NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
641346 |
6j3l   |
cing | 1-original | 3 | XPLOR/CNS | distance | NOE | ambi |
# Restraints file 3: unambig.tbl
assign (segid " A" and resid 105 and name HN) (segid " A" and resid 107 and name HA) 3.170 1.256 1.256 weight 1.000 ! spec=15N, no=2, id=1, vol=4.507100e+00
assign (segid " A" and resid 108 and name HN) (segid " A" and resid 107 and name HA) 2.743 0.940 0.940 weight 1.000 ! spec=15N, no=6, id=3, vol=1.074960e+01
assign (segid " A" and resid 109 and name HN) (segid " A" and resid 109 and name HA) 3.006 1.130 1.130 weight 1.000 ! spec=15N, no=12, id=6, vol=6.202300e+00
assign (segid " A" and resid 109 and name HN) (segid " A" and resid 108 and name HA) 2.623 0.860 0.860 weight 1.000 ! spec=15N, no=13, id=7, vol=1.404210e+01
assign (segid " A" and resid 111 and name HN) (segid " A" and resid 110 and name HA) 2.687 0.902 0.902 weight 1.000 ! spec=15N, no=19, id=11, vol=1.216230e+01
assign (segid " A" and resid 111 and name HN) (segid " A" and resid 111 and name HA) 3.331 1.387 1.387 weight 1.000 ! spec=15N, no=20, id=12, vol=3.351300e+00
assign (segid " A" and resid 112 and name HN) (segid " A" and resid 112 and name HA) 2.773 0.961 0.961 weight 1.000 ! spec=15N, no=26, id=17, vol=1.006400e+01
assign (segid " A" and resid 112 and name HN) (segid " A" and resid 111 and name HA) 2.513 0.790 0.790 weight 1.000 ! spec=15N, no=27, id=18, vol=1.816210e+01
assign (segid " A" and resid 114 and name HN) (segid " A" and resid 113 and name HA) 3.100 1.201 1.201 weight 1.000 ! spec=15N, no=33, id=22, vol=5.159300e+00
assign (segid " A" and resid 114 and name HN) (segid " A" and resid 115 and name HN) 3.765 1.772 1.772 weight 1.000 ! spec=15N, no=36, id=25, vol=1.607000e+00
assign (segid " A" and resid 115 and name HN) (segid " A" and resid 167 and name HB) 3.126 1.222 1.222 weight 1.000 ! spec=15N, no=40, id=27, vol=4.903700e+00
assign (segid " A" and resid 114 and name HN) (segid " A" and resid 115 and name HN) 3.296 1.358 1.358 weight 1.000 ! spec=15N, no=44, id=31, vol=3.566200e+00
assign (segid " A" and resid 116 and name HN) (segid " A" and resid 116 and name HB) 2.395 0.717 0.717 weight 1.000 ! spec=15N, no=46, id=33, vol=2.421980e+01
assign (segid " A" and resid 116 and name HN) (segid " A" and resid 115 and name HA) 2.275 0.647 0.647 weight 1.000 ! spec=15N, no=47, id=34, vol=3.302650e+01
assign (segid " A" and resid 117 and name HN) (segid " A" and resid 116 and name HA) 2.634 0.868 0.868 weight 1.000 ! spec=15N, no=50, id=36, vol=1.368820e+01
assign (segid " A" and resid 119 and name HN) (segid " A" and resid 119 and name HA) 3.124 1.220 1.220 weight 1.000 ! spec=15N, no=54, id=39, vol=4.927200e+00
assign (segid " A" and resid 119 and name HN) (segid " A" and resid 117 and name HA) 3.645 1.661 1.661 weight 1.000 ! spec=15N, no=57, id=42, vol=1.950400e+00
assign (segid " A" and resid 120 and name HN) (segid " A" and resid 121 and name HA) 3.385 1.432 1.432 weight 1.000 ! spec=15N, no=64, id=49, vol=3.041400e+00
assign (segid " A" and resid 120 and name HN) (segid " A" and resid 121 and name HN) 3.178 1.262 1.262 weight 1.000 ! spec=15N, no=68, id=51, vol=4.444200e+00
assign (segid " A" and resid 121 and name HN) (segid " A" and resid 161 and name HN) 3.139 1.232 1.232 weight 1.000 ! spec=15N, no=71, id=52, vol=4.779800e+00
