ! spec=c13n...li-4, no=497, id=1343, vol=9.364567e+02 or (segid " " and resid 105 and name HA) (segid " " and resid 105 and name HD11) assign (segid " " and resid 175 and name HA) (segid " " and resid 122 and name HB2) 2.937 1.078 1.078 weight 1.000 ! spec=c13n...li-4, no=499, id=1345, vol=4.492110e+01 or (segid " " and resid 175 and name HA) (segid " " and resid 180 and name HB2) assign (segid " " and resid 160 and name HA) (segid " " and resid 160 and name HB2) 2.238 0.626 0.626 weight 1.000 ! spec=c13n...li-4, no=517, id=1360, vol=2.293271e+02 or (segid " " and resid 160 and name HA) (segid " " and resid 160 and name HG) assign (segid " " and resid 110 and name HA) (segid " " and resid 110 and name HG) 2.452 0.752 0.752 weight 1.000 ! spec=c13n...li-4, no=540, id=1377, vol=1.325256e+02 or (segid " " and resid 110 and name HA) (segid " " and resid 113 and name HB1) assign (segid " " and resid 94 and name HA) (segid " " and resid 94 and name HG2) 2.574 0.828 0.828 weight 1.000 ! spec=c13n...li-4, no=553, id=1387, vol=9.903150e+01 or (segid " " and resid 94 and name HA) (segid " " and resid 94 and name HG1) assign (segid " " and resid 161 and name HA) (segid " " and resid 161 and name HB1) 2.048 0.524 3.952 weight 1.000 ! spec=c13n...li-4, no=557, id=1390, vol=3.906785e+02 or (segid " " and resid 161 and name HA) (segid " " and resid 161 and name HG2) assign (segid " " and resid 127 and name HA) (segid " " and resid 174 and name HB1) 2.697 0.909 0.909 weight 1.000 ! spec=c13n...li-4, no=561, id=1394, vol=7.489410e+01 or (segid " " and resid 127 and name HA) (segid " " and resid 131 and name HB2) assign (segid " " and resid 161 and name HA) (segid " " and resid 161 and name HB2) 2.105 0.554 0.554 weight 1.000 ! spec=c13n...li-4, no=569, id=1401, vol=3.315521e+02 or (segid " " and resid 178 and name HA) (segid " " and resid 178 and name HB1) assign (segid " " and resid 178 and name HA) (segid " " and resid 177 and name HB2) 2.754 0.948 3.246 weight 1.000 ! spec=c13n...li-4, no=571, id=1403, vol=6.609250e+01 or (segid " " and resid 178 and name HA) (segid " " and resid 179 and name HB1) assign (segid " " and resid 178 and name HA) (segid " " and resid 177 and name HB2) 3.100 1.202 1.202 weight 1.000 ! spec=c13n...li-4, no=572, id=1404, vol=3.246610e+01 or (segid " " and resid 178 and name HA) (segid " " and resid 179 and name HB2) assign (segid " " and resid 150 and name HA) (segid " " and resid 149 and name HB2) 2.114 0.559 3.886 weight 1.000 ! spec=c13n...li-4, no=583, id=1413, vol=3.229687e+02 or (segid " " and resid 150 and name HA) (segid " " and resid 153 and name HB2) assign (segid " " and resid 174 and name HA) (segid " " and resid 173 and name HB1) 2.688 0.903 3.312 weight 1.000 ! spec=c13n...li-4, no=587, id=1416, vol=7.643120e+01 or (segid " " and resid 174 and name HA) (segid " " and resid 177 and name HD2) assign (segid " " and resid 131 and name HA) (segid " " and resid 131 and name HB2) 2.154 0.580 0.580 weight 1.000 ! spec=c13n...li-4, no=618, id=1437, vol=2.883533e+02 or (segid " " and resid 131 and name HA) (segid " " and resid 131 and name HG) assign (segid " " and resid 120 and name HD2) (segid " " and resid 119 and name HD11) 2.865 1.026 1.026 weight 1.000 ! spec=c13n...li-4, no=641, id=1457, vol=5.211830e+01 or (segid " " and resid 120 and name HD2) (segid " " and resid 155 and name HD11) assign (segid " " and resid 179 and name HD2) (segid " " and resid 176 and name HA) 3.024 1.143 1.143 weight 1.000 ! spec=c13n...li-4, no=698, id=1504, vol=3.767980e+01 or (segid " " and resid 179 and name HD2) (segid " " and resid 177 and name HA) assign (segid " " and resid 117 and name HD2) (segid " " and resid 117 and name HG2) 2.278 0.649 0.649 weight 1.000 ! spec=c13n...li-4, no=713, id=1515, vol=2.063261e+02 or (segid " " and resid 117 and name HD1) (segid " " and resid 117 and name HG2) assign (segid " " and resid 161 and name HD2) (segid " " and resid 161 and name HG1) 1.997 0.498 0.498 weight 1.000 ! spec=c13n...li-4, no=716, id=1518, vol=4.551935e+02 or (segid " " and resid 161 and name HD2) (segid " " and resid 161 and name HB1) or (segid " " and resid 161 and name HD2) (segid " " and resid 161 and name HG2) assign (segid " " and resid 117 and name HD2) (segid " " and resid 117 and name HG1) 1.994 0.497 0.497 weight 1.000 ! spec=c13n...li-4, no=718, id=1520, vol=4.581952e+02 or (segid " " and resid 117 and name HD2) (segid " " and resid 117 and name HB1) assign (segid " " and resid 117 and name HD1) (segid " " and resid 182 and name HD1) 2.596 0.842 0.842 weight 1.000 ! spec=c13n...li-4, no=720, id=1522, vol=9.422700e+01 or (segid " " and resid 117 and name HD2) (segid " " and resid 182 and name HD1) assign (segid " " and resid 100 and name HB2) (segid " " and resid 97 and name HA) 3.070 1.178 1.178 weight 1.000 ! spec=c13n...li-4, no=733, id=1532, vol=3.442120e+01 or (segid " " and resid 101 and name HA) (segid " " and resid 100 and name HB2) assign (segid " " and resid 181 and name HE2) (segid " " and resid 181 and name HD2) 2.104 0.553 0.553 weight 1.000 ! spec=c13n...li-4, no=754, id=1547, vol=3.321796e+02 or (segid " " and resid 95 and name HE2) (segid " " and resid 95 and name HD2) or (segid " " and resid 96 and name HE2) (segid " " and resid 96 and name HD1) assign (segid " " and resid 96 and name HE2) (segid " " and resid 96 and name HD1) 2.496 0.779 0.779 weight 1.000 ! spec=c13n...li-4, no=757, id=1550, vol=1.191452e+02 or (segid " " and resid 181 and name HE2) (segid " " and resid 181 and name HD2) assign (segid " " and resid 146 and name HE2) (segid " " and resid 146 and name HD2) 1.972 0.486 0.486 weight 1.000 ! spec=c13n...li-4, no=765, id=1557, vol=4.905717e+02 or (segid " " and resid 99 and name HE2) (segid " " and resid 99 and name HG2) assign (segid " " and resid 169 and name HE2) (segid " " and resid 169 and name HD2) 1.642 0.337 0.337 weight 1.000 ! spec=c13n...li-4, no=766, id=1558, vol=1.470939e+03 or (segid " " and resid 181 and name HE2) (segid " " and resid 181 and name HD2) or (segid " " and resid 96 and name HE2) (segid " " and resid 96 and name HD1) or (segid " " and resid 99 and name HE2) (segid " " and resid 99 and name HD2) or (segid " " and resid 108 and name HE2) (segid " " and resid 108 and name HD2) assign (segid " " and resid 96 and name HE2) (segid " " and resid 96 and name HG1) 2.001 0.501 0.501 weight 1.000 ! spec=c13n...li-4, no=767, id=1559, vol=4.489135e+02 or (segid " " and resid 146 and name HE2) (segid " " and resid 146 and name HG2) assign (segid " " and resid 163 and name HB2) (segid " " and resid 162 and name HA) 2.696 0.909 3.304 weight 1.000 ! spec=c13n...li-4, no=774, id=1565, vol=7.509710e+01 or (segid " " and resid 169 and name HE2) (segid " " and resid 188 and name HA) assign (segid " " and resid 108 and name HE2) (segid " " and resid 104 and name HB1) 2.306 0.665 0.665 weight 1.000 ! spec=c13n...li-4, no=784, id=1571, vol=1.915500e+02 or (segid " " and resid 108 and name HE2) (segid " " and resid 108 and name HB2) assign (segid " " and resid 169 and name HE2) (segid " " and resid 169 and name HD2) 1.641 0.337 0.337 weight 1.000 ! spec=c13n...li-4, no=785, id=1572, vol=1.474068e+03 or (segid " " and resid 99 and name HE2) (segid " " and resid 99 and name HD2) or (segid " " and resid 108 and name HE2) (segid " " and resid 108 and name HD2) assign (segid " " and resid 146 and name HE2) (segid " " and resid 146 and name HG2) 2.064 0.533 0.533 weight 1.000 ! spec=c13n...li-4, no=786, id=1573, vol=3.728917e+02 or (segid " " and resid 115 and name HE2) (segid " " and resid 115 and name HG2) assign (segid " " and resid 126 and name HA) (segid " " and resid 126 and name HB2) 2.406 0.723 0.723 weight 1.000 ! spec=c13n...li-4, no=792, id=1579, vol=1.487344e+02 or (segid " " and resid 180 and name HA) (segid " " and resid 180 and name HB2) assign (segid " " and resid 122 and name HB2) (segid " " and resid 178 and name HB1) 2.511 0.788 0.788 weight 1.000 ! spec=c13n...li-4, no=802, id=1587, vol=1.149226e+02 or (segid " " and resid 122 and name HB2) (segid " " and resid 123 and name HB) or (segid " " and resid 154 and name HE2) (segid " " and resid 154 and name HB1) or (segid " " and resid 180 and name HB2) (segid " " and resid 178 and name HB1) assign (segid " " and resid 126 and name HB2) (segid " " and resid 174 and name HB2) 2.329 0.678 0.678 weight 1.000 ! spec=c13n...li-4, no=805, id=1590, vol=1.806776e+02 or (segid " " and resid 126 and name HB2) (segid " " and resid 174 and name HB1) or (segid " " and resid 126 and name HB2) (segid " " and resid 174 and name HB3) or (segid " " and resid 154 and name HE2) (segid " " and resid 154 and name HD1) assign (segid " " and resid 180 and name HB2) (segid " " and resid 119 and name HG11) 2.574 0.828 0.828 weight 1.000 ! spec=c13n...li-4, no=806, id=1591, vol=9.921130e+01 or (segid " " and resid 122 and name HB2) (segid " " and resid 119 and name HG11) or (segid " " and resid 154 and name HE2) (segid " " and resid 154 and name HG2) assign (segid " " and resid 122 and name HB2) (segid " " and resid 123 and name HG22) 2.375 0.705 0.705 weight 1.000 ! spec=c13n...li-4, no=808, id=1593, vol=1.606647e+02 or (segid " " and resid 122 and name HB2) (segid " " and resid 123 and name HG21) or (segid " " and resid 122 and name HB2) (segid " " and resid 123 and name HG23) or (segid " " and resid 122 and name HB2) (segid " " and resid 175 and name HD22) or (segid " " and resid 122 and name HB2) (segid " " and resid 175 and name HD21) or (segid " " and resid 122 and name HB2) (segid " " and resid 175 and name HD23) assign (segid " " and resid 175 and name HB2) (segid " " and resid 175 and name HA) 2.628 0.863 0.863 weight 1.000 ! spec=c13n...li-4, no=824, id=1605, vol=8.752220e+01 or (segid " " and resid 183 and name HB2) (segid " " and resid 175 and name HB2) assign (segid " " and resid 175 and name HB2) (segid " " and resid 176 and name HG2) 3.095 1.197 2.905 weight 1.000 ! spec=c13n...li-4, no=826, id=1607, vol=3.283090e+01 or (segid " " and resid 175 and name HB2) (segid " " and resid 172 and name HB2) assign (segid " " and resid 171 and name HB2) (segid " " and resid 171 and name HD21) 2.579 0.831 0.831 weight 1.000 ! spec=c13n...li-4, no=856, id=1630, vol=9.797240e+01 or (segid " " and resid 107 and name HB2) (segid " " and resid 160 and name HD21) assign (segid " " and resid 105 and name HA) (segid " " and resid 105 and name HB2) 2.224 0.618 0.618 weight 1.000 ! spec=c13n...li-4, no=869, id=1642, vol=2.383270e+02 or (segid " " and resid 173 and name HA) (segid " " and resid 173 and name HB2) assign (segid " " and resid 105 and name HB2) (segid " " and resid 104 and name HB2) 2.753 0.947 3.247 weight 1.000 ! spec=c13n...li-4, no=872, id=1645, vol=6.626310e+01 or (segid " " and resid 140 and name HB2) (segid " " and resid 141 and name HB2) assign (segid " " and resid 105 and name HB2) (segid " " and resid 105 and name HB1) 1.841 0.424 0.424 weight 1.000 ! spec=c13n...li-4, no=878, id=1649, vol=7.411888e+02 or (segid " " and resid 173 and name HB2) (segid " " and resid 173 and name HB1) assign (segid " " and resid 160 and name HB2) (segid " " and resid 160 and name HD11) 2.429 0.737 3.571 weight 1.000 ! spec=c13n...li-4, no=894, id=1663, vol=1.405170e+02 or (segid " " and resid 123 and name HB) (segid " " and resid 175 and name HD11) assign (segid " " and resid 173 and name HB1) (segid " " and resid 173 and name HD11) 2.436 0.742 0.742 weight 1.000 ! spec=c13n...li-4, no=913, id=1680, vol=1.378788e+02 or (segid " " and resid 106 and name HB1) (segid " " and resid 106 and name HD21) assign (segid " " and resid 106 and name HB1) (segid " " and resid 106 and name HD12) 2.873 1.031 1.031 weight 1.000 ! spec=c13n...li-4, no=914, id=1681, vol=5.131520e+01 or (segid " " and resid 106 and name HB1) (segid " " and resid 106 and name HD11) or (segid " " and resid 106 and name HB1) (segid " " and resid 106 and name HD13) or (segid " " and resid 127 and name HB2) (segid " " and resid 123 and name HD12) or (segid " " and resid 127 and name HB2) (segid " " and resid 123 and name HD11) or (segid " " and resid 127 and name HB2) (segid " " and resid 123 and name HD13) assign (segid " " and resid 105 and name HB1) (segid " " and resid 105 and name HD11) 2.024 0.512 0.512 weight 1.000 ! spec=c13n...li-4, no=916, id=1683, vol=4.199794e+02 or (segid " " and resid 173 and name HB1) (segid " " and resid 173 and name HD11) assign (segid " " and resid 105 and name HB1) (segid " " and resid 105 and name HD21) 2.017 0.508 0.508 weight 1.000 ! spec=c13n...li-4, no=933, id=1697, vol=4.285720e+02 or (segid " " and resid 105 and name HB1) (segid " " and resid 105 and name HD11) assign (segid " " and resid 175 and name HB1) (segid " " and resid 176 and name HG2) 2.998 1.123 1.123 weight 1.000 ! spec=c13n...li-4, no=939, id=1703, vol=3.974000e+01 or (segid " " and resid 175 and name HB1) (segid " " and resid 178 and name HG2) assign (segid " " and resid 175 and name HB1) (segid " " and resid 182 and name HB1) 2.970 1.103 1.103 weight 1.000 ! spec=c13n...li-4, no=940, id=1704, vol=4.199170e+01 or (segid " " and resid 185 and name HB2) (segid " " and resid 186 and name HB1) assign (segid " " and resid 175 and name HB1) (segid " " and resid 175 and name HD12) 2.526 0.798 0.798 weight 1.000 ! spec=c13n...li-4, no=946, id=1709, vol=1.108980e+02 or (segid " " and resid 175 and name HB1) (segid " " and resid 175 and name HD11) or (segid " " and resid 175 and name HB1) (segid " " and resid 175 and name HD13) or (segid " " and resid 185 and name HB2) (segid " " and resid 185 and name HD12) or (segid " " and resid 185 and name HB2) (segid " " and resid 185 and name HD11) or (segid " " and resid 185 and name HB2) (segid " " and resid 185 and name HD13) assign (segid " " and resid 114 and name HB2) (segid " " and resid 118 and name HG12) 2.997 1.123 1.123 weight 1.000 ! spec=c13n...li-4, no=968, id=1725, vol=3.977480e+01 or (segid " " and resid 114 and name HB2) (segid " " and resid 156 and name HG22) or (segid " " and resid 114 and name HB2) (segid " " and resid 156 and name HG21) or (segid " " and resid 114 and name HB2) (segid " " and resid 156 and name HG23) assign (segid " " and resid 166 and name HB2) (segid " " and resid 164 and name HB2) 2.944 1.083 1.083 weight 1.000 ! spec=c13n...li-4, no=1020, id=1768, vol=4.432990e+01 or (segid " " and resid 166 and name HB2) (segid " " and resid 165 and name HB2) or (segid " " and resid 166 and name HB2) (segid " " and resid 165 and name HB1) or (segid " " and