assign (segid " A" and resid 121 and name HN) (segid " A" and resid 120 and name HA) 2.420 0.732 0.732 weight 1.000 ! spec=15N, no=72, id=53, vol=2.275930e+01
assign (segid " A" and resid 121 and name HN) (segid " A" and resid 121 and name HA) 3.012 1.134 1.134 weight 1.000 ! spec=15N, no=73, id=54, vol=6.126600e+00
assign (segid " A" and resid 121 and name HN) (segid " A" and resid 121 and name HB) 2.844 1.011 1.011 weight 1.000 ! spec=15N, no=78, id=59, vol=8.655700e+00
assign (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HA) 2.985 1.114 1.114 weight 1.000 ! spec=15N, no=80, id=60, vol=6.466800e+00
assign (segid " A" and resid 122 and name HN) (segid " A" and resid 121 and name HA) 2.231 0.622 0.622 weight 1.000 ! spec=15N, no=81, id=61, vol=3.714570e+01
assign (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HB) 2.597 0.843 0.843 weight 1.000 ! spec=15N, no=82, id=62, vol=1.493350e+01
assign (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HG12) 2.705 0.915 0.915 weight 1.000 ! spec=15N, no=84, id=64, vol=1.167570e+01
or (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HG11)
or (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HG13)
assign (segid " A" and resid 123 and name HN) (segid " A" and resid 122 and name HA) 2.427 0.736 0.736 weight 1.000 ! spec=15N, no=86, id=65, vol=2.241720e+01
assign (segid " A" and resid 123 and name HN) (segid " A" and resid 123 and name HB) 2.747 0.943 0.943 weight 1.000 ! spec=15N, no=87, id=66, vol=1.065360e+01
assign (segid " A" and resid 123 and name HN) (segid " A" and resid 123 and name HG11) 2.944 1.084 1.084 weight 1.000 ! spec=15N, no=88, id=67, vol=7.024400e+00
assign (segid " A" and resid 123 and name HN) (segid " A" and resid 123 and name HG11) 2.786 0.970 0.970 weight 1.000 ! spec=15N, no=89, id=68, vol=9.792400e+00
assign (segid " A" and resid 123 and name HN) (segid " A" and resid 123 and name HA) 3.042 1.156 1.156 weight 1.000 ! spec=15N, no=91, id=70, vol=5.778900e+00
assign (segid " A" and resid 125 and name HN) (segid " A" and resid 125 and name HA) 2.838 1.007 1.007 weight 1.000 ! spec=15N, no=95, id=74, vol=8.760600e+00
assign (segid " A" and resid 125 and name HN) (segid " A" and resid 124 and name HA) 2.233 0.623 0.623 weight 1.000 ! spec=15N, no=96, id=75, vol=3.690760e+01
assign (segid " A" and resid 125 and name HN) (segid " A" and resid 157 and name HA) 2.604 0.848 0.848 weight 1.000 ! spec=15N, no=97, id=76, vol=1.466590e+01
assign (segid " A" and resid 125 and name HN) (segid " A" and resid 157 and name HN) 3.217 1.294 1.294 weight 1.000 ! spec=15N, no=99, id=77, vol=4.129000e+00
assign (segid " A" and resid 126 and name HN) (segid " A" and resid 124 and name HA) 3.490 1.522 1.522 weight 1.000 ! spec=15N, no=104, id=82, vol=2.532900e+00
assign (segid " A" and resid 126 and name HN) (segid " A" and resid 126 and name HA) 2.643 0.873 0.873 weight 1.000 ! spec=15N, no=105, id=83, vol=1.342310e+01
assign (segid " A" and resid 126 and name HN) (segid " A" and resid 154 and name HN) 2.906 1.056 1.056 weight 1.000 ! spec=15N, no=106, id=84, vol=7.600500e+00
assign (segid " A" and resid 126 and name HN) (segid " A" and resid 125 and name HA) 2.309 0.667 0.667 weight 1.000 ! spec=15N, no=110, id=86, vol=3.016770e+01
assign (segid " A" and resid 128 and name HN) (segid " A" and resid 128 and name HG1) 2.762 0.953 0.953 weight 1.000 ! spec=15N, no=111, id=87, vol=1.031320e+01
assign (segid " A" and resid 128 and name HN) (segid " A" and resid 129 and name HN) 2.866 1.027 1.027 weight 1.000 ! spec=15N, no=112, id=88, vol=8.255200e+00
assign (segid " A" and resid 128 and name HN) (segid " A" and resid 153 and name HA) 2.763 0.954 0.954 weight 1.000 ! spec=15N, no=114, id=89, vol=1.029370e+01
assign (segid " A" and resid 128 and name HN) (segid " A" and resid 128 and name HA) 2.894 1.047 1.047 weight 1.000 ! spec=15N, no=115, id=90, vol=7.794700e+00
assign (segid " A" and resid 128 and name HN) (segid " A" and resid 127 and name HA) 2.587 0.837 0.837 weight 1.000 ! spec=15N, no=118, id=93, vol=1.526460e+01
assign (segid " A" and resid 128 and name HN) (segid " A" and resid 129 and name HN) 3.447 1.485 1.485 weight 1.000 ! spec=15N, no=121, id=96, vol=2.727300e+00
assign (segid " A" and resid 129 and name HN) (segid " A" and resid 151 and name HG1) 3.666 1.680 1.680 weight 1.000 ! spec=15N, no=123, id=97, vol=1.886100e+00
assign (segid " A" and resid 130 and name HN) (segid " A" and resid 130 and name HG) 2.637 0.869 0.869 weight 1.000 ! spec=15N, no=127, id=101, vol=1.362350e+01
assign (segid " A" and resid 130 and name HN) (segid " A" and resid 128 and name HG1) 2.984 1.113 1.113 weight 1.000 ! spec=15N, no=129, id=103, vol=6.476800e+00
assign (segid " A" and resid 131 and name HN) (segid " A" and resid 130 and name HA) 2.283 0.652 0.652 weight 1.000 ! spec=15N, no=134, id=106, vol=3.230810e+01
assign (segid " A" and resid 131 and name HN) (segid " A" and resid 134 and name HN) 3.321 1.379 1.379 weight 1.000 ! spec=15N, no=142, id=114, vol=3.409900e+00
assign (segid " A" and resid 133 and name HN) (segid " A" and resid 134 and name HN) 3.440 1.479 1.479 weight 1.000 ! spec=15N, no=146, id=116, vol=2.764000e+00
assign (segid " A" and resid 133 and name HN) (segid " A" and resid 133 and name HA) 3.293 1.355 1.355 weight 1.000 ! spec=15N, no=148, id=117, vol=3.589500e+00
assign (segid " A" and resid 133 and name HN) (segid " A" and resid 132 and name HA) 3.610 1.629 1.629 weight 1.000 ! spec=15N, no=151, id=120, vol=2.066200e+00
assign (segid " A" and resid 134 and name HN) (segid " A" and resid 134 and name HB1) 2.494 0.778 0.778 weight 1.000 ! spec=15N, no=152, id=121, vol=1.900560e+01
assign (segid " A" and resid 134 and name HN) (segid " A" and resid 134 and name HB1) 2.790 0.973 0.973 weight 1.000 ! spec=15N, no=153, id=122, vol=9.709100e+00
assign (segid " A" and resid 134 and name HN) (segid " A" and resid 132 and name HA) 3.139 1.232 1.232 weight 1.000 ! spec=15N, no=154, id=123, vol=4.782300e+00
assign (segid " A" and resid 134 and name HN) (segid " A" and resid 134 and name HA) 2.598 0.843 0.843 weight 1.000 ! spec=15N, no=155, id=124, vol=1.489530e+01
assign (segid " A" and resid 135 and name HN) (segid " A" and resid 135 and name HB) 2.669 0.890 0.890 weight 1.000 ! spec=15N, no=160, id=129, vol=1.267150e+01
assign (segid " A" and resid 135 and name HN) (segid " A" and resid 133 and name HA) 3.200 1.280 1.280 weight 1.000 ! spec=15N, no=161, id=130, vol=4.261700e+00
assign (segid " A" and resid 135 and name HN) (segid " A" and resid 134 and name HA) 2.471 0.763 0.763 weight 1.000 ! spec=15N, no=162, id=131, vol=2.010070e+01