resid 103 and name HB2) (segid " " and resid 106 and name HB2) or (segid " " and resid 103 and name HB2) (segid " " and resid 107 and name HB1) assign (segid " " and resid 133 and name HB2) (segid " " and resid 137 and name HB2) 3.020 1.140 1.140 weight 1.000 ! spec=c13n...li-4, no=1023, id=1771, vol=3.797090e+01 or (segid " " and resid 166 and name HB1) (segid " " and resid 129 and name HB1) assign (segid " " and resid 103 and name HB1) (segid " " and resid 100 and name HD11) 2.701 0.912 0.912 weight 1.000 ! spec=c13n...li-4, no=1040, id=1783, vol=7.433610e+01 or (segid " " and resid 103 and name HB1) (segid " " and resid 168 and name HB2) assign (segid " " and resid 113 and name HG2) (segid " " and resid 110 and name HG) 2.158 0.582 0.582 weight 1.000 ! spec=c13n...li-4, no=1046, id=1788, vol=2.854078e+02 or (segid " " and resid 176 and name HG2) (segid " " and resid 176 and name HB2) assign (segid " " and resid 176 and name HG2) (segid " " and resid 172 and name HG1) 3.034 1.151 1.151 weight 1.000 ! spec=c13n...li-4, no=1049, id=1790, vol=3.693720e+01 or (segid " " and resid 176 and name HG2) (segid " " and resid 173 and name HB1) or (segid " " and resid 176 and name HG2) (segid " " and resid 177 and name HD2) assign (segid " " and resid 113 and name HG2) (segid " " and resid 185 and name HB2) 2.936 1.077 1.077 weight 1.000 ! spec=c13n...li-4, no=1050, id=1791, vol=4.503360e+01 or (segid " " and resid 176 and name HG2) (segid " " and resid 177 and name HG2) assign (segid " " and resid 129 and name HG2) (segid " " and resid 130 and name HB1) 2.947 1.086 1.086 weight 1.000 ! spec=c13n...li-4, no=1073, id=1811, vol=4.401170e+01 or (segid " " and resid 129 and name HG2) (segid " " and resid 166 and name HB2) assign (segid " " and resid 135 and name HG2) (segid " " and resid 135 and name HB1) 2.395 0.717 0.717 weight 1.000 ! spec=c13n...li-4, no=1077, id=1813, vol=1.527235e+02 or (segid " " and resid 135 and name HG1) (segid " " and resid 135 and name HB1) assign (segid " " and resid 176 and name HG1) (segid " " and resid 176 and name HA) 3.002 1.126 1.126 weight 1.000 ! spec=c13n...li-4, no=1101, id=1833, vol=3.942100e+01 or (segid " " and resid 150 and name HA) (segid " " and resid 153 and name HG1) assign (segid " " and resid 122 and name HB2) (segid " " and resid 119 and name HB) 2.688 0.903 0.903 weight 1.000 ! spec=c13n...li-4, no=1103, id=1835, vol=7.638010e+01 or (segid " " and resid 157 and name HG1) (segid " " and resid 154 and name HE2) assign (segid " " and resid 124 and name HA) (segid " " and resid 124 and name HB) 2.063 0.532 0.532 weight 1.000 ! spec=c13n...li-4, no=1116, id=1846, vol=3.741886e+02 or (segid " " and resid 124 and name HB) (segid " " and resid 120 and name HA) assign (segid " " and resid 139 and name HB) (segid " " and resid 139 and name HG12) 2.630 0.864 0.864 weight 1.000 ! spec=c13n...li-4, no=1122, id=1851, vol=8.717280e+01 or (segid " " and resid 142 and name HB) (segid " " and resid 142 and name HG11) assign (segid " " and resid 124 and name HB) (segid " " and resid 124 and name HG21) 1.865 0.435 0.435 weight 1.000 ! spec=c13n...li-4, no=1124, id=1853, vol=6.862977e+02 or (segid " " and resid 97 and name HB) (segid " " and resid 97 and name HG21) assign (segid " " and resid 138 and name HG2) (segid " " and resid 138 and name HG1) 1.697 0.360 0.360 weight 1.000 ! spec=c13n...li-4, no=1158, id=1878, vol=1.207634e+03 or (segid " " and resid 157 and name HG2) (segid " " and resid 157 and name HG1) assign (segid " " and resid 157 and name HG2) (segid " " and resid 154 and name HD2) 3.019 1.139 1.139 weight 1.000 ! spec=c13n...li-4, no=1159, id=1879, vol=3.808060e+01 or (segid " " and resid 165 and name HG2) (segid " " and resid 100 and name HG) assign (segid " " and resid 113 and name HG1) (segid " " and resid 185 and name HD12) 2.665 0.888 0.888 weight 1.000 ! spec=c13n...li-4, no=1169, id=1887, vol=8.043890e+01 or (segid " " and resid 113 and name HG1) (segid " " and resid 185 and name HD11) or (segid " " and resid 113 and name HG1) (segid " " and resid 185 and name HD13) or (segid " " and resid 184 and name HG2) (segid " " and resid 185 and name HD22) or (segid " " and resid 184 and name HG2) (segid " " and resid 185 and name HD21) or (segid " " and resid 184 and name HG2) (segid " " and resid 185 and name HD23) assign (segid " " and resid 148 and name HG2) (segid " " and resid 148 and name HE2) 2.360 0.696 0.696 weight 1.000 ! spec=c13n...li-4, no=1209, id=1918, vol=1.667849e+02 or (segid " " and resid 148 and name HG2) (segid " " and resid 148 and name HE1) or (segid " " and resid 148 and name HG2) (segid " " and resid 148 and name HE3) or (segid " " and resid 148 and name HG2) (segid " " and resid 148 and name HB1) or (segid " " and resid 148 and name HG1) (segid " " and resid 148 and name HB1) assign (segid " " and resid 148 and name HG2) (segid " " and resid 119 and name HG22) 2.718 0.923 0.923 weight 1.000 ! spec=c13n...li-4, no=1212, id=1921, vol=7.153330e+01 or (segid " " and resid 148 and name HG2) (segid " " and resid 119 and name HG21) or (segid " " and resid 148 and name HG2) (segid " " and resid 119 and name HG23) or (segid " " and resid 148 and name HG1) (segid " " and resid 119 and name HG22) or (segid " " and resid 148 and name HG1) (segid " " and resid 119 and name HG21) or (segid " " and resid 148 and name HG1) (segid " " and resid 119 and name HG23) assign (segid " " and resid 148 and name HG2) (segid " " and resid 119 and name HD12) 2.787 0.971 0.971 weight 1.000 ! spec=c13n...li-4, no=1213, id=1922, vol=6.155820e+01 or (segid " " and resid 148 and name HG2) (segid " " and resid 119 and name HD11) or (segid " " and resid 148 and name HG2) (segid " " and resid 119 and name HD13) or (segid " " and resid 148 and name HG1) (segid " " and resid 119 and name HD12) or (segid " " and resid 148 and name HG1) (segid " " and resid 119 and name HD11) or (segid " " and resid 148 and name HG1) (segid " " and resid 119 and name HD13) assign (segid " " and resid 148 and name HG1) (segid " " and resid 148 and name HA) 2.835 1.004 1.004 weight 1.000 ! spec=c13n...li-4, no=1214, id=1923, vol=5.556510e+01 or (segid " " and resid 148 and name HG2) (segid " " and resid 148 and name HA) assign (segid " " and resid 149 and name HG2) (segid " " and resid 149 and name HB1) 2.569 0.825 0.825 weight 1.000 ! spec=c13n...li-4, no=1221, id=1927, vol=1.004004e+02 or (segid " " and resid 149 and name HG1) (segid " " and resid 149 and name HB1) assign (segid " " and resid 149 and name HG2) (segid " " and resid 115 and name HB1) 3.056 1.167 1.167 weight 1.000 ! spec=c13n...li-4, no=1222, id=1928, vol=3.541830e+01 or (segid " " and resid 149 and name HG1) (segid " " and resid 115 and name HB1) assign (segid " " and resid 149 and name HG1) (segid " " and resid 152 and name HB2) 3.040 1.155 1.155 weight 1.000 ! spec=c13n...li-4, no=1223, id=1929, vol=3.652370e+01 or (segid " " and resid 149 and name HG1) (segid " " and resid 152 and name HB1) or (segid " " and resid 149 and name HG1) (segid " " and resid 152 and name HB3) or (segid " " and resid 149 and name HG2) (segid " " and resid 152 and name HB2) or (segid " " and resid 149 and name HG2) (segid " " and resid 152 and name HB1) or (segid " " and resid 149 and name HG2) (segid " " and resid 152 and name HB3) assign (segid " " and resid 169 and name HA) (segid " " and resid 172 and name HB2) 2.587 0.836 0.836 weight 1.000 ! spec=c13n...li-4, no=1227, id=1933, vol=9.628180e+01 or (segid " " and resid 172 and name HB2) (segid " " and resid 183 and name HA) assign (segid " " and resid 172 and name HB2) (segid " " and resid 172 and name HG1) 2.686 0.902 0.902 weight 1.000 ! spec=c13n...li-4, no=1239, id=1941, vol=7.673500e+01 or (segid " " and resid 172 and name HB2) (segid " " and resid 172 and name HD2) assign (segid " " and resid 134 and name HA) (segid " " and resid 134 and name HG2) 2.093 0.547 0.547 weight 1.000 ! spec=c13n...li-4, no=1254, id=1950, vol=3.432625e+02 or (segid " " and resid 141 and name HA) (segid " " and resid 141 and name HG2) assign (segid " " and resid 148 and name HG2) (segid " " and resid 148 and name HB2) 2.484 0.771 0.771 weight 1.000 ! spec=c13n...li-4, no=1262, id=1956, vol=1.226710e+02 or (segid " " and resid 148 and name HG1) (segid " " and resid 148 and name HB2) assign (segid " " and resid 94 and name HA) (segid " " and resid 94 and name HB2) 2.400 0.720 0.720 weight 1.000 ! spec=c13n...li-4, no=1270, id=1961, vol=1.508596e+02 or (segid " " and resid 119 and name HA) (segid " " and resid 148 and name HB1) assign (segid " " and resid 117 and name HB2) (segid " " and resid 182 and name HA) 2.805 0.984 0.984 weight 1.000 ! spec=c13n...li-4, no=1271, id=1962, vol=5.918320e+01 or (segid " " and resid 172 and name HA) (segid " " and resid 172 and name HB1) assign (segid " " and resid 148 and name HG2) (segid " " and resid 148 and name HB1) 2.453 0.752 0.752 weight 1.000 ! spec=c13n...li-4, no=1273, id=1964, vol=1.324092e+02 or (segid " " and resid 148 and name HG1) (segid " " and resid 148 and name HB1) assign (segid " " and resid 172 and name HB1) (segid " " and resid 172 and name HD2) 2.187 0.598 0.598 weight 1.000 ! spec=c13n...li-4, no=1277, id=1967, vol=2.632349e+02 or (segid " " and resid 117 and name HB2) (segid " " and resid 117 and name HB1) assign (segid " " and resid 177 and name HA) (segid " " and resid 177 and name HB2) 1.960 0.480 0.480 weight 1.000 ! spec=c13n...li-4, no=1281, id=1971, vol=5.093536e+02 or (segid " " and resid 105 and name HA) (segid " " and resid 108 and name HB2) assign (segid " " and resid 115 and name HA) (segid " " and resid 115 and name HB2) 2.000 0.500 0.500 weight 1.000 ! spec=c13n...li-4, no=1284, id=1974, vol=4.499519e+02 or (segid " " and resid 108 and name HA) (segid " " and resid 108 and name HB2) assign (segid " " and resid 108 and name HE2) (segid " " and resid 108 and name HB2) 2.382 0.710 0.710 weight 1.000 ! spec=c13n...li-4, no=1285, id=1975, vol=1.576754e+02 or (segid " " and resid 177 and name HE2) (segid " " and resid 177 and name HB2) assign (segid " " and resid 108 and name HB2) (segid " " and resid 108 and name HG1) 1.979 0.489 0.489 weight 1.000 ! spec=c13n...li-4, no=1290, id=1979, vol=4.806236e+02 or (segid " " and resid 108 and name HB2) (segid " " and resid 108 and name HD2) assign (segid " " and resid 108 and name HB2) (segid " " and resid 108 and name HD2) 1.998 0.499 0.499 weight 1.000 ! spec=c13n...li-4, no=1292, id=1981, vol=4.527992e+02 or (segid " " and resid 115 and name HB2) (segid " " and resid 115 and name HD2) assign (segid " " and resid 181 and name HB2) (segid " " and resid 117 and name HD2) 2.859 1.022 1.022 weight 1.000 ! spec=c13n...li-4, no=1301, id=1989, vol=5.274410e+01 or (segid " " and resid 181 and name HB2) (segid " " and resid 117 and name HD1) or (segid " " and resid 181 and name HB2) (segid " " and resid 181 and name HE2) assign (segid " " and resid 149 and name HB1) (segid " " and resid 149 and name HE2) 1.895 0.449 0.449 weight 1.000 ! spec=c13n...li-4, no=1304, id=1992, vol=6.227986e+02 or (segid " " and resid 149 and name HB1) (segid " " and resid 149 and name HE1) or (segid " " and resid 149 and name HB1) (segid " " and resid 149 and name HE3) or (segid " " and resid 149 and name HB2) (segid " " and resid 149 and name HB1) assign (segid " " and resid 181 and name HB2) (segid " " and resid 181 and name HG2) 2.103 0.553 0.553 weight 1.000 ! spec=c13n...li-4, no=1306, id=1993, vol=3.329332e+02 or (segid " " and resid 99 and name HB2) (segid " " and resid 99 and name HG2) assign (segid " " and resid 169 and name HB2) (segid " " and resid 169 and name HD2) 2.082 0.542 0.542 weight 1.000 ! spec=c13n...li-4, no=1307, id=1994, vol=3.543538e+02 or (segid " " and resid 181 and name HB2) (segid " " and resid 181 and name HD2) assign (segid " " and resid 169 and name HB2) (segid " " and resid 188 and name HG22) 2.966 1.100 1.100 weight 1.000 ! spec=c13n...li-4, no=1308, id=1995, vol=4.233390e+01 or (segid " " and resid 169 and name HB2) (segid " " and resid 188 and name HG21) or (segid " " and resid 169 and name HB2) (segid " " and resid 188 and name HG23) or (segid " " and resid 169 and name HB2) (segid " " and resid 188 and name HG12) or (segid " " and resid 169 and name HB2) (segid " " and resid 188 and name HG11) or (segid " " and resid 169 and name HB2) (segid " " and resid 188 and name HG13) assign (segid " " and resid 95 and name HA) (segid " " and resid 95 and name HB2) 2.013 0.507 0.507 weight 1.000 ! spec=c13n...li-4, no=1309, id=1996, vol=4.332548e+02 or (segid " " and resid 96 and name HA) (segid " " and resid 96 and name HB2) assign (segid " " and resid 120 and name HD2) (segid " " and resid 120 and name HB2) 2.230 0.621 0.621 weight 1.000 ! spec=c13n...li-4, no=1310, id=1997, vol=2.347460e+02 or (segid " " and resid 169 and name HA) (segid " " and resid 169 and name HB2) assign (segid " " and resid 95 and name HB2) (segid " " and resid 95 and name HG2) 2.003 0.501 0.501 weight 1.000 ! spec=c13n...li-4, no=1317, id=2003, vol=4.466515e+02 or (segid " " and resid 96 and name HB2) (segid " " and resid 96 and name HG2) or (segid " " and resid 115 and name HB1) (segid " " and resid 115 and name HG2) or (segid " " and resid 169 and name HB2) (segid " " and resid 169 and name HG2) assign (segid " " and resid 96 and name HB2) (segid " " and resid 96 and name HG1) 2.066 0.534 0.534 weight 1.000 ! spec=c13n...li-4, no=1318, id=2004, vol=3.707877e+02 or (segid " " and resid 115 and name HB1) (segid " " and resid 115 and name HG2) or (segid " " and resid 169 and name HB2) (segid " " and resid 169 and name HG2) assign (segid " " and resid 181 and name HB2) (segid " " and resid 181 and name HG2) 2.054 0.527 3.946 weight 1.000 ! spec=c13n...li-4, no=1319, id=2005, vol=3.839309e+02 or (segid " " and resid 115 and name HB1) (segid " " and resid 115 and name HD2) assign (segid " " and resid 169 and name HB2) (segid " " and resid 188 and name HB) 2.340 0.684 3.660 weight 1.000 ! spec=c13n...li-4, no=1331, id=2016, vol=1.756954e+02 or (segid " " and resid 188 and name HB) (segid " " and resid 189 and name HB1) assign (segid " " and resid 188 and name HB) (segid " " and resid 188 and name HG22) 1.970 0.485 0.485 weight 1.000 ! spec=c13n...li-4, no=1339, id=2021, vol=4.931951e+02 or (segid " " and resid 188 and name HB) (segid " " and resid 188 and name HG21) or (segid " " and resid 188 and name HB) (segid " " and resid 188 and name HG23) or (segid " " and resid 188 and name HB) (segid " " and resid 188 and name HG12) or (segid " " and resid 188 and name HB) (segid " " and resid 188 and name HG11) or (segid " " and resid 188 and name HB) (segid " " and resid 188 and name HG13) assign (segid " " and resid 104 and name HB2) (segid " " and resid 105 and name HD21) 3.046 1.160 2.954 weight 1.000 ! spec=c13n...li-4, no=1383, id=2055, vol=3.611080e+01 or (segid " " and resid 104 and name HB2) (segid " " and resid 160 and name HD11) assign (segid " " and resid 135 and name HA) (segid " " and resid 138 and name HB2) 2.420 0.732 0.732 weight 1.000 ! spec=c13n...li-4, no=1386, id=2058, vol=1.435452e+02 or (segid " " and resid 176 and name HB2) (segid " " and resid 173 and name HA) or (segid " " and resid 176 and name HB2) (segid " " and resid 176 and name HA) assign (segid " " and resid 98 and name HA) (segid " " and resid 98 and name HB2) 1.964 0.482 0.482 weight 1.000 ! spec=c13n...li-4, no=1387, id=2059, vol=5.023559e+02 or (segid " " and resid 109 and name HB2) (segid " " and resid 106 and name HA) or (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HB2) assign (segid " " and resid 164 and name HB2) (segid " " and resid 130 and name HB2) 3.011 1.133 1.133 weight 1.000 ! spec=c13n...li-4, no=1389, id=2061, vol=3.868960e+01 or (segid " " and resid 166 and name HB2) (segid " " and resid 164 and name HB2) assign (segid " " and resid 176 and name HG2) (segid " " and resid 176 and name HB2) 2.449 0.750 0.750 weight 1.000 ! spec=c13n...li-4, no=1391, id=2062, vol=1.336663e+02 or (segid " " and resid 157 and name HB2) (segid " " and resid 154 and name HE1) assign (segid " " and resid 154 and name HB2) (segid " " and resid 154 and name HD1) 2.760 0.952 0.952 weight 1.000 ! spec=c13n...li-4, no=1394, id=2064, vol=6.526180e+01 or (segid " " and resid 135 and name HB1) (segid " " and resid 131 and name HG) or (segid " " and resid 153 and name HB2) (segid " " and resid 152 and name HB2) or (segid " " and resid 153 and name HB2) (segid " " and resid 152 and name HB1) or (segid " " and resid 153 and name HB2) (segid " " and resid 152 and name HB3) assign (segid " " and resid 109 and name HB2) (segid " " and resid 110 and name HD21) 2.480 0.769 3.520 weight 1.000 ! spec=c13n...li-4, no=1396, id=2066, vol=1.239905e+02 or (segid " " and resid 109 and name HB2) (segid " " and resid 105 and name HD11) assign (segid " " and resid 98 and name HA) (segid " " and resid 98 and name HB2) 2.225 0.619 0.619 weight 1.000 ! spec=c13n...li-4, no=1402, id=2072, vol=2.378798e+02 or (segid " " and resid 129 and name HB1) (segid " " and resid 170 and name HB) or (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HB2) assign (segid " " and resid 165 and name HG2) (segid " " and resid 165 and name HB1) 1.828 0.418 0.418 weight 1.000 ! spec=c13n...li-4, no=1411, id=2078, vol=7.729915e+02 or (segid " " and resid 135 and name HG2) (segid " " and resid 135 and name HB1) or (segid " " and resid 135 and name HG1) (segid " " and resid 135 and name HB1) assign (segid " " and resid 189 and name HA) (segid " " and resid 189 and name HB2) 2.297 0.659 0.659 weight 1.000 ! spec=c13n...li-4, no=1425, id=2090, vol=1.965078e+02 or (segid " " and resid 104 and name HB1) (segid " " and resid 101 and name HA) assign (segid " " and resid 167 and name HB1) (segid " " and resid 159 and name HD21) 2.826 0.999 3.174 weight 1.000 ! spec=c13n...li-4, no=1483, id=2125, vol=5.655100e+01 or (segid " " and resid 167 and name HB1) (segid " " and resid 159 and name HD11) assign (segid " " and resid 167 and name HB2) (segid " " and resid 130 and name HB1) 2.997 1.123 1.123 weight 1.000 ! spec=c13n...li-4, no=1491, id=2132, vol=3.977260e+01 or (segid " " and resid 167 and name HB2) (segid " " and resid 168 and name HD2) assign (segid " " and resid 130 and name HB1) (segid " " and resid 131 and name HB2) 2.841 1.009 1.009 weight 1.000 ! spec=c13n...li-4, no=1515, id=2150, vol=5.482060e+01 or (segid " " and resid 130 and name HB1) (segid " " and resid 164 and name HG2) assign (segid " " and resid 157 and name HB2) (segid " " and resid 157 and name HG2) 1.859 0.432 0.432 weight 1.000 ! spec=c13n...li-4, no=1555, id=2182, vol=6.980048e+02 or (segid " " and resid 101 and name HB2) (segid " " and resid 101 and name HG2) or (segid " " and resid 138 and name HB2) (segid " " and resid 138 and name HG2) assign (segid " " and resid 129 and name HB2) (segid " " and resid 174 and name HB2) 2.949 1.087 1.087 weight 1.000 ! spec=c13n...li-4, no=1559, id=2185, vol=4.382590e+01 or (segid " " and resid 129 and name HB2) (segid " " and resid 174 and name HB1) or (segid " " and resid 129 and name HB2) (segid " " and resid 174 and name HB3) or (segid " " and resid 137 and name HB1) (segid " " and resid 140 and name HB1) or (segid " " and resid 157 and name HB2) (segid " " and resid 154 and name HD1) assign (segid " " and resid 129 and name HA) (segid " " and resid 129 and name HB1) 2.336 0.682 0.682 weight 1.000 ! spec=c13n...li-4, no=1579, id=2202, vol=1.774668e+02 or (segid " " and resid 137 and name HB2) (segid " " and resid 133 and name HA) assign (segid " " and resid 134 and name HA) (segid " " and resid 138 and name HB1) 2.345 0.687 3.655 weight 1.000 ! spec=c13n...li-4, no=1582, id=2205, vol=1.733508e+02 or (segid " " and resid 184 and name HB2) (segid " " and resid 185 and name HA) assign (segid " " and resid 120 and name HD1) (segid " " and resid 120 and name HG2) 2.429 0.738 0.738 weight 1.000 ! spec=c13n...li-4, no=1583, id=2206, vol=1.403695e+02 or (segid " " and resid 151 and name HA2) (segid " " and resid 120 and name HG2) assign (segid " " and resid 129 and name HB1) (segid " " and resid 129 and name HG2) 1.803 0.406 0.406 weight 1.000 ! spec=c13n...li-4, no=1592, id=2215, vol=8.388495e+02 or (segid " " and resid 137 and name HG2) (segid " " and resid 137 and name HB2) or (segid " " and resid 184 and name HB2) (segid " " and resid 184 and name HG2) assign (segid " " and resid 95 and name HE2) (segid " " and resid 95 and name HD2) 2.112 0.558 0.558 weight 1.000 ! spec=c13n...li-4, no=1626, id=2244, vol=3.245719e+02 or (segid " " and resid 181 and name HE2) (segid " " and resid 181 and name HD2) assign (segid " " and resid 154 and name HD2) (segid " " and resid 154 and name HB2) 2.201 0.606 0.606 weight 1.000 ! spec=c13n...li-4, no=1627, id=2245, vol=2.534087e+02 or (segid " " and resid 164 and name HB2) (segid " " and resid 164 and name HD2) assign (segid " " and resid 96 and name HA) (segid " " and resid 96 and name HD1) 2.459 0.756 0.756 weight 1.000 ! spec=c13n...li-4, no=1635, id=2251, vol=1.303003e+02 or (segid " " and resid 99 and name HA) (segid " " and resid 102 and name HB1) assign (segid " " and resid 99 and name HA) (segid " " and resid 102 and name HB1) 2.188 0.598 0.598 weight 1.000 ! spec=c13n...li-4, no=1636, id=2252, vol=2.631551e+02 or (segid " " and resid 181 and name HD2) (segid " " and resid 181 and name HA) assign (segid " " and resid 169 and name HE2) (segid " " and resid 169 and name HD2) 1.873 0.438 0.438 weight 1.000 ! spec=c13n...li-4, no=1638, id=2254, vol=6.686667e+02 or (segid " " and resid 96 and name HE2) (segid " " and resid 96 and name HD1) or (segid " " and resid 108 and name HE2) (segid " " and resid 108 and name HD2) assign (segid " " and resid 169 and name HD2) (segid " " and resid 168 and name HD1) 2.402 0.721 0.721 weight 1.000 ! spec=c13n...li-4, no=1644, id=2258, vol=1.501331e+02 or (segid " " and resid 181 and name HD2) (segid " " and resid 184 and name HG2) assign (segid " " and resid 102 and name HB2) (segid " " and resid 102 and name HB1) 1.621 0.328 0.328 weight 1.000 ! spec=c13n...li-4, no=1646, id=2260, vol=1.590937e+03 or (segid " " and resid 96 and name HD2) (segid " " and resid 96 and name HD1) assign (segid " " and resid 181 and name HD2) (segid " " and resid 181 and name HG2) 1.619 0.328 4.381 weight 1.000 ! spec=c13n...li-4, no=1648, id=2261, vol=1.599655e+03 or (segid " " and resid 99 and name HD2) (segid " " and resid 99 and name HG2) assign (segid " " and resid 183 and name HA) (segid " " and resid 172 and name HD2) 2.965 1.099 3.035 weight 1.000 ! spec=c13n...li-4, no=1652, id=2265, vol=4.240100e+01 or (segid " " and resid 172 and name HD2) (segid " " and resid 183 and name HB2) assign (segid " " and resid 146 and name HD2) (segid " " and resid 149 and name HB2) 3.017 1.137 2.983 weight 1.000 ! spec=c13n...li-4, no=1653, id=2266, vol=3.827050e+01 or (segid " " and resid 172 and name HD2) (segid " " and resid 171 and name HB2) or (segid " " and resid 172 and name HD2) (segid " " and resid 176 and name HB2) or (segid " " and resid 172 and name HD2) (segid " " and resid 176 and name HG1) assign (segid " " and resid 146 and name HD2) (segid " " and resid 142 and name HD11) 2.789 0.972 0.972 weight 1.000 ! spec=c13n...li-4, no=1656, id=2268, vol=6.132660e+01 or (segid " " and resid 146 and name HD2) (segid " " and resid 142 and name HG21) assign (segid " " and resid 172 and name HD2) (segid " " and resid 172 and name HG1) 2.144 0.575 0.575 weight 1.000 ! spec=c13n...li-4, no=1664, id=2276, vol=2.964905e+02 or (segid " " and resid 172 and name HD2) (segid " " and resid 188 and name HB) assign (segid " " and resid 97 and name HA) (segid " " and resid 97 and name HG12) 2.664 0.887 0.887 weight 1.000 ! spec=c13n...li-4, no=1681, id=2287, vol=8.060450e+01 or (segid " " and resid 171 and name HA) (segid " " and resid 171 and name HG) assign (segid " " and resid 124 and name HG12) (segid " " and resid 127 and name HB1) 2.946 1.085 1.085 weight 1.000 ! spec=c13n...li-4, no=1683, id=2289, vol=4.413000e+01 or (segid " " and resid 124 and name HG12) (segid " " and resid 140 and name HG) assign (segid " " and resid 175 and name HD13) (segid " " and resid 186 and name HD1) 2.752 0.947 0.947 weight 1.000 ! spec=c13n...li-4, no=1703, id=2300, vol=6.639130e+01 or (segid " " and resid 175 and name HD11) (segid " " and resid 186 and name HD1) assign (segid " " and resid 183 and name HB2) (segid " " and resid 175 and name HD12) 2.604 0.848 0.848 weight 1.000 ! spec=c13n...li-4, no=1705, id=2302, vol=9.240220e+01 or (segid " " and resid 183 and name HB2) (segid " " and resid 175 and name HD11) or (segid " " and resid 183 and name HB2) (segid " " and resid 175 and name HD13) or (segid " " and resid 175 and name HD12) (segid " " and resid 183 and name HA) or (segid " " and resid 175 and name HD11) (segid " " and resid 183 and name HA) or (segid " " and resid 175 and name HD13) (segid " " and resid 183 and name HA) assign (segid " " and resid 175 and name HD12) (segid " " and resid 172 and name HB2) 2.947 1.086 3.053 weight 1.000 ! spec=c13n...li-4, no=1710, id=2307, vol=4.398700e+01 or (segid " " and resid 175 and name HD11) (segid " " and resid 172 and name HB2) or (segid " " and resid 175 and name HD13) (segid " " and resid 172 and name HB2) or (segid " " and resid 175 and name HD12) (segid " " and resid 178 and name HG2) or (segid " " and resid 175 and name HD11) (segid " " and resid 178 and name HG2) or (segid " " and resid 175 and name HD13) (segid " " and resid 178 and name HG2) assign (segid " " and resid 175 and name HB2) (segid " " and resid 175 and name HD11) 2.378 0.707 0.707 weight 1.000 ! spec=c13n...li-4, no=1711, id=2308, vol=1.595831e+02 or (segid " " and resid 175 and name HD13) (segid " " and resid 175 and name HB2) assign (segid " " and resid 175 and name HD12) (segid " " and resid 175 and name HG) 2.205 0.608 0.608 weight 1.000 ! spec=c13n...li-4, no=1712, id=2309, vol=2.511154e+02 or (segid " " and resid 175 and name HD11) (segid " " and resid 175 and name HG) assign (segid " " and resid 175 and name HD12) (segid " " and resid 117 and name HB2) 2.874 1.033 1.033 weight 1.000 ! spec=c13n...li-4, no=1714, id=2311, vol=5.115910e+01 or (segid " " and resid 175 and name HD11) (segid " " and resid 117 and name HB2) or (segid " " and resid 175 and name HD13) (segid " " and resid 117 and name HB2) or (segid " " and resid 175 and name HD12) (segid " " and resid 172 and name HB1) or (segid " " and resid 175 and name HD11) (segid " " and resid 172 and name HB1) or (segid " " and resid 175 and name HD13) (segid " " and resid 172 and name HB1) assign (segid " " and resid 107 and name HD11) (segid " " and resid 167 and name HH2) 2.862 1.024 1.024 weight 1.000 ! spec=c13n...li-4, no=1726, id=2319, vol=5.242650e+01 or (segid " " and resid 107 and name HD11) (segid " " and resid 186 and name HZ2) assign (segid " " and resid 173 and name HG) (segid " " and resid 173 and name HD11) 1.853 0.429 0.429 weight 1.000 ! spec=c13n...li-4, no=1821, id=2384, vol=7.128260e+02 or (segid " " and resid 173 and name HG) (segid " " and resid 173 and name HD12) assign (segid " " and resid 157 and name HA) (segid " " and resid 160 and name HG) 3.085 1.190 1.190 weight 1.000 ! spec=c13n...li-4, no=1827, id=2388, vol=3.345150e+01 or (segid " " and resid 160 and name HA) (segid " " and resid 160 and name HG) assign (segid " " and resid 161 and name HG2) (segid " " and resid 158 and name HB1) 2.595 0.842 3.405 weight 1.000 ! spec=c13n...li-4, no=1829, id=2389, vol=9.445020e+01 or (segid " " and resid 161 and name HG2) (segid " " and resid 158 and name HB2) assign (segid " " and resid 171 and name HB1) (segid " " and resid 173 and name HG) 2.562 0.821 3.438 weight 1.000 ! spec=c13n...li-4, no=1835, id=2391, vol=1.019386e+02 or (segid " " and resid 173 and name HG) (segid " " and resid 172 and name HG2) or (segid " " and resid 173 and name HG) (segid " " and resid 177 and name HG2) assign (segid " " and resid 161 and name HD2) (segid " " and resid 161 and name HG2) 2.181 0.595 0.595 weight 1.000 ! spec=c13n...li-4, no=1853, id=2400, vol=2.675739e+02 or (segid " " and resid 161 and name HD2) (segid " " and resid 161 and name HG1) assign (segid " " and resid 179 and name HB1) (segid " " and resid 179 and name HG2) 2.215 0.613 0.613 weight 1.000 ! spec=c13n...li-4, no=1875, id=2420, vol=2.439972e+02 or (segid " " and resid 105 and name HB2) (segid " " and resid 105 and name HG) assign (segid " " and resid 131 and name HG) (segid " " and resid 127 and name HD11) 2.362 0.697 3.638 weight 1.000 ! spec=c13n...li-4, no=1880, id=2424, vol=1.660104e+02 or (segid " " and resid 131 and name HG) (segid " " and resid 127 and name HD21) assign (segid " " and resid 131 and name HG) (segid " " and resid 131 and name HD11) 2.223 0.617 0.617 weight 1.000 ! spec=c13n...li-4, no=1881, id=2425, vol=2.392449e+02 or (segid " " and resid 131 and name HG) (segid " " and resid 131 and name HD21) or (segid " " and resid 123 and name