assign (segid " A" and resid 135 and name HN) (segid " A" and resid 135 and name HA) 2.496 0.779 0.779 weight 1.000 ! spec=15N, no=163, id=132, vol=1.890310e+01
assign (segid " A" and resid 135 and name HN) (segid " A" and resid 138 and name HN) 3.501 1.532 1.532 weight 1.000 ! spec=15N, no=164, id=133, vol=2.483700e+00
assign (segid " A" and resid 137 and name HN) (segid " A" and resid 139 and name HN) 3.402 1.446 1.446 weight 1.000 ! spec=15N, no=165, id=134, vol=2.954200e+00
assign (segid " A" and resid 137 and name HN) (segid " A" and resid 138 and name HN) 2.572 0.827 0.827 weight 1.000 ! spec=15N, no=166, id=135, vol=1.582190e+01
assign (segid " A" and resid 137 and name HN) (segid " A" and resid 134 and name HA) 2.656 0.882 0.882 weight 1.000 ! spec=15N, no=168, id=136, vol=1.303220e+01
assign (segid " A" and resid 137 and name HN) (segid " A" and resid 137 and name HA) 2.530 0.800 0.800 weight 1.000 ! spec=15N, no=169, id=137, vol=1.743480e+01
assign (segid " A" and resid 137 and name HN) (segid " A" and resid 139 and name HB1) 3.492 1.525 1.525 weight 1.000 ! spec=15N, no=173, id=141, vol=2.521800e+00
assign (segid " A" and resid 138 and name HN) (segid " A" and resid 138 and name HA) 2.688 0.903 0.903 weight 1.000 ! spec=15N, no=177, id=144, vol=1.213380e+01
assign (segid " A" and resid 138 and name HN) (segid " A" and resid 139 and name HB1) 3.240 1.312 1.312 weight 1.000 ! spec=15N, no=179, id=146, vol=3.955000e+00
assign (segid " A" and resid 139 and name HN) (segid " A" and resid 139 and name HB1) 2.349 0.690 0.690 weight 1.000 ! spec=15N, no=182, id=148, vol=2.725370e+01
assign (segid " A" and resid 139 and name HN) (segid " A" and resid 139 and name HA) 2.428 0.737 0.737 weight 1.000 ! spec=15N, no=186, id=152, vol=2.232130e+01
assign (segid " A" and resid 139 and name HN) (segid " A" and resid 138 and name HN) 2.448 0.749 0.749 weight 1.000 ! spec=15N, no=193, id=158, vol=2.127110e+01
assign (segid " A" and resid 139 and name HN) (segid " A" and resid 141 and name HN) 3.473 1.508 1.508 weight 1.000 ! spec=15N, no=194, id=159, vol=2.606900e+00
assign (segid " A" and resid 140 and name HN) (segid " A" and resid 139 and name HN) 2.687 0.903 0.903 weight 1.000 ! spec=15N, no=195, id=160, vol=1.215920e+01
assign (segid " A" and resid 140 and name HN) (segid " A" and resid 141 and name HN) 2.650 0.877 0.877 weight 1.000 ! spec=15N, no=197, id=161, vol=1.322900e+01
assign (segid " A" and resid 140 and name HN) (segid " A" and resid 139 and name HB1) 2.500 0.781 0.781 weight 1.000 ! spec=15N, no=201, id=164, vol=1.874170e+01
assign (segid " A" and resid 140 and name HN) (segid " A" and resid 137 and name HN) 3.405 1.449 1.449 weight 1.000 ! spec=15N, no=203, id=166, vol=2.936100e+00
assign (segid " A" and resid 140 and name HN) (segid " A" and resid 143 and name HN) 3.258 1.327 1.327 weight 1.000 ! spec=15N, no=204, id=167, vol=3.824000e+00
assign (segid " A" and resid 141 and name HN) (segid " A" and resid 142 and name HN) 2.391 0.715 0.715 weight 1.000 ! spec=15N, no=206, id=169, vol=2.447540e+01
assign (segid " A" and resid 141 and name HN) (segid " A" and resid 143 and name HN) 3.216 1.293 1.293 weight 1.000 ! spec=15N, no=207, id=170, vol=4.136000e+00