HG11) (segid " " and resid 123 and name HD11) assign (segid " " and resid 185 and name HG) (segid " " and resid 185 and name HD21) 1.924 0.463 0.463 weight 1.000 ! spec=c13n...li-4, no=1891, id=2435, vol=5.683690e+02 or (segid " " and resid 185 and name HG) (segid " " and resid 185 and name HD11) or (segid " " and resid 155 and name HG) (segid " " and resid 155 and name HD11) assign (segid " " and resid 146 and name HE2) (segid " " and resid 146 and name HG2) 2.728 0.930 0.930 weight 1.000 ! spec=c13n...li-4, no=1896, id=2440, vol=6.990700e+01 or (segid " " and resid 169 and name HE2) (segid " " and resid 169 and name HG2) or (segid " " and resid 115 and name HE2) (segid " " and resid 115 and name HG2) assign (segid " " and resid 115 and name HE2) (segid " " and resid 115 and name HG2) 2.244 0.629 0.629 weight 1.000 ! spec=c13n...li-4, no=1897, id=2441, vol=2.260702e+02 or (segid " " and resid 169 and name HE2) (segid " " and resid 169 and name HG2) assign (segid " " and resid 132 and name HG12) (segid " " and resid 132 and name HD11) 2.271 0.644 0.644 weight 1.000 ! spec=c13n...li-4, no=1907, id=2448, vol=2.104215e+02 or (segid " " and resid 107 and name HG) (segid " " and resid 160 and name HD11) assign (segid " " and resid 119 and name HG12) (segid " " and resid 119 and name HD11) 2.278 0.649 0.649 weight 1.000 ! spec=c13n...li-4, no=1910, id=2451, vol=2.060756e+02 or (segid " " and resid 119 and name HG12) (segid " " and resid 119 and name HD12) assign (segid " " and resid 107 and name HD11) (segid " " and resid 107 and name HG) 2.500 0.781 0.781 weight 1.000 ! spec=c13n...li-4, no=1913, id=2454, vol=1.180961e+02 or (segid " " and resid 123 and name HG12) (segid " " and resid 123 and name HD11) assign (segid " " and resid 132 and name HB) (segid " " and resid 132 and name HG12) 2.180 0.594 0.594 weight 1.000 ! spec=c13n...li-4, no=1917, id=2458, vol=2.687552e+02 or (segid " " and resid 132 and name HG12) (segid " " and resid 134 and name HB2) assign (segid " " and resid 97 and name HG12) (segid " " and resid 97 and name HD12) 1.933 0.467 0.467 weight 1.000 ! spec=c13n...li-4, no=1922, id=2462, vol=5.528646e+02 or (segid " " and resid 97 and name HG12) (segid " " and resid 97 and name HD11) or (segid " " and resid 97 and name HG12) (segid " " and resid 97 and name HD13) or (segid " " and resid 132 and name HG12) (segid " " and resid 132 and name HD12) or (segid " " and resid 132 and name HG12) (segid " " and resid 132 and name HD11) or (segid " " and resid 132 and name HG12) (segid " " and resid 132 and name HD13) assign (segid " " and resid 132 and name HG12) (segid " " and resid 131 and name HD12) 2.757 0.950 0.950 weight 1.000 ! spec=c13n...li-4, no=1925, id=2465, vol=6.562380e+01 or (segid " " and resid 132 and name HG12) (segid " " and resid 131 and name HD11) or (segid " " and resid 132 and name HG12) (segid " " and resid 131 and name HD13) or (segid " " and resid 132 and name HG12) (segid " " and resid 131 and name HD22) or (segid " " and resid 132 and name HG12) (segid " " and resid 131 and name HD21) or (segid " " and resid 132 and name HG12) (segid " " and resid 131 and name HD23) assign (segid " " and resid 110 and name HD12) (segid " " and resid 110 and name HG) 2.652 0.879 0.879 weight 1.000 ! spec=c13n...li-4, no=1931, id=2470, vol=8.289120e+01 or (segid " " and resid 110 and name HG) (segid " " and resid 110 and name HD11) or (segid " " and resid 110 and name HD13) (segid " " and resid 110 and name HG) or (segid " " and resid 119 and name HB) (segid " " and resid 119 and name HG11) assign (segid " " and resid 171 and name HG) (segid " " and resid 171 and name HD23) 2.181 0.594 0.594 weight 1.000 ! spec=c13n...li-4, no=1937, id=2475, vol=2.682642e+02 or (segid " " and resid 171 and name HG) (segid " " and resid 171 and name HD21) assign (segid " " and resid 187 and name HG12) (segid " " and resid 187 and name HD13) 2.054 0.527 0.527 weight 1.000 ! spec=c13n...li-4, no=1939, id=2477, vol=3.836828e+02 or (segid " " and resid 187 and name HG12) (segid " " and resid 187 and name HD12) assign (segid " " and resid 171 and name HG) (segid " " and resid 171 and name HD12) 2.481 0.770 0.770 weight 1.000 ! spec=c13n...li-4, no=1955, id=2489, vol=1.235166e+02 or (segid " " and resid 171 and name HG) (segid " " and resid 171 and name HD11) assign (segid " " and resid 187 and name HG11) (segid " " and resid 187 and name HD12) 2.127 0.566 0.566 weight 1.000 ! spec=c13n...li-4, no=1962, id=2493, vol=3.112778e+02 or (segid " " and resid 187 and name HG11) (segid " " and resid 187 and name HD13) assign (segid " " and resid 185 and name HD11) (segid " " and resid 182 and name HD1) 2.537 0.804 3.463 weight 1.000 ! spec=c13n...li-4, no=1975, id=2496, vol=1.082339e+02 or (segid " " and resid 185 and name HD12) (segid " " and resid 182 and name HD1) assign (segid " " and resid 117 and name HD2) (segid " " and resid 185 and name HD11) 2.890 1.044 1.044 weight 1.000 ! spec=c13n...li-4, no=1978, id=2499, vol=4.951350e+01 or (segid " " and resid 117 and name HD1) (segid " " and resid 185 and name HD11) assign (segid " " and resid 185 and name HB2) (segid " " and resid 185 and name HD11) 2.035 0.518 0.518 weight 1.000 ! spec=c13n...li-4, no=1984, id=2503, vol=4.056500e+02 or (segid " " and resid 185 and name HG) (segid " " and resid 185 and name HD11) or (segid " " and resid 185 and name HD12) (segid " " and resid 185 and name HG) assign (segid " " and resid 185 and name HB1) (segid " " and resid 185 and name HD11) 2.194 0.602 0.602 weight 1.000 ! spec=c13n...li-4, no=1986, id=2505, vol=2.584458e+02 or (segid " " and resid 185 and name HD12) (segid " " and resid 185 and name HB1) assign (segid " " and resid 155 and name HD11) (segid " " and resid 139 and name HG12) 2.108 0.556 3.892 weight 1.000 ! spec=c13n...li-4, no=1988, id=2506, vol=3.281423e+02 or (segid " " and resid 185 and name HD11) (segid " " and resid 110 and name HD21) assign (segid " " and resid 160 and name HG) (segid " " and resid 160 and name HD23) 2.017 0.509 0.509 weight 1.000 ! spec=c13n...li-4, no=1999, id=2513, vol=4.281501e+02 or (segid " " and resid 160 and name HG) (segid " " and resid 160 and name HD22) or (segid " " and resid 160 and name HG) (segid " " and resid 160 and name HD21) assign (segid " " and resid 155 and name HB2) (segid " " and resid 155 and name HD11) 2.237 0.626 0.626 weight 1.000 ! spec=c13n...li-4, no=2001, id=2515, vol=2.298390e+02 or (segid " " and resid 127 and name HD11) (segid " " and resid 170 and name HG21) assign (segid " " and resid 127 and name HD11) (segid " " and resid 131 and name HD11) 2.019 0.509 0.509 weight 1.000 ! spec=c13n...li-4, no=2006, id=2518, vol=4.260503e+02 or (segid " " and resid 155 and name HD11) (segid " " and resid 123 and name HD11) assign (segid " " and resid 131 and name HA) (segid " " and resid 131 and name HD11) 2.880 1.037 1.037 weight 1.000 ! spec=c13n...li-4, no=2013, id=2525, vol=5.053840e+01 or (segid " " and resid 131 and name HD12) (segid " " and resid 131 and name HA) assign (segid " " and resid 131 and name HD12) (segid " " and resid 131 and name HG) 2.037 0.519 0.519 weight 1.000 ! spec=c13n...li-4, no=2018, id=2530, vol=4.039599e+02 or (segid " " and resid 131 and name HD13) (segid " " and resid 131 and name HG) assign (segid " " and resid 106 and name HD11) (segid " " and resid 187 and name HB) 2.234 0.624 0.624 weight 1.000 ! spec=c13n...li-4, no=2020, id=2532, vol=2.318512e+02 or (segid " " and resid 106 and name HB1) (segid " " and resid 106 and name HD11) assign (segid " " and resid 106 and name HD11) (segid " " and resid 106 and name HD21) 1.819 0.414 4.181 weight 1.000 ! spec=c13n...li-4, no=2022, id=2534, vol=7.963546e+02 or (segid " " and resid 106 and name HD11) (segid " " and resid 187 and name HG11) assign (segid " " and resid 159 and name HD13) (segid " " and resid 114 and name HZ) 2.979 1.109 1.109 weight 1.000 ! spec=c13n...li-4, no=2032, id=2537, vol=4.124220e+01 or (segid " " and resid 159 and name HD12) (segid " " and resid 114 and name HZ) assign (segid " " and resid 159 and name HD22) (segid " " and resid 156 and name HA) 2.843 1.010 1.010 weight 1.000 ! spec=c13n...li-4, no=2033, id=2538, vol=5.460620e+01 or (segid " " and resid 159 and name HD21) (segid " " and resid 156 and name HA) or (segid " " and resid 159 and name HD23) (segid " " and resid 156 and name HA) or (segid " " and resid 159 and name HD12) (segid " " and resid 156 and name HA) or (segid " " and resid 159 and name HD11) (segid " " and resid 156 and name HA) or (segid " " and resid 159 and name HD13) (segid " " and resid 156 and name HA) or (segid " " and resid 159 and name HD22) (segid " " and resid 158 and name HB2) or (segid " " and resid 159 and name HD21) (segid " " and resid 158 and name HB2) or (segid " " and resid 159 and name HD23) (segid " " and resid 158 and name HB2) or (segid " " and resid 159 and name HD12) (segid " " and resid 158 and name HB2) or (segid " " and resid 159 and name HD11) (segid " " and resid 158 and name HB2) or (segid " " and resid 159 and name HD13) (segid " " and resid 158 and name HB2) assign (segid " " and resid 159 and name HG) (segid " " and resid 159 and name HD21) 2.348 0.689 0.689 weight 1.000 ! spec=c13n...li-4, no=2035, id=2540, vol=1.722417e+02 or (segid " " and resid 159 and name HG) (segid " " and resid 159 and name HD11) assign (segid " " and resid 159 and name HD21) (segid " " and resid 159 and name HB2) 2.481 0.769 0.769 weight 1.000 ! spec=c13n...li-4, no=2036, id=2541, vol=1.236883e+02 or (segid " " and resid 159 and name HB2) (segid " " and resid 159 and name HD11) assign (segid " " and resid 159 and name HB1) (segid " " and resid 159 and name HD11) 2.549 0.812 0.812 weight 1.000 ! spec=c13n...li-4, no=2042, id=2546, vol=1.050177e+02 or (segid " " and resid 159 and name HD13) (segid " " and resid 159 and name HB1) assign (segid " " and resid 118 and name HG12) (segid " " and resid 118 and name HG23) 2.619 0.857 0.857 weight 1.000 ! spec=c13n...li-4, no=2046, id=2549, vol=8.933940e+01 or (segid " " and resid 118 and name HG12) (segid " " and resid 118 and name HG21) assign (segid " " and resid 118 and name HG12) (segid " " and resid 118 and name HD12) 2.683 0.900 0.900 weight 1.000 ! spec=c13n...li-4, no=2047, id=2550, vol=7.729470e+01 or (segid " " and resid 118 and name HG12) (segid " " and resid 118 and name HD11) assign (segid " " and resid 118 and name HG11) (segid " " and resid 118 and name HG23) 2.692 0.906 0.906 weight 1.000 ! spec=c13n...li-4, no=2052, id=2555, vol=7.578180e+01 or (segid " " and resid 118 and name HG11) (segid " " and resid 118 and name HG21) assign (segid " " and resid 118 and name HG11) (segid " " and resid 118 and name HD13) 2.629 0.864 0.864 weight 1.000 ! spec=c13n...li-4, no=2053, id=2556, vol=8.736270e+01 or (segid " " and resid 118 and name HG11) (segid " " and resid 118 and name HD12) assign (segid " " and resid 130 and name HB2) (segid " " and resid 164 and name HG1) 2.426 0.736 0.736 weight 1.000 ! spec=c13n...li-4, no=2072, id=2565, vol=1.414591e+02 or (segid " " and resid 181 and name HE2) (segid " " and resid 181 and name HG2) assign (segid " " and resid 172 and name HG1) (segid " " and resid 188 and name HG22) 3.005 1.129 1.129 weight 1.000 ! spec=c13n...li-4, no=2084, id=2572, vol=3.918200e+01 or (segid " " and resid 172 and name HG1) (segid " " and resid 188 and name HG21) or (segid " " and resid 172 and name HG1) (segid " " and resid 188 and name HG23) or (segid " " and resid 172 and name HG1) (segid " " and resid 188 and name HG12) or (segid " " and resid 172 and name HG1) (segid " " and resid 188 and name HG11) or (segid " " and resid 172 and name HG1) (segid " " and resid 188 and name HG13) assign (segid " " and resid 99 and name HG1) (segid " " and resid 99 and name HA) 2.530 0.800 0.800 weight 1.000 ! spec=c13n...li-4, no=2088, id=2575, vol=1.099798e+02 or (segid " " and resid 99 and name HA) (segid " " and resid 99 and name HG2) assign (segid " " and resid 95 and name HA) (segid " " and resid 95 and name HG2) 2.420 0.732 0.732 weight 1.000 ! spec=c13n...li-4, no=2089, id=2576, vol=1.435956e+02 or (segid " " and resid 96 and name HA) (segid " " and resid 96 and name HG2) or (segid " " and resid 115 and name HG2) (segid " " and resid 116 and name HA) assign (segid " " and resid 95 and name HG2) (segid " " and resid 95 and name HD2) 1.980 0.490 0.490 weight 1.000 ! spec=c13n...li-4, no=2097, id=2583, vol=4.787919e+02 or (segid " " and resid 96 and name HB2) (segid " " and resid 96 and name HG2) or (segid " " and resid 96 and name HG2) (segid " " and resid 96 and name HD2) or (segid " " and resid 115 and name HB1) (segid " " and resid 115 and name HG2) or (segid " " and resid 146 and name HB1) (segid " " and resid 146 and name HG2) assign (segid " " and resid 96 and name HB2) (segid " " and resid 96 and name HG1) 1.949 0.475 0.475 weight 1.000 ! spec=c13n...li-4, no=2111, id=2591, vol=5.265873e+02 or (segid " " and resid 96 and name HG1) (segid " " and resid 96 and name HD2) or (segid " " and resid 115 and name HB1) (segid " " and resid 115 and name HG2) assign (segid " " and resid 115 and name HG2) (segid " " and resid 115 and name HB2) 2.226 0.619 0.619 weight 1.000 ! spec=c13n...li-4, no=2112, id=2592, vol=2.372068e+02 or (segid " " and resid 177 and name HB2) (segid " " and resid 177 and name HG2) assign (segid " " and resid 115 and name HG2) (segid " " and resid 115 and name HD2) 1.894 0.449 0.449 weight 1.000 ! spec=c13n...li-4, no=2113, id=2593, vol=6.239845e+02 or (segid " " and resid 169 and name HG2) (segid " " and resid 169 and name HD2) assign (segid " " and resid 99 and name HG1) (segid " " and resid 99 and name HG2) 1.691 0.358 0.358 weight 1.000 ! spec=c13n...li-4, no=2115, id=2594, vol=1.231051e+03 or (segid " " and resid 146 and name HG2) (segid " " and resid 146 and name HD1) assign (segid " " and resid 146 and name HG1) (segid " " and resid 150 and name HA) 2.955 1.091 1.091 weight 1.000 ! spec=c13n...li-4, no=2121, id=2599, vol=4.331150e+01 or (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HG2) assign (segid " " and resid 154 and name HB1) (segid " " and resid 154 and name HG2) 2.519 0.793 0.793 weight 1.000 ! spec=c13n...li-4, no=2133, id=2609, vol=1.129855e+02 or (segid " " and resid 146 and name HB2) (segid " " and resid 146 and name HG1) assign (segid " " and resid 146 and name HB1) (segid " " and resid 146 and name HG1) 2.726 0.929 0.929 weight 1.000 ! spec=c13n...li-4, no=2136, id=2611, vol=7.024250e+01 or (segid " " and resid 154 and name HG2) (segid " " and resid 154 and name HD2) assign (segid " " and resid 170 and name HG21) (segid " " and resid 127 and name HB1) 2.653 0.880 0.880 weight 1.000 ! spec=c13n...li-4, no=2138, id=2613, vol=8.276990e+01 or (segid " " and resid 170 and name HG21) (segid " " and resid 127 and name HB2) assign (segid " " and resid 146 and name HD2) (segid " " and resid 146 and name HG1) 2.751 0.946 0.946 weight 1.000 ! spec=c13n...li-4, no=2139, id=2614, vol=6.653240e+01 or (segid " " and resid 154 and name HG2) (segid " " and resid 154 and name HD1) assign (segid " " and resid 106 and name HD22) (segid " " and resid 106 and name HA) 2.006 0.503 3.994 weight 1.000 ! spec=c13n...li-4, no=2176, id=2637, vol=4.421996e+02 or (segid " " and resid 106 and name HD23) (segid " " and resid 106 and name HA) assign (segid " " and resid 105 and name HD12) (segid " " and resid 106 and name HA) 2.257 0.637 0.637 weight 1.000 ! spec=c13n...li-4, no=2195, id=2651, vol=2.182647e+02 or (segid " " and resid 106 and name HA) (segid " " and resid 105 and name HD11) or (segid " " and resid 105 and name HD13) (segid " " and resid 106 and name HA) or (segid " " and resid 160 and name HD12) (segid " " and resid 104 and name HA) or (segid " " and resid 104 and name HA) (segid " " and resid 160 and name HD11) or (segid " " and resid 160 and name HD13) (segid " " and resid 104 and name HA) assign (segid " " and resid 105 and name HD23) (segid " " and resid 105 and name HA) 1.781 0.397 4.219 weight 1.000 ! spec=c13n...li-4, no=2199, id=2654, vol=9.020972e+02 or (segid " " and resid 105 and name HA) (segid " " and resid 105 and name HD21) or (segid " " and resid 105 and name HD22) (segid " " and resid 105 and name HA) assign (segid " " and resid 100 and name HD11) (segid " " and resid 168 and name HD2) 2.599 0.844 0.844 weight 1.000 ! spec=c13n...li-4, no=2203, id=2658, vol=9.351380e+01 or (segid " " and resid 177 and name HE2) (segid " " and resid 173 and name HD11) assign (segid " " and resid 173 and name HG) (segid " " and resid 173 and name HD12) 1.754 0.385 0.385 weight 1.000 ! spec=c13n...li-4, no=2210, id=2664, vol=9.906603e+02 or (segid " " and resid 173 and name HG) (segid " " and resid 173 and name HD11) or (segid " " and resid 173 and name HG) (segid " " and resid 173 and name HD13) or (segid " " and resid 105 and name HD12) (segid " " and resid 109 and name HG2) or (segid " " and resid 109 and name HG2) (segid " " and resid 105 and name HD11) or (segid " " and resid 105 and name HD13) (segid " " and resid 109 and name HG2) assign (segid " " and resid 100 and name HB2) (segid " " and resid 100 and name HD11) 2.031 0.515 0.515 weight 1.000 ! spec=c13n...li-4, no=2212, id=2666, vol=4.111877e+02 or (segid " " and resid 109 and name HG2) (segid " " and resid 105 and name HD11) assign (segid " " and resid 160 and name HG) (segid " " and resid 160 and name HD11) 1.812 0.410 0.410 weight 1.000 ! spec=c13n...li-4, no=2213, id=2667, vol=8.145760e+02 or (segid " " and resid 173 and name HG) (segid " " and resid 173 and name HD11) or (segid " " and resid 100 and name HD11) (segid " " and resid 100 and name HG) assign (segid " " and resid 105 and name HD11) (segid " " and resid 105 and name HG) 2.098 0.550 0.550 weight 1.000 ! spec=c13n...li-4, no=2216, id=2670, vol=3.378181e+02 or (segid " " and resid 173 and name HB1) (segid " " and resid 173 and name HD11) assign (segid " " and resid 105 and name HD12) (segid " " and resid 105 and name HB1) 2.222 0.617 0.617 weight 1.000 ! spec=c13n...li-4, no=2217, id=2671, vol=2.396350e+02 or (segid " " and resid 105 and name HB1) (segid " " and resid 105 and name HD11) or (segid " " and resid 105 and name HD13) (segid " " and resid 105 and name HB1) or (segid " " and resid 105 and name HD12) (segid " " and resid 105 and name HG) or (segid " " and resid 105 and name HD11) (segid " " and resid 105 and name HG) or (segid " " and resid 105 and name HD13) (segid " " and resid 105 and name HG) assign (segid " " and resid 173 and name HB1) (segid " " and resid 173 and name HD11) 2.346 0.688 0.688 weight 1.000 ! spec=c13n...li-4, no=2219, id=2673, vol=1.730526e+02 or (segid " " and resid 108 and name HG1) (segid " " and resid 160 and name HD11) assign (segid " " and resid 105 and name HD22) (segid " " and resid 105 and name HB1) 2.169 0.588 0.588 weight 1.000 ! spec=c13n...li-4, no=2220, id=2674, vol=2.771497e+02 or (segid " " and resid 105 and name HB1) (segid " " and resid 105 and name HD21) or (segid " " and resid 105 and name HD23) (segid " " and resid 105 and name HB1) or (segid " " and resid 105 and name HD22) (segid " " and resid 105 and name HG) or (segid " " and resid 105 and name HD21) (segid " " and resid 105 and name HG) or (segid " " and resid 105 and name HD23) (segid " " and resid 105 and name HG) assign (segid " " and resid 105 and name HD21) (segid " " and resid 105 and name HG) 2.165 0.586 0.586 weight 1.000 ! spec=c13n...li-4, no=2221, id=2675, vol=2.799927e+02 or (segid " " and resid 105 and name HB1) (segid " " and resid 105 and name HD21) assign (segid " " and resid 105 and name HD12) (segid " " and resid 106 and name HD12) 2.385 0.711 0.711 weight 1.000 ! spec=c13n...li-4, no=2226, id=2677, vol=1.566917e+02 or (segid " " and resid 105 and name HD12) (segid " " and resid 106 and name HD11) or (segid " " and resid 105 and name HD12) (segid " " and resid 106 and name HD13) or (segid " " and resid 105 and name HD11) (segid " " and resid 106 and name HD12) or (segid " " and resid 105 and name HD11) (segid " " and resid 106 and name HD11) or (segid " " and resid 105 and name HD11) (segid " " and resid 106 and name HD13) or (segid " " and resid 105 and name HD13) (segid " " and resid 106 and name HD12) or (segid " " and resid 105 and name HD13) (segid " " and resid 106 and name HD11) or (segid " " and resid 105 and name HD13) (segid " " and resid 106 and name HD13) or (segid " " and resid 160 and name HD12) (segid " " and resid 156 and name HG12) or (segid " " and resid 160 and name HD12) (segid " " and resid 156 and name HG11) or (segid " " and resid 160 and name HD12) (segid " " and resid 156 and name HG13) or (segid " " and resid 160 and name HD11) (segid " " and resid 156 and name HG12) or (segid " " and resid 160 and name HD11) (segid " " and resid 156 and name HG11) or (segid " " and resid 160 and name HD11) (segid " " and resid 156 and name HG13) or (segid " " and resid 160 and name HD13) (segid " " and resid 156 and name HG12) or (segid " " and resid 160 and name HD13) (segid " " and resid 156 and name HG11) or (segid " " and resid 160 and name HD13) (segid " " and resid 156 and name HG13) assign (segid " " and resid 140 and name HD12) (segid " " and resid 140 and name HA) 2.191 0.600 3.809 weight 1.000 ! spec=c13n...li-4, no=2235, id=2685, vol=2.608411e+02 or (segid " " and resid 140 and name HD13) (segid " " and resid 140 and name HA) or (segid " " and resid 140 and name HA) (segid " " and resid 140 and name HD11) assign (segid " " and resid 100 and name HD21) (segid " " and resid 99 and name HB2) 2.204 0.607 3.796 weight 1.000 ! spec=c13n...li-4, no=2243, id=2693, vol=2.516140e+02 or (segid " " and resid 100 and name HB2) (segid " " and resid 100 and name HD21) assign (segid " " and resid 100 and name HB1) (segid " " and resid 100 and name HD21) 1.898 0.451 4.102 weight 1.000 ! spec=c13n...li-4, no=2244, id=2694, vol=6.159412e+02 or (segid " " and resid 100 and name HD21) (segid " " and resid 100 and name HG) assign (segid " " and resid 171 and name HD21) (segid " " and resid 114 and name HE1) 2.567 0.824 3.433 weight 1.000 ! spec=c13n...li-4, no=2254, id=2698, vol=1.007101e+02 or (segid " " and resid 171 and name HD23) (segid " " and resid 114 and name HE1) assign (segid " " and resid 171 and name HD21) (segid " " and resid 114 and name HZ) 2.789 0.972 0.972 weight 1.000 ! spec=c13n...li-4, no=2255, id=2699, vol=6.126330e+01 or (segid " " and resid 171 and name HD23) (segid " " and resid 114 and name HZ) assign (segid " " and resid 171 and name HD22) (segid " " and resid 175 and name HA) 2.697 0.909 3.303 weight 1.000 ! spec=c13n...li-4, no=2256, id=2700, vol=7.488330e+01 or (segid " " and resid 171 and name HD21) (segid " " and resid 175 and name HA) or (segid " " and resid 171 and name HD23) (segid " " and resid 175 and name HA) or (segid " " and resid 171 and name HD22) (segid " " and resid 183 and name HB2) or (segid " " and resid 171 and name HD21) (segid " " and resid 183 and name HB2) or (segid " " and resid 171 and name HD23) (segid " " and resid 183 and name HB2) or (segid " " and resid 171 and name HD22) (segid " " and resid 183 and name HA) or (segid " " and resid 171 and name HD21) (segid " " and resid 183 and name HA) or (segid " " and resid 171 and name HD23) (segid " " and resid 183 and name HA) assign (segid " " and resid 127 and name HD21) (segid " " and resid 158 and name HB1) 2.892 1.046 1.046 weight 1.000 ! spec=c13n...li-4, no=2259, id=2703, vol=4.925670e+01 or (segid " " and resid 127 and name HD21) (segid " " and resid 136 and name HB1) assign (segid " " and resid 171 and name HB2) (segid " " and resid 171 and name HD21) 2.413 0.728 0.728 weight 1.000 ! spec=c13n...li-4, no=2261, id=2705, vol=1.460634e+02 or (segid " " and resid 171 and name HD22) (segid " " and resid 171 and name HB2) assign (segid " " and resid 131 and name HD21) (segid " " and resid 131 and name HA) 1.952 0.476 4.048 weight 1.000 ! spec=c13n...li-4, no=2268, id=2711, vol=5.219102e+02 or (segid " " and resid 131 and name HD22) (segid " " and resid 131 and name HA) or (segid " " and resid 131 and name HD23) (segid " " and resid 131 and name HA) assign (segid " " and resid 131 and name HG) (segid " " and resid 131 and name HD21) 1.963 0.482 0.482 weight 1.000 ! spec=c13n...li-4, no=2276, id=2719, vol=5.032855e+02 or (segid " " and resid 131 and name HD23) (segid " " and resid 131 and name HB2) or (segid " " and resid 131 and name HD23) (segid " " and resid 131 and name HG) or (segid " " and resid 131 and name HD22) (segid " " and resid 131 and name HG) assign (segid " " and resid 156 and name HG23) (segid " " and resid 114 and name HE1) 2.537 0.804 3.463 weight 1.000 ! spec=c13n...li-4, no=2280, id=2722, vol=1.081725e+02 or (segid " " and resid 156 and name HG22) (segid " " and resid 114 and name HE1) assign (segid " " and resid 156 and name HG23) (segid " " and resid 114 and name HD1) 2.475 0.766 0.766 weight 1.000 ! spec=c13n...li-4, no=2281, id=2723, vol=1.255208e+02 or (segid " " and resid 156 and name HG22) (segid " " and resid 114 and name HD1) assign (segid " " and resid 156 and name HG22) (segid " " and resid 153 and name HB2) 2.894 1.047 1.047 weight 1.000 ! spec=c13n...li-4, no=2285, id=2727, vol=4.909430e+01 or (segid " " and resid 156 and name HG21) (segid " " and resid 153 and name HB2) or (segid " " and resid 156 and name HG23) (segid " " and resid 153 and name HB2) or (segid " " and resid 156 and name HG22) (segid " " and resid 153 and name HG1) or (segid " " and resid 156 and name HG21) (segid " " and resid 153 and name HG1) or (segid " " and resid 156 and name HG23) (segid " " and resid 153 and name HG1) or (segid " " and resid 156 and name HG22) (segid " " and resid 157 and name HG1) or (segid " " and resid 156 and name HG21) (segid " " and resid 157 and name HG1) or (segid " " and resid 156 and name HG23) (segid " " and resid 157 and name HG1) assign (segid " " and resid 156 and name HB) (segid " " and resid 156 and name HG23) 2.111 0.557 0.557 weight 1.000 ! spec=c13n...li-4, no=2287, id=2729, vol=3.258677e+02 or (segid " " and resid 156 and name HB) (segid " " and resid 156 and name HG22) assign (segid " " and resid 171 and name HD13) (segid " " and resid 186 and name HZ3) 2.831 1.002 3.169 weight 1.000 ! spec=c13n...li-4, no=2294, id=2734, vol=5.605630e+01 or (segid " " and resid 171 and name HD11) (segid " " and resid 186 and name HZ3) or (segid " " and resid 171 and name HD12) (segid " " and resid 186 and name HZ3) assign (segid " " and resid 171 and name HD11) (segid " " and resid 186 and name HD1) 2.432 0.740 3.568 weight 1.000 ! spec=c13n...li-4, no=2297, id=2737, vol=1.392285e+02 or (segid " " and resid 171 and name HD13) (segid " " and resid 186 and name HD1) assign (segid " " and resid 171 and name HD13) (segid " " and resid 114 and name HE1) 2.434 0.740 3.566 weight 1.000 ! spec=c13n...li-4, no=2298, id=2738, vol=1.387608e+02 or (segid " " and resid 171 and name HD12) (segid " " and resid 114 and name HE1) assign (segid " " and resid 171 and name HD13) (segid " " and resid 114 and name HD1) 3.031 1.149 2.969 weight 1.000 ! spec=c13n...li-4, no=2299, id=2739, vol=3.716960e+01 or (segid " " and resid 171 and name HD12) (segid " " and resid 114 and name HD1) assign (segid " " and resid 171 and name HA) (segid " " and resid 171 and name HD11) 2.502 0.783 3.498 weight 1.000 ! spec=c13n...li-4, no=2300, id=2740, vol=1.174728e+02 or (segid " " and resid 171 and name HA) (segid " " and resid 171 and name HD12) or (segid " " and resid 171 and name HA) (segid " " and resid 171 and name HD13) assign (segid " " and resid 171 and name HB2) (segid " " and resid 171 and name HD11) 2.341 0.685 0.685 weight 1.000 ! spec=c13n...li-4, no=2301, id=2741, vol=1.750178e+02 or (segid " " and resid 171 and name HD13) (segid " " and resid 171 and name HB2) assign (segid " " and resid 116 and name HG21) (segid " " and resid 113 and name HB1) 2.373 0.704 0.704 weight 1.000 ! spec=c13n...li-4, no=2315, id=2753, vol=1.616300e+02 or (segid " " and resid 116 and name HG22) (segid " " and resid 113 and name HB1) or (segid " " and resid 116 and name HG23) (segid " " and resid 113 and name HB1) or (segid " " and resid 116 and name HG21) (segid " " and resid 117 and name HB2) or (segid " " and resid 116 and name HG22) (segid " " and resid 117 and name HB2) or (segid " " and resid 116 and name HG23) (segid " " and resid 117 and name HB2) or (segid " " and resid 116 and name HG21) (segid " " and resid 149 and name HE2) or (segid " " and resid 116 and name HG21) (segid " " and resid 149 and name HE1) or (segid " " and resid 116 and name HG21) (segid " " and resid 149 and name HE3) or (segid " " and resid 116 and name HG22) (segid " " and resid 149 and name HE2) or (segid " " and resid 116 and name HG22) (segid " " and resid 149 and name HE1) or (segid " " and resid 116 and name HG22) (segid " " and resid 149 and name HE3) or (segid " " and resid 116 and name HG23) (segid " " and resid 149 and name HE2) or (segid " " and resid 116 