assign (segid " A" and resid 141 and name HN) (segid " A" and resid 141 and name HA) 2.750 0.945 0.945 weight 1.000 ! spec=15N, no=209, id=171, vol=1.058330e+01
assign (segid " A" and resid 142 and name HN) (segid " A" and resid 143 and name HN) 2.706 0.915 0.915 weight 1.000 ! spec=15N, no=216, id=177, vol=1.165510e+01
assign (segid " A" and resid 141 and name HN) (segid " A" and resid 142 and name HN) 2.442 0.745 0.745 weight 1.000 ! spec=15N, no=217, id=178, vol=2.157320e+01
assign (segid " A" and resid 142 and name HN) (segid " A" and resid 141 and name HA) 2.846 1.013 1.013 weight 1.000 ! spec=15N, no=220, id=180, vol=8.607000e+00
assign (segid " A" and resid 142 and name HN) (segid " A" and resid 142 and name HA) 2.148 0.577 0.577 weight 1.000 ! spec=15N, no=221, id=181, vol=4.653130e+01
assign (segid " A" and resid 142 and name HN) (segid " A" and resid 143 and name HN) 2.644 0.874 0.874 weight 1.000 ! spec=15N, no=225, id=185, vol=1.340200e+01
assign (segid " A" and resid 141 and name HN) (segid " A" and resid 143 and name HN) 3.190 1.272 1.272 weight 1.000 ! spec=15N, no=227, id=186, vol=4.339000e+00
assign (segid " A" and resid 143 and name HN) (segid " A" and resid 143 and name HA) 2.793 0.975 0.975 weight 1.000 ! spec=15N, no=228, id=187, vol=9.644000e+00
assign (segid " A" and resid 143 and name HN) (segid " A" and resid 142 and name HA) 2.488 0.774 0.774 weight 1.000 ! spec=15N, no=229, id=188, vol=1.928310e+01
assign (segid " A" and resid 143 and name HN) (segid " A" and resid 143 and name HB) 2.409 0.725 0.725 weight 1.000 ! spec=15N, no=231, id=190, vol=2.341750e+01
assign (segid " A" and resid 145 and name HN) (segid " A" and resid 145 and name HA) 2.955 1.091 1.091 weight 1.000 ! spec=15N, no=237, id=195, vol=6.879100e+00
assign (segid " A" and resid 145 and name HN) (segid " A" and resid 144 and name HA) 2.108 0.556 0.556 weight 1.000 ! spec=15N, no=238, id=196, vol=5.210320e+01
assign (segid " A" and resid 145 and name HN) (segid " A" and resid 145 and name HB) 3.021 1.141 1.141 weight 1.000 ! spec=15N, no=240, id=198, vol=6.021500e+00
assign (segid " A" and resid 146 and name HN) (segid " A" and resid 145 and name HA) 2.480 0.769 0.769 weight 1.000 ! spec=15N, no=244, id=201, vol=1.969170e+01
assign (segid " A" and resid 146 and name HN) (segid " A" and resid 145 and name HB) 2.481 0.769 0.769 weight 1.000 ! spec=15N, no=245, id=202, vol=1.962380e+01
assign (segid " A" and resid 146 and name HN) (segid " A" and resid 146 and name HA) 2.876 1.034 1.034 weight 1.000 ! spec=15N, no=250, id=207, vol=8.083900e+00
assign (segid " A" and resid 146 and name HN) (segid " A" and resid 153 and name HN) 3.188 1.270 1.270 weight 1.000 ! spec=15N, no=251, id=208, vol=4.361900e+00
assign (segid " A" and resid 146 and name HN) (segid " A" and resid 155 and name HN) 3.615 1.634 1.634 weight 1.000 ! spec=15N, no=252, id=209, vol=2.049000e+00
assign (segid " A" and resid 146 and name HN) (segid " A" and resid 145 and name HN) 3.552 1.577 1.577 weight 1.000 ! spec=15N, no=254, id=211, vol=2.277600e+00
assign (segid " A" and resid 147 and name HN) (segid " A" and resid 146 and name HA) 2.294 0.658 0.658 weight 1.000 ! spec=15N, no=255, id=212, vol=3.136310e+01
assign (segid " A" and resid 148 and name HN) (segid " A" and resid 151 and name HN) 2.983 1.112 1.112 weight 1.000 ! spec=15N, no=263, id=218, vol=6.499700e+00