and name HG23) (segid " " and resid 149 and name HE1) or (segid " " and resid 116 and name HG23) (segid " " and resid 149 and name HE3) assign (segid " " and resid 116 and name HG21) (segid " " and resid 115 and name HD2) 2.173 0.590 0.590 weight 1.000 ! spec=c13n...li-4, no=2319, id=2757, vol=2.735492e+02 or (segid " " and resid 116 and name HG22) (segid " " and resid 115 and name HD2) or (segid " " and resid 116 and name HG23) (segid " " and resid 115 and name HD2) or (segid " " and resid 116 and name HG21) (segid " " and resid 117 and name HG1) or (segid " " and resid 116 and name HG22) (segid " " and resid 117 and name HG1) or (segid " " and resid 116 and name HG23) (segid " " and resid 117 and name HG1) assign (segid " " and resid 116 and name HG21) (segid " " and resid 112 and name HG1) 2.888 1.042 3.112 weight 1.000 ! spec=c13n...li-4, no=2324, id=2762, vol=4.974540e+01 or (segid " " and resid 116 and name HG22) (segid " " and resid 112 and name HG1) or (segid " " and resid 116 and name HG23) (segid " " and resid 112 and name HG1) or (segid " " and resid 145 and name HG21) (segid " " and resid 141 and name HB2) or (segid " " and resid 145 and name HG22) (segid " " and resid 141 and name HB2) or (segid " " and resid 145 and name HG23) (segid " " and resid 141 and name HB2) assign (segid " " and resid 116 and name HG21) (segid " " and resid 112 and name HB2) 2.799 0.980 0.980 weight 1.000 ! spec=c13n...li-4, no=2325, id=2763, vol=5.990830e+01 or (segid " " and resid 116 and name HG22) (segid " " and resid 112 and name HB2) or (segid " " and resid 116 and name HG23) (segid " " and resid 112 and name HB2) or (segid " " and resid 141 and name HG2) (segid " " and resid 145 and name HG21) or (segid " " and resid 141 and name HG2) (segid " " and resid 145 and name HG22) or (segid " " and resid 141 and name HG2) (segid " " and resid 145 and name HG23) assign (segid " " and resid 110 and name HD21) (segid " " and resid 186 and name HZ3) 2.741 0.939 3.259 weight 1.000 ! spec=c13n...li-4, no=2332, id=2768, vol=6.795580e+01 or (segid " " and resid 106 and name HD21) (segid " " and resid 186 and name HZ3) assign (segid " " and resid 110 and name HG) (segid " " and resid 110 and name HD21) 2.018 0.509 0.509 weight 1.000 ! spec=c13n...li-4, no=2336, id=2772, vol=4.270825e+02 or (segid " " and resid 106 and name HB2) (segid " " and resid 106 and name HD21) assign (segid " " and resid 175 and name HD22) (segid " " and resid 182 and name HD1) 2.560 0.819 3.440 weight 1.000 ! spec=c13n...li-4, no=2349, id=2778, vol=1.025319e+02 or (segid " " and resid 175 and name HD23) (segid " " and resid 182 and name HD1) assign (segid " " and resid 171 and name HD22) (segid " " and resid 172 and name HA) 2.581 0.833 0.833 weight 1.000 ! spec=c13n...li-4, no=2353, id=2781, vol=9.745300e+01 or (segid " " and resid 171 and name HD21) (segid " " and resid 172 and name HA) or (segid " " and resid 171 and name HD23) (segid " " and resid 172 and name HA) or (segid " " and resid 175 and name HD22) (segid " " and resid 172 and name HA) or (segid " " and resid 175 and name HD21) (segid " " and resid 172 and name HA) or (segid " " and resid 175 and name HD23) (segid " " and resid 172 and name HA) assign (segid " " and resid 175 and name HD22) (segid " " and resid 172 and name HB2) 2.533 0.802 3.467 weight 1.000 ! spec=c13n...li-4, no=2359, id=2787, vol=1.090410e+02 or (segid " " and resid 175 and name HD21) (segid " " and resid 172 and name HB2) or (segid " " and resid 175 and name HD23) (segid " " and resid 172 and name HB2) or (segid " " and resid 175 and name HD22) (segid " " and resid 176 and name HG2) or (segid " " and resid 175 and name HD21) (segid " " and resid 176 and name HG2) or (segid " " and resid 175 and name HD23) (segid " " and resid 176 and name HG2) assign (segid " " and resid 175 and name HD13) (segid " " and resid 175 and name HD22) 2.061 0.531 0.531 weight 1.000 ! spec=c13n...li-4, no=2370, id=2795, vol=3.759185e+02 or (segid " " and resid 175 and name HD13) (segid " " and resid 175 and name HD23) assign (segid " " and resid 188 and name HG12) (segid " " and resid 186 and name HE3) 2.747 0.943 3.253 weight 1.000 ! spec=c13n...li-4, no=2376, id=2800, vol=6.706400e+01 or (segid " " and resid 188 and name HG11) (segid " " and resid 186 and name HE3) assign (segid " " and resid 188 and name HG12) (segid " " and resid 171 and name HD22) 2.102 0.552 3.898 weight 1.000 ! spec=c13n...li-4, no=2382, id=2803, vol=3.346522e+02 or (segid " " and resid 188 and name HG12) (segid " " and resid 171 and name HD21) or (segid " " and resid 188 and name HG12) (segid " " and resid 171 and name HD23) or (segid " " and resid 188 and name HG11) (segid " " and resid 171 and name HD22) or (segid " " and resid 188 and name HG11) (segid " " and resid 171 and name HD21) or (segid " " and resid 188 and name HG11) (segid " " and resid 171 and name HD23) or (segid " " and resid 188 and name HG13) (segid " " and resid 171 and name HD22) or (segid " " and resid 188 and name HG13) (segid " " and resid 171 and name HD21) or (segid " " and resid 188 and name HG13) (segid " " and resid 171 and name HD23) or (segid " " and resid 188 and name HG12) (segid " " and resid 187 and name HG22) or (segid " " and resid 188 and name HG12) (segid " " and resid 187 and name HG21) or (segid " " and resid 188 and name HG12) (segid " " and resid 187 and name HG23) or (segid " " and resid 188 and name HG11) (segid " " and resid 187 and name HG22) or (segid " " and resid 188 and name HG11) (segid " " and resid 187 and name HG21) or (segid " " and resid 188 and name HG11) (segid " " and resid 187 and name HG23) or (segid " " and resid 188 and name HG13) (segid " " and resid 187 and name HG22) or (segid " " and resid 188 and name HG13) (segid " " and resid 187 and name HG21) or (segid " " and resid 188 and name HG13) (segid " " and resid 187 and name HG23) assign (segid " " and resid 107 and name HD21) (segid " " and resid 186 and name HZ2) 2.773 0.961 0.961 weight 1.000 ! spec=c13n...li-4, no=2384, id=2805, vol=6.342080e+01 or (segid " " and resid 107 and name HD21) (segid " " and resid 167 and name HH2) assign (segid " " and resid 188 and name HG11) (segid " " and resid 172 and name HD2) 2.684 0.900 3.316 weight 1.000 ! spec=c13n...li-4, no=2393, id=2813, vol=7.713670e+01 or (segid " " and resid 188 and name HG11) (segid " " and resid 172 and name HG2) assign (segid " " and resid 174 and name HB1) (segid " " and resid 175 and name HD21) 2.062 0.532 3.938 weight 1.000 ! spec=c13n...li-4, no=2411, id=2825, vol=3.747890e+02 or (segid " " and resid 174 and name HB1) (segid " " and resid 123 and name HG21) or (segid " " and resid 174 and name HB1) (segid " " and resid 171 and name HD21) assign (segid " " and resid 156 and name HA) (segid " " and resid 156 and name HG11) 2.226 0.619 0.619 weight 1.000 ! spec=c13n...li-4, no=2416, id=2830, vol=2.372530e+02 or (segid " " and resid 156 and name HG12) (segid " " and resid 156 and name HA) assign (segid " " and resid 156 and name HB) (segid " " and resid 156 and name HG13) 2.013 0.507 0.507 weight 1.000 ! spec=c13n...li-4, no=2419, id=2833, vol=4.329473e+02 or (segid " " and resid 156 and name HB) (segid " " and resid 156 and name HG12) assign (segid " " and resid 169 and name HA) (segid " " and resid 188 and name HG22) 2.529 0.799 0.799 weight 1.000 ! spec=c13n...li-4, no=2430, id=2842, vol=1.102583e+02 or (segid " " and resid 169 and name HA) (segid " " and resid 188 and name HG21) or (segid " " and resid 169 and name HA) (segid " " and resid 188 and name HG23) or (segid " " and resid 169 and name HA) (segid " " and resid 188 and name HG12) or (segid " " and resid 169 and name HA) (segid " " and resid 188 and name HG11) or (segid " " and resid 169 and name HA) (segid " " and resid 188 and name HG13) assign (segid " " and resid 188 and name HG12) (segid " " and resid 188 and name HA) 2.307 0.665 0.665 weight 1.000 ! spec=c13n...li-4, no=2431, id=2843, vol=1.913626e+02 or (segid " " and resid 188 and name HA) (segid " " and resid 188 and name HG11) or (segid " " and resid 188 and name HG13) (segid " " and resid 188 and name HA) or (segid " " and resid 188 and name HG22) (segid " " and resid 188 and name HA) or (segid " " and resid 188 and name HA) (segid " " and resid 188 and name HG21) or (segid " " and resid 188 and name HG23) (segid " " and resid 188 and name HA) assign (segid " " and resid 149 and name HA) (segid " " and resid 152 and name HB1) 2.139 0.572 3.861 weight 1.000 ! spec=c13n...li-4, no=2465, id=2870, vol=3.011524e+02 or (segid " " and resid 120 and name HD1) (segid " " and resid 152 and name HB1) assign (segid " " and resid 152 and name HB2) (segid " " and resid 149 and name HB1) 2.675 0.895 3.325 weight 1.000 ! spec=c13n...li-4, no=2472, id=2876, vol=7.867690e+01 or (segid " " and resid 152 and name HB1) (segid " " and resid 149 and name HB1) or (segid " " and resid 152 and name HB3) (segid " " and resid 149 and name HB1) or (segid " " and resid 152 and name HB2) (segid " " and resid 154 and name HB1) or (segid " " and resid 152 and name HB1) (segid " " and resid 154 and name HB1) or (segid " " and resid 152 and name HB3) (segid " " and resid 154 and name HB1) assign (segid " " and resid 150 and name HB2) (segid " " and resid 148 and name HA) 2.898 1.050 1.050 weight 1.000 ! spec=c13n...li-4, no=2481, id=2884, vol=4.867670e+01 or (segid " " and resid 150 and name HB1) (segid " " and resid 148 and name HA) or (segid " " and resid 150 and name HB3) (segid " " and resid 148 and name HA) or (segid " " and resid 150 and name HB2) (segid " " and resid 149 and name HA) or (segid " " and resid 150 and name HB1) (segid " " and resid 149 and name HA) or (segid " " and resid 150 and name HB3) (segid " " and resid 149 and name HA) or (segid " " and resid 150 and name HB2) (segid " " and resid 151 and name HA2) or (segid " " and resid 150 and name HB1) (segid " " and resid 151 and name HA2) or (segid " " and resid 150 and name HB3) (segid " " and resid 151 and name HA2) assign (segid " " and resid 146 and name HD2) (segid " " and resid 150 and name HB2) 2.446 0.748 0.748 weight 1.000 ! spec=c13n...li-4, no=2487, id=2890, vol=1.347860e+02 or (segid " " and resid 146 and name HD2) (segid " " and resid 150 and name HB1) or (segid " " and resid 146 and name HD2) (segid " " and resid 150 and name HB3) or (segid " " and resid 150 and name HB2) (segid " " and resid 146 and name HD1) or (segid " " and resid 150 and name HB1) (segid " " and resid 146 and name HD1) or (segid " " and resid 150 and name HB3) (segid " " and resid 146 and name HD1) assign (segid " " and resid 120 and name HD1) (segid " " and resid 119 and name HG21) 2.601 0.845 0.845 weight 1.000 ! spec=c13n...li-4, no=2500, id=2900, vol=9.317340e+01 or (segid " " and resid 98 and name HA) (segid " " and resid 97 and name HG21) assign (segid " " and resid 148 and name HG2) (segid " " and resid 119 and name HG21) 2.706 0.915 0.915 weight 1.000 ! spec=c13n...li-4, no=2505, id=2905, vol=7.345840e+01 or (segid " " and resid 148 and name HG1) (segid " " and resid 119 and name HG21) assign (segid " " and resid 119 and name HB) (segid " " and resid 119 and name HG21) 1.937 0.469 0.469 weight 1.000 ! spec=c13n...li-4, no=2509, id=2909, vol=5.455182e+02 or (segid " " and resid 148 and name HE1) (segid " " and resid 119 and name HG21) assign (segid " " and resid 119 and name HG12) (segid " " and resid 119 and name HG21) 2.355 0.693 0.693 weight 1.000 ! spec=c13n...li-4, no=2511, id=2911, vol=1.692327e+02 or (segid " " and resid 124 and name HG11) (segid " " and resid 124 and name HG21) assign (segid " " and resid 97 and name HG12) (segid " " and resid 97 and name HG21) 2.076 0.539 3.924 weight 1.000 ! spec=c13n...li-4, no=2513, id=2913, vol=3.604649e+02 or (segid " " and resid 119 and name HG21) (segid " " and resid 119 and name HG11) assign (segid " " and resid 150 and name HA) (segid " " and resid 142 and name HG21) 2.642 0.873 0.873 weight 1.000 ! spec=c13n...li-4, no=2518, id=2917, vol=8.478250e+01 or (segid " " and resid 143 and name HA) (segid " " and resid 142 and name HG21) assign (segid " " and resid 150 and name HB1) (segid " " and resid 142 and name HG21) 1.980 0.490 0.490 weight 1.000 ! spec=c13n...li-4, no=2529, id=2927, vol=4.791164e+02 or (segid " " and resid 187 and name HG21) (segid " " and resid 187 and name HG12) assign (segid " " and resid 139 and name HG22) (segid " " and resid 154 and name HA) 2.795 0.977 0.977 weight 1.000 ! spec=c13n...li-4, no=2537, id=2933, vol=6.045220e+01 or (segid " " and resid 139 and name HG21) (segid " " and resid 154 and name HA) or (segid " " and resid 139 and name HG23) (segid " " and resid 154 and name HA) or (segid " " and resid 188 and name HA) (segid " " and resid 187 and name HG22) or (segid " " and resid 188 and name HA) (segid " " and resid 187 and name HG21) or (segid " " and resid 188 and name HA) (segid " " and resid 187 and name HG23) or (segid " " and resid 187 and name HG22) (segid " " and resid 189 and name HA) or (segid " " and resid 189 and name HA) (segid " " and resid 187 and name HG21) or (segid " " and resid 187 and name HG23) (segid " " and resid 189 and name HA) assign (segid " " and resid 120 and name HB2) (segid " " and resid 139 and name HG21) 1.997 0.498 0.498 weight 1.000 ! spec=c13n...li-4, no=2547, id=2941, vol=4.550851e+02 or (segid " " and resid 139 and name HB) (segid " " and resid 139 and name HG21) assign (segid " " and resid 118 and name HG21) (segid " " and resid 123 and name HB) 2.760 0.952 0.952 weight 1.000 ! spec=c13n...li-4, no=2562, id=2955, vol=6.522990e+01 or (segid " " and resid 118 and name HG21) (segid " " and resid 155 and name HB1) assign (segid " " and resid 136 and name HA) (segid " " and resid 124 and name HD11) 2.225 0.619 3.775 weight 1.000 ! spec=c13n...li-4, no=2574, id=2966, vol=2.375817e+02 or (segid " " and resid 124 and name HD11) (segid " " and resid 140 and name HA) assign (segid " " and resid 124 and name HD11) (segid " " and resid 139 and name HB) 2.045 0.523 3.955 weight 1.000 ! spec=c13n...li-4, no=2582, id=2972, vol=3.940686e+02 or (segid " " and resid 120 and name HB2) (segid " " and resid 124 and name HD11) assign (segid " " and resid 97 and name HD12) (segid " " and resid 165 and name HG2) 2.863 1.025 1.025 weight 1.000 ! spec=c13n...li-4, no=2599, id=2986, vol=5.234230e+01 or (segid " " and resid 97 and name HD11) (segid " " and resid 165 and name HG2) or (segid " " and resid 97 and name HD13) (segid " " and resid 165 and name HG2) or (segid " " and resid 132 and name HD12) (segid " " and resid 134 and name HG2) or (segid " " and resid 134 and name HG2) (segid " " and resid 132 and name HD11) or (segid " " and resid 132 and name HD13) (segid " " and resid 134 and name HG2) or (segid " " and resid 132 and name HD12) (segid " " and resid 135 and name HB2) or (segid " " and resid 132 and name HD11) (segid " " and resid 135 and name HB2) or (segid " " and resid 132 and name HD13) (segid " " and resid 135 and name HB2) assign (segid " " and resid 132 and name HD11) (segid " " and resid 135 and name HG1) 2.766 0.956 0.956 weight 1.000 ! spec=c13n...li-4, no=2600, id=2987, vol=6.436370e+01 or (segid " " and resid 132 and name HD11) (segid " " and resid 135 and name HG2) assign (segid " " and resid 120 and name HD1) (segid " " and resid 119 and name HD11) 2.789 0.972 0.972 weight 1.000 ! spec=c13n...li-4, no=2623, id=3005, vol=6.123770e+01 or (segid " " and resid 119 and name HD11) (segid " " and resid 148 and name HA) assign (segid " " and resid 148 and name HG2) (segid " " and resid 119 and name HD11) 2.679 0.897 0.897 weight 1.000 ! spec=c13n...li-4, no=2625, id=3007, vol=7.804770e+01 or (segid " " and resid 148 and name HG1) (segid " " and resid 119 and name HD11) assign (segid " " and resid 116 and name HB) (segid " " and resid 112 and name HB1) 3.297 1.358 1.358 weight 1.000 ! spec=c13n...li-4, no=2657, id=3034, vol=2.246720e+01 or (segid " " and resid 116 and name HB) (segid " " and resid 115 and name HB2) assign (segid " " and resid 145 and name HB) (segid " " and resid 146 and name HD2) 3.179 1.263 1.263 weight 1.000 ! spec=c13n...li-4, no=2660, id=3037, vol=2.793950e+01 or (segid " " and resid 145 and name HB) (segid " " and resid 146 and name HD1) assign (segid " " and resid 168 and name HA) (segid " " and resid 159 and name HB1) 3.226 1.301 1.301 weight 1.000 ! spec=c13n...li-4, no=2665, id=3042, vol=2.557620e+01 or (segid " " and resid 168 and name HA) (segid " " and resid 168 and name HG2) assign (segid " " and resid 120 and name HA) (segid " " and resid 119 and name HG22) 2.977 1.108 1.108 weight 1.000 ! spec=c13n...li-4, no=2669, id=3046, vol=4.144360e+01 or (segid " " and resid 120 and name HA) (segid " " and resid 119 and name HG21) or (segid " " and resid 120 and name HA) (segid " " and resid 119 and name HG23) or (segid " " and resid 120 and name HA) (segid " " and resid 124 and name HG22) or (segid " " and resid 120 and name HA) (segid " " and resid 124 and name HG21) or (segid " " and resid 120 and name HA) (segid " " and resid 124 and name HG23) assign (segid " " and resid 139 and name HA) (segid " " and resid 142 and name HG12) 3.179 1.263 1.263 weight 1.000 ! spec=c13n...li-4, no=2670, id=3047, vol=2.793330e+01 or (segid " " and resid 139 and name HA) (segid " " and resid 154 and name HG2) assign (segid " " and resid 145 and name HA) (segid " " and resid 146 and name HD2) 3.254 1.324 2.746 weight 1.000 ! spec=c13n...li-4, no=2671, id=3048, vol=2.427470e+01 or (segid " " and resid 145 and name HA) (segid " " and resid 146 and name HD1) assign (segid " " and resid 103 and name HA) (segid " " and resid 102 and name HG2) 3.195 1.276 2.805 weight 1.000 ! spec=c13n...li-4, no=2674, id=3051, vol=2.709390e+01 or (segid " " and resid 103 and name HA) (segid " " and resid 104 and name HB1) assign (segid " " and resid 143 and name HA) (segid " " and resid 142 and name HB) 3.478 1.512 1.512 weight 1.000 ! spec=c13n...li-4, no=2678, id=3054, vol=1.628810e+01 or (segid " " and resid 143 and name HA) (segid " " and resid 146 and name HB2) assign (segid " " and resid 162 and name HA) (segid " " and resid 159 and name HA) 3.464 1.500 1.500 weight 1.000 ! spec=c13n...li-4, no=2693, id=3067, vol=1.668720e+01 or (segid " " and resid 113 and name HA) (segid " " and resid 114 and name HA) or (segid " " and resid 134 and name HA) (segid " " and resid 136 and name HB2) assign (segid " " and resid 102 and name HA) (segid " " and resid 105 and name HD22) 2.557 0.817 0.817 weight 1.000 ! spec=c13n...li-4, no=2697, id=3071, vol=1.031189e+02 or (segid " " and resid 102 and name HA) (segid " " and resid 105 and name HD21) or (segid " " and resid 102 and name HA) (segid " " and resid 105 and name HD23) or (segid " " and resid 102 and name HA) (segid " " and resid 105 and name HD12) or (segid " " and resid 102 and name HA) (segid " " and resid 105 and name HD11) or (segid " " and resid 102 and name HA) (segid " " and resid 105 and name HD13) assign (segid " " and resid 146 and name HA) (segid " " and resid 142 and name HG22) 3.431 1.472 1.472 weight 1.000 ! spec=c13n...li-4, no=2711, id=3083, vol=1.766430e+01 or (segid " " and resid 146 and name HA) (segid " " and resid 142 and name HG21) or (segid " " and resid 146 and name HA) (segid " " and resid 142 and name HG23) or (segid " " and resid 146 and name HA) (segid " " and resid 142 and name HD12) or (segid " " and resid 146 and name HA) (segid " " and resid 142 and name HD11) or (segid " " and resid 146 and name HA) (segid " " and resid 142 and name HD13) assign (segid " " and resid 189 and name HA) (segid " " and resid 189 and name HB1) 2.040 0.520 0.520 weight 1.000 ! spec=c13n...li-4, no=2716, id=3088, vol=3.999251e+02 or (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HB1) assign (segid " " and resid 171 and name HB2) (segid " " and resid 171 and name HA) 2.310 0.667 0.667 weight 1.000 ! spec=c13n...li-4, no=2719, id=3091, vol=1.896045e+02 or (segid " " and resid 176 and name HB2) (segid " " and resid 173 and name HA) assign (segid " " and resid 169 and name HA) (segid " " and resid 188 and name HB) 2.525 0.797 0.797 weight 1.000 ! spec=c13n...li-4, no=2721, id=3093, vol=1.111901e+02 or (segid " " and resid 169 and name HA) (segid " " and resid 169 and name HD2) assign (segid " " and resid 186 and name HA) (segid " " and resid 182 and name HE1) 3.076 1.183 1.183 weight 1.000 ! spec=c13n...li-4, no=2728, id=3098, vol=3.405540e+01 or (segid " " and resid 186 and name HA) (segid " " and resid 185 and name HN) or (segid " " and resid 186 and name HA) (segid " " and resid 186 and name HZ3) assign (segid " " and resid 186 and name HA) (segid " " and resid 182 and name HD1) 3.135 1.228 2.865 weight 1.000 ! spec=c13n...li-4, no=2729, id=3099, vol=3.037630e+01 or (segid " " and resid 186 and name HA) (segid " " and resid 186 and name HZ2) assign (segid " " and resid 180 and name HA) (segid " " and resid 175 and name HA) 3.181 1.265 1.265 weight 1.000 ! spec=c13n...li-4, no=2730, id=3100, vol=2.784800e+01 or (segid " " and resid 186 and name HA) (segid " " and resid 183 and name HA) or (segid " " and resid 186 and name HA) (segid " " and resid 187 and name HA) assign (segid " " and resid 180 and name HA) (segid " " and resid 178 and name HB1) 3.180 1.264 1.264 weight 1.000 ! spec=c13n...li-4, no=2731, id=3101, vol=2.789300e+01 or (segid " " and resid 180 and name HA) (segid " " and resid 181 and name HB2) assign (segid " " and resid 166 and name HA) (segid " " and resid 169 and name HG2) 3.207 1.286 1.286 weight 1.000 ! spec=c13n...li-4, no=2741, id=3107, vol=2.648510e+01 or (segid " " and resid 166 and name HA) (segid " " and resid 170 and name HG21) or (segid " " and resid 166 and name HA) (segid " " and resid 170 and name HG22) or (segid " " and resid 166 and name HA) (segid " " and resid 170 and name HG23) assign (segid " " and resid 131 and name HB2) (segid " " and resid 129 and name HB1) 3.320 1.378 1.378 weight 1.000 ! spec=c13n...li-4, no=2761, id=3123, vol=2.152660e+01 or (segid " " and resid 135 and name HB1) (segid " " and resid 131 and name HB2) assign (segid " " and resid 122 and name HB2) (segid " " and resid 119 and name HG12) 3.446 1.485 1.485 weight 1.000 ! spec=c13n...li-4, no=2767, id=3128, vol=1.720580e+01 or (segid " " and resid 126 and name HB1) (segid " " and resid 177 and name HG2) assign (segid " " and resid 154 and name HB1) (segid " " and resid 154 and name HE1) 2.659 0.884 0.884 weight 1.000 ! spec=c13n...li-4, no=2769, id=3130, vol=8.159640e+01 or (segid " " and resid 154 and name HE1) (segid " " and resid 154 and name HD2) assign (segid " " and resid 140 and name HB2) (segid " " and resid 137 and name HA) 2.535 0.803 0.803 weight 1.000 ! spec=c13n...li-4, no=2780, id=3137, vol=1.086637e+02 or (segid " " and resid 140 and name HA) (segid " " and resid 140 and name HB2) assign (segid " " and resid 135 and name HG2) (segid " " and resid 132 and name HB) 3.115 1.213 1.213 weight 1.000 ! spec=c13n...li-4, no=2796, id=3152, vol=3.156530e+01 or (segid " " and resid 135 and name HG1) (segid " " and resid 132 and name HB) assign (segid " " and resid 153 and name HG2) (segid " " and resid 156 and name HA) 3.231 1.305 2.769 weight 1.000 ! spec=c13n...li-4, no=2806, id=3162, vol=2.535160e+01 or (segid " " and resid 153 and name HG2) (segid " " and resid 115 and name HE2) or (segid " " and resid 153 and name HG2) (segid " " and resid 148 and name HG1) assign (segid " " and resid 96 and name HA) (segid " " and resid 97 and name HB) 3.160 1.248 1.248 weight 1.000 ! spec=c13n...li-4, no=2810, id=3166, vol=2.894680e+01 or (segid " " and resid 124 and name HB) (segid " " and resid 121 and name HA) assign (segid " " and resid 149 and name HG2) (segid " " and resid 148 and name HB2) 3.147 1.238 2.853 weight 1.000 ! spec=c13n...li-4, no=2815, id=3170, vol=2.969830e+01 or (segid " " and resid 149 and name HG1) (segid " " and resid 148 and name HB2) assign (segid " " and resid 138 and name HA) (segid " " and resid 141 and name HG2) 2.941 1.082 1.082 weight 1.000 ! spec=c13n...li-4, no=2818, id=3172, vol=4.451900e+01 or (segid " " and resid 141 and name HG2) (segid " " and resid 144 and name HB2) assign (segid " " and resid 108 and name HB2) (segid " " and resid 105 and name HD12) 2.771 0.960 0.960 weight 1.000 ! spec=c13n...li-4, no=2821, id=3175, vol=6.371980e+01 or (segid " " and resid 108 and name HB2) (segid " " and resid 105 and name HD11) or (segid " " and resid 108 and name HB2) (segid " " and resid 105 and name HD13) or (segid " " and resid 177 and name HB2) (segid " " and resid 173 and name HD12) or (segid " " and resid 177 and name HB2) (segid " " and resid 173 and name HD11) or (segid " " and resid 177 and name HB2) (segid " " and resid 173 and name HD13) assign (segid " " and resid 181 and name HB2) (segid " " and resid 117 and name HD2) 3.052 1.164 1.164 weight 1.000 ! spec=c13n...li-4, no=2822, id=3176, vol=3.567060e+01 or (segid " " and resid 181 and name HB2) (segid " " and resid 117 and name HD1) assign (segid " " and resid 186 and name HB1) (segid " " and resid 182 and name HE1) 3.073 1.180 1.180 weight 1.000 ! spec=c13n...li-4, no=2826, id=3180, vol=3.427040e+01 or (segid " " and resid 186 and name HB1) (segid " " and resid 185 and name HN) assign (segid " " and resid 176 and name HB2) (segid " " and resid 173 and name HA) 2.877 1.035 1.035 weight 1.000 ! spec=c13n...li-4, no=2834, id=3188, vol=5.082420e+01 or (segid " " and resid 176 and name HB2) (segid " " and resid 176 and name HA) assign (segid " " and resid 154 and name HB2) (segid " " and resid 142 and name HG12) 2.776 0.963 0.963 weight 1.000 ! spec=c13n...li-4, no=2841, id=3191, vol=6.297290e+01 or (segid " " and resid 154 and name HB2) (segid " " and resid 154 and name HG2) assign (segid " " and resid 101 and name HB1) (segid " " and resid 101 and name HA) 2.326 0.676 0.676 weight 1.000 ! spec=c13n...li-4, no=2842, id=3192, vol=1.821618e+02 or (segid " " and resid 113 and name HA) (segid " " and resid 113 and name HB1) assign (segid " " and resid 101 and name HB1) (segid " " and resid 101 and name HA) 2.187 0.598 0.598 weight 1.000 ! spec=c13n...li-4, no=2844, id=3194, vol=2.638094e+02 or (segid " " and resid 113 and name HA) (segid " " and resid 113 and name HB1) or (segid " " and resid 150 and name HA) (segid " " and resid 153 and name HB2) or (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HB2) assign (segid " " and resid 104 and name HA) (segid " " and resid 104 and name HB1) 2.753 0.947 0.947 weight 1.000 ! spec=c13n...li-4, no=2848, id=3198, vol=6.625170e+01 or (segid " " and resid 189 and name HA) (segid " " and resid 189 and name HB2) assign (segid " " and resid 154 and name HB1) (segid " " and resid 152 and name HA) 3.129 1.224 1.224 weight 1.000 ! spec=c13n...li-4, no=2852, id=3202, vol=3.072150e+01 or (segid " " and resid 155 and name HA) (segid " " and resid 154 and name HB1) assign (segid " " and resid 130 and name HB1) (segid " " and resid 129 and name HB2) 3.142 1.234 1.234 weight 1.000 ! spec=c13n...li-4, no=2867, id=3213, vol=2.996750e+01 or (segid " " and resid 130 and name HB1) (segid " " and resid 164 and name HB2) assign (segid " " and resid 141 and name HB2) (segid " " and resid 142 and name HG12) 3.161 1.249 1.249 weight 1.000 ! spec=c13n...li-4, no=2875, id=3219, vol=2.888240e+01 or (segid " " and resid 145 and name HG21) (segid " " and resid 141 and name HB2) or (segid " " and resid 145 and name HG22) (segid " " and resid 141 and name HB2) or (segid " " and resid 145 and name HG23) (segid " " and resid 141 and name HB2) assign (segid " " and resid 120 and name HD2) (segid " " and resid 120 and name HG1) 2.804 0.983 0.983 weight 1.000 ! spec=c13n...li-4, no=2877, id=3221, vol=5.935070e+01 or (segid " " and resid 123 and name HG11) (segid " " and resid 171 and name HA) assign (segid " " and resid 154 and name HD2) (segid " " and resid 154 and name HD1) 1.981 0.491 0.491 weight 1.000 ! spec=c13n...li-4, no=2880, id=3223, vol=4.771074e+02 or (segid " " and resid 181 and name HD2) (segid " " and resid 181 and name HG2) assign (segid " " and resid 181 and name HE2) (segid " " and resid 181 and name HD2) 2.137 0.571 0.571 weight 1.000 ! spec=c13n...li-4, no=2882, id=3225, vol=3.025846e+02 or (segid " " and resid 99 and name HE2) (segid " " and resid 99 and name HD2) assign (segid " " and resid 99 and name HD2) (segid " " and resid 99 and name HG1) 1.811 0.410 0.410 weight 1.000 ! spec=c13n...li-4, no=2884, id=3227, vol=8.172853e+02 or (segid " " and resid 96 and name HD1) (segid " " and resid 96 and name HG2) assign (segid " " and resid 159 and name HD13) (segid " " and resid 114 and name HE1) 3.053 1.165 2.947 weight 1.000 ! spec=c13n...li-4, no=2898, id=3237, vol=3.561780e+01 or (segid " " and resid 159 and name HD12) (segid " " and resid 114 and name HE1) assign (segid " " and resid 171 and name HD12) (segid " " and resid 114 and name HZ) 3.028 1.146 1.146 weight 1.000 ! spec=c13n...li-4, no=2902, id=3240, vol=3.738970e+01 or (segid " " and resid 171 and name HD13) (segid " " and resid 114 and name HZ) assign (segid " " and resid 171 and name HD12) (segid " " and resid 172 and name HN) 3.273 1.339 1.339 weight 1.000 ! spec=c13n...li-4, no=2903, id=3241, vol=2.345070e+01 or (segid " " and resid 171 and name HD11) (segid " " and resid 172 and name HN) or (segid " " and resid 171 and name HD13) (segid " " and resid 172 and name HN) or (segid " " and resid 171 and name HD12) (segid " " and resid 186 and name HH2) or (segid " " and resid 171 and name HD11) (segid " " and resid 186 and name HH2) or (segid " " and resid 171 and name HD13) (segid " " and resid 186 and name HH2) assign (segid " " and resid 156 and name HG23) (segid " " and resid 114 and name HZ) 3.137 1.230 2.863 weight 1.000 ! spec=c13n...li-4, no=2904, id=3242, vol=3.028070e+01 or (segid " " and resid 156 and name HG21) (segid " " and resid 114 and name HZ) assign (segid " " and resid 156 and name HG12) (segid " " and resid 114 and name HD1) 3.221 1.297 1.297 weight 1.000 ! spec=c13n...li-4, no=2905, id=3243, vol=2.580130e+01 or (segid " " and resid 156 and name HG13) (segid " " and resid 114 and name HD1) assign (segid " " and resid 156 and name HG12) (segid " " and resid 114 and name HE1) 3.257 1.326 2.743 weight 1.000 ! spec=c13n...li-4, no=2906, id=3244, vol=2.415140e+01 or (segid " " and resid 156 and name HG11) (segid " " and resid 114 and name HE1) or (segid " " and resid 156 and name HG13) (segid " " and resid 114 and name HE1) assign (segid " " and resid 173 and name HG) (segid " " and resid 170 and name HB) 2.825 0.998 3.175 weight 1.000 ! spec=c13n...li-4, no=2909, id=3246, vol=5.672840e+01 or (segid " " and resid 172 and name HA) (segid " " and resid 173 and name HG) assign (segid " " and resid 171 and name HD21) (segid " " and resid 123 and name HG12) 2.607 0.850 0.850 weight 1.000 ! spec=c13n...li-4, no=2915, id=3251, vol=9.180560e+01 or (segid " " and resid 107 and name HG) (segid " " and resid 160 and name HD21) assign (segid " " and resid 130 and name HB2) (segid " " and resid 164 and name HG1) 2.440 0.744 0.744 weight 1.000 ! spec=c13n...li-4, no=2929, id=3261, vol=1.367519e+02 or (segid " " and resid 164 and name HG1) (segid " " and resid 166 and name HB2) assign (segid " " and resid 172 and name HG1) (segid " " and resid 173 and name HA) 3.122 1.219 1.219 weight 1.000 ! spec=c13n...li-4, no=2932, id=3263, vol=3.111390e+01 or (segid " " and resid 172 and name HG1) (segid " " and resid 183 and name HB2) assign (segid " " and resid 95 and name HA) (segid " " and resid 95 and name HG2) 2.603 0.847 0.847 weight 1.000 ! spec=c13n...li-4, no=2934, id=3265, vol=9.262970e+01 or (segid " " and resid 115 and name HG2) (segid " " and resid 116 and name HA) or (segid " " and resid 115 and name HG2) (segid " " and resid 116 and name HB) assign (segid " " and resid 170 and name HG21) (segid " " and resid 126 and name HB2) 3.098 1.200 1.200 weight 1.000 ! spec=c13n...li-4, no=2935, id=3266, vol=3.261610e+01 or (segid " " and resid 170 and name HG22) (segid " " and resid 126 and name HB2) or (segid " " and resid 170 and name HG23) (segid " " and resid 126 and name HB2) or (segid " " and resid 170 and name HG21) (segid " " and resid 166 and name HB1) or (segid " " and resid 170 and name HG22) (segid " " and resid 166 and name HB1) or (segid " " and resid 170 and name HG23) (segid " " and resid 166 and name HB1) assign (segid " " and resid 110 and name HD22) (segid " " and resid 109 and name HD2) 3.099 1.201 2.901 weight 1.000 ! spec=c13n...li-4, no=2946, id=3276, vol=3.252800e+01 or (segid " " and resid 110 and name HD21) (segid " " and resid 109 and name HD2) or (segid " " and resid 110 and name HD23) (segid " " and resid 109 and name HD2) or (segid " " and resid 110 and name HD22) (segid " " and resid 186 and name HB2) or (segid " " and resid 110 and name HD21) (segid " " and resid 186 and name HB2) or (segid " " and resid 110 and name HD23) (segid " " and resid 186 and name HB2) or (segid " " and resid 106 and name HD22) (segid " " and resid 109 and name HD2) or (segid " " and resid 106 and name HD21) (segid " " and resid 109 and name HD2) or (segid " " and resid 106 and name HD23) (segid " " and resid 109 and name HD2) assign (segid " " and resid 174 and name HB2) (segid " " and resid 122 and name HA) 3.113 1.211 1.211 weight 1.000 ! spec=c13n...li-4, no=2952, id=3281, vol=3.169930e+01 or (segid " " and resid 174 and name HB1) (segid " " and resid 122 and name HA) or (segid " " and resid 174 and name HB3) (segid " " and resid 122 and name HA) or (segid " " and resid 174 and name HB2) (segid " " and resid 126 and name HA) or (segid " " and resid 126 and name HA) (segid " " and resid 174 and name HB1) or (segid " " and resid 174 and name HB3) (segid " " and resid 126 and name HA) assign (segid " " and resid 124 and name HD11) (segid " " and resid 155 and name HA) 2.825 0.997 3.175 weight 1.000 ! spec=c13n...li-4, no=2963, id=3292, vol=5.677300e+01 or (segid " " and resid 124 and name HD11) (segid " " and resid 140 and name HA) assign (segid " " and resid 168 and name HA) (segid " " and resid 103 and name HB2) 3.094 1.197 1.197 weight 1.000 ! spec=c13n...li-4, no=2974, id=3301, vol=3.286180e+01 or (segid " " and resid 168 and name HA) (segid " " and resid 168 and name HD2) assign (segid " " and resid 139 and name HA) (segid " " and resid 142 and name HB) 2.309 0.667 0.667 weight 1.000 ! spec=c13n...li-4, no=2975, id=3302, vol=1.900719e+02 or (segid " " and resid 139 and name HA) (segid " " and resid 154 and name HB1) assign (segid " " and resid 101 and name HB1) (segid " " and resid 101 and name HA) 2.215 0.613 0.613 weight 1.000 ! spec=c13n...li-4, no=2988, id=3313, vol=2.441155e+02 or (segid " " and resid 172 and name HA) (segid " " and resid 172 and name HB1) assign (segid " " and resid 181 and name HA) (segid " " and resid 181 and name HB2) 2.151 0.578 0.578 weight 1.000 ! spec=c13n...li-4, no=2991, id=3316, vol=2.912605e+02 or (segid " " and resid 113 and name HA) (segid " " and resid 117 and name HG2) assign (segid " " and resid 138 and name HA) (segid " " and resid 138 and name HB2) 2.087 0.544 0.544 weight 1.000 ! spec=c13n...li-4, no=2993, id=3318, vol=3.492660e+02 or (segid " " and resid 138 and name HA) (segid " " and resid 138 and name HG1) or (segid " " and resid 138 and name HA) (segid " " and resid 141 and name HB2) assign (segid " " and resid 115 and name HA) (segid " " and resid 114 and name HE1) 3.160 1.248 1.248 weight 1.000 ! spec=c13n...li-4, no=2994, id=3319, vol=2.896710e+01 or (segid " " and resid 155 and name HA) (segid " " and resid 114 and name HE1) assign (segid " " and resid 95 and name HA) (segid " " and resid 95 and name HN) 3.071 1.179 1.179 weight 1.000 ! spec=c13n...li-4, no=2997, id=3322, vol=3.437990e+01 or (segid " " and resid 96 and name HN) (segid " " and resid 95 and name HA) assign (segid " " and resid 161 and name HA) (segid " " and resid 161 and name HG2) 2.343 0.686 0.686 weight 1.000 ! spec=c13n...li-4, no=3001, id=3325, vol=1.740873e+02 or (segid " " and resid 161 and name HA) (segid " " and resid 161 and name HG1) assign (segid " " and resid 151 and name HA2) (segid " " and resid 120 and name HB2) 2.848 1.014 1.014 weight 1.000 ! spec=c13n...li-4, no=3008, id=3330, vol=5.404070e+01 or (segid " " and resid 151 and name HA2) (segid " " and resid 154 and name HB1) assign (segid " " and resid 117 and name HD2) (segid " " and resid 117 and name HG2) 2.096 0.549 0.549 weight 1.000 ! spec=c13n...li-4, no=3015, id=3336, vol=3.403287e+02 or (segid " " and resid 161 and name HB2) (segid " " and resid 161 and name HD2) assign (segid " " and resid 117 and name HD1) (segid " " and resid 117 and name HG1) 2.449 0.750 0.750 weight 1.000 ! spec=c13n...li-4, no=3016, id=3337, vol=1.335260e+02 or (segid " " and resid 117 and name HD2) (segid " " and resid 117 and name HB1) or (segid " " and resid 117 and name HD2) (segid " " and resid 117 and name HG1) assign (segid " " and resid 95 and name HE2) (segid " " and resid 93 and name HA) 3.038 1.154 1.154 weight 1.000 ! spec=c13n...li-4, no=3017, id=3338, vol=3.665120e+01 or (segid " " and resid 146 and name HA) (segid " " and resid 146 and name HE2) assign (segid " " and resid 146 and name HE2) (segid " " and resid 146 and name HD1) 2.557 0.818 0.818 weight 1.000 ! spec=c13n...li-4, no=3018, id=3339, vol=1.030781e+02 or (segid " " and resid 99 and name HE2) (segid " " and resid 99 and name HG2) assign (segid " " and resid 115 and name HE2) (segid " " and resid 115 and name HD2) 2.382 0.709 0.709 weight 1.000 ! spec=c13n...li-4, no=3019, id=3340, vol=1.579499e+02 or (segid " " and resid 169 and name HE2) (segid " " and resid 169 and name HD2) or (segid " " and resid 108 and name HE2) (segid " " and resid 108 and name HD2) assign (segid " " and resid 99 and name HE2) (segid " " and resid 189 and name HB2) 2.574 0.828 0.828 weight 1.000 ! spec=c13n...li-4, no=3020, id=3341, vol=9.922020e+01 or (segid " " and resid 108 and name HE2) (segid " " and resid 108 and name HB2) or (segid " " and resid 177 and name HE2) (segid " " and resid 177 and name HB2) assign (segid " " and resid 114 and name HB1) (segid " " and resid 118 and name HG12) 3.108 1.207 1.207 weight 1.000 ! spec=c13n...li-4, no=3023, id=3344, vol=3.198700e+01 or (segid " " and resid 114 and name HB1) (segid " " and resid 156 and name HG22) or (segid " " and resid 114 and name HB1) (segid " " and resid 156 and name HG21) or (segid " " and resid 114 and name HB1) (segid " " and resid 156 and name HG23) assign (segid " " and resid 114 and name HB1) (segid " " and resid 115 and name HD2) 3.218 1.294 1.294 weight 1.000 ! spec=c13n...li-4, no=3024, id=3345, vol=2.596630e+01 or (segid " " and resid 114 and name HB1) (segid " " and resid 117 and name HG1) or (segid " " and resid 114 and name HB1) (segid " " and resid 152 and name HB2) or (segid " " and resid 114 and name HB1) (segid " " and resid 152 and name HB1) or (segid " " and resid 114 and name HB1) (segid " " and resid 152 and name HB3) assign (segid " " and resid 113 and name HG1) (segid " " and resid 113 and name HB1) 2.176 0.592 0.592 weight 1.000 ! spec=c13n...li-4, no=3027, id=3348, vol=2.719003e+02 or (segid " " and resid 98 and name HG2) (segid " " and resid 98 and name HB2) assign (segid " " and resid 139 and name HD11) (segid " " and resid 139 and name HB) 1.953 0.477 4.047 weight 1.000 ! spec=c13n...li-4, no=3031, id=3350, vol=5.203352e+02 or (segid " " and resid 124 and name HD11) (segid " " and resid 139 and name HB) assign (segid " " and resid 101 and name HG2) (segid " " and resid 98 and name HA) 2.787 0.971 0.971 weight 1.000 ! spec=c13n...li-4, no=3034, id=3352, vol=6.156770e+01 or (segid " " and resid 154 and name HA) (segid " " and resid 157 and name HG2) assign (segid " " and resid 117 and name HB2) (segid " " and resid 117 and name HA) 2.607 0.850 0.850 weight 1.000 ! spec=c13n...li-4, no=3037, id=3355, vol=9.181130e+01 or (segid " " and resid 119 and name HA) (segid " " and resid 148 and name HB1) assign (segid " " and resid 115 and name HG2) (segid " " and resid 115 and name HB2) 2.146 0.575 0.575 weight 1.000 ! spec=c13n...li-4, no=3038, id=3356, vol=2.955040e+02 or (segid " " and resid 108 and name HB2) (segid " " and resid 108 and name HG2) assign (segid " " and resid 156 and name HG22) (segid " " and resid 115 and name HA) 3.027 1.145 1.145 weight 1.000 ! spec=c13n...li-4, no=3041, id=3358, vol=3.749410e+01 or (segid " " and resid 156 and name HG21) (segid " " and resid 115 and name HA) or (segid " " and resid 156 and name HG23) (segid " " and resid 115 and name HA) or (segid " " and resid 156 and name HG22) (segid " " and resid 152 and name HA) or (segid " " and resid 156 and name HG21) (segid " " and resid 152 and name HA) or (segid " " and resid 156 and name HG23) (segid " " and resid 152 and name HA) or (segid " " and resid 156 and name HG22) (segid " " and resid 155 and name HA) or (segid " " and resid 156 and name HG21) (segid " " and resid 155 and name HA) or (segid " " and resid 156 and name HG23) (segid " " and resid 155 and name HA) assign (segid " " and resid 182 and name HD1) (segid " " and resid 175 and name HD13) 2.542 0.807 3.458 weight 1.000 ! spec=c13n...ro-1, no=18, id=3367, vol=2.357000e+01 or (segid " " and resid 182 and name HD1) (segid " " and resid 175 and name HD12) assign (segid " " and resid 103 and name HD1) (segid " " and resid 102 and name HB2) 3.145 1.236 2.855 weight 1.000 ! spec=c13n...ro-1, no=63, id=3401, vol=6.564700e+00 or (segid " " and resid 103 and name HD1) (segid " " and resid 99 and name HB2) assign (segid " " and resid 118 and name HD11) (segid " " and resid 114 and name HD1) 2.956 1.092 1.092 weight 1.000 ! spec=c13n...ro-1, no=67, id=3404, vol=9.517400e+00 or (segid " " and resid 114 and name HD1) (segid " " and resid 118 and name HD12) assign (segid " " and resid 114 and name HZ) (segid " " and resid 107 and name HD21) 2.994 1.121 1.121 weight 1.000 ! spec=c13n...ro-1, no=73, id=3409, vol=8.814500e+00 or (segid " " and resid 114 and name HZ) (segid " " and resid 159 and name HD21) assign (segid " " and resid 182 and name HD1) (segid " " and resid 118 and name HD12) 2.770 0.959 3.230 weight 1.000 ! spec=c13n...ro-1, no=83, id=3418, vol=1.407190e+01 or (segid " " and resid 182 and name HD1) (segid " " and resid 118 and name HD13) assign (segid " " and resid 107 and name HB1) (segid " " and resid 186 and name HZ3) 3.193 1.275 1.275 weight 1.000 ! spec=c13n...ro-1, no=95, id=3429, vol=5.990300e+00 or (segid " " and resid 186 and name HZ3) (segid " " and resid 110 and name HG) assign (segid " " and resid 186 and name HH2) (segid " " and resid 106 and name HB2) 3.330 1.386 1.386 weight 1.000 ! spec=c13n...ro-1, no=105, id=3439, vol=4.658200e+00 or (segid " " and resid 107 and name HB2) (segid " " and resid 186 and name HH2) assign (segid " " and resid 121 and name HN) (segid " " and resid 120 and name HA) 2.533 0.802 0.802 weight 1.000 ! spec=n15n...hn-2, no=87, id=9, vol=1.223900e+00 or (segid " " and resid 121 and name HN) (segid " " and resid 121 and name HB) assign (segid " " and resid 152 and name HN) (segid " " and resid 151 and name HN) 2.322 0.674 0.674 weight 1.000 ! spec=n15n...hn-2, no=124, id=35, vol=2.063300e+00 or (segid " " and resid 152 and name HN) (segid " " and resid 153 and name HN) assign (segid " " and resid 98 and name HN) (segid " " and resid 97 and name HG21) 2.935 1.077 1.077 weight 1.000 ! 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