assign (segid " A" and resid 148 and name HN) (segid " A" and resid 147 and name HA) 2.311 0.668 0.668 weight 1.000 ! spec=15N, no=264, id=219, vol=3.002240e+01
assign (segid " A" and resid 148 and name HN) (segid " A" and resid 147 and name HB) 3.314 1.373 1.373 weight 1.000 ! spec=15N, no=267, id=222, vol=3.452300e+00
assign (segid " A" and resid 150 and name HN) (segid " A" and resid 151 and name HN) 2.929 1.072 1.072 weight 1.000 ! spec=15N, no=270, id=223, vol=7.245700e+00
assign (segid " A" and resid 150 and name HN) (segid " A" and resid 149 and name HA) 2.787 0.971 0.971 weight 1.000 ! spec=15N, no=273, id=225, vol=9.771900e+00
assign (segid " A" and resid 150 and name HN) (segid " A" and resid 149 and name HN) 3.560 1.584 1.584 weight 1.000 ! spec=15N, no=278, id=230, vol=2.247000e+00
assign (segid " A" and resid 151 and name HN) (segid " A" and resid 151 and name HG1) 3.090 1.193 1.193 weight 1.000 ! spec=15N, no=280, id=231, vol=5.262400e+00
assign (segid " A" and resid 151 and name HN) (segid " A" and resid 147 and name HA) 3.227 1.302 1.302 weight 1.000 ! spec=15N, no=282, id=232, vol=4.052000e+00
assign (segid " A" and resid 150 and name HN) (segid " A" and resid 151 and name HN) 2.817 0.992 0.992 weight 1.000 ! spec=15N, no=287, id=237, vol=9.161200e+00
assign (segid " A" and resid 151 and name HN) (segid " A" and resid 152 and name HN) 3.646 1.662 1.662 weight 1.000 ! spec=15N, no=290, id=240, vol=1.948400e+00
assign (segid " A" and resid 152 and name HN) (segid " A" and resid 152 and name HB) 2.635 0.868 0.868 weight 1.000 ! spec=15N, no=291, id=241, vol=1.366400e+01
assign (segid " A" and resid 152 and name HN) (segid " A" and resid 151 and name HB) 2.794 0.976 0.976 weight 1.000 ! spec=15N, no=296, id=246, vol=9.625700e+00
assign (segid " A" and resid 152 and name HN) (segid " A" and resid 151 and name HA) 2.762 0.954 0.954 weight 1.000 ! spec=15N, no=297, id=247, vol=1.030910e+01
assign (segid " A" and resid 152 and name HN) (segid " A" and resid 152 and name HA) 3.249 1.320 1.320 weight 1.000 ! spec=15N, no=299, id=248, vol=3.889500e+00
assign (segid " A" and resid 152 and name HN) (segid " A" and resid 128 and name HG1) 3.373 1.422 1.422 weight 1.000 ! spec=15N, no=300, id=249, vol=3.105600e+00
assign (segid " A" and resid 152 and name HN) (segid " A" and resid 151 and name HG1) 3.435 1.475 1.475 weight 1.000 ! spec=15N, no=301, id=250, vol=2.786500e+00
assign (segid " A" and resid 152 and name HN) (segid " A" and resid 130 and name HN) 3.542 1.568 1.568 weight 1.000 ! spec=15N, no=302, id=251, vol=2.317100e+00
assign (segid " A" and resid 146 and name HN) (segid " A" and resid 153 and name HN) 3.164 1.251 1.251 weight 1.000 ! spec=15N, no=304, id=252, vol=4.565500e+00
assign (segid " A" and resid 153 and name HN) (segid " A" and resid 147 and name HA) 3.092 1.195 1.195 weight 1.000 ! spec=15N, no=305, id=253, vol=5.237100e+00
assign (segid " A" and resid 153 and name HN) (segid " A" and resid 152 and name HA) 2.494 0.778 0.778 weight 1.000 ! spec=15N, no=306, id=254, vol=1.900620e+01
assign (segid " A" and resid 126 and name HN) (segid " A" and resid 154 and name HN) 3.123 1.219 1.219 weight 1.000 ! spec=15N, no=312, id=259, vol=4.931300e+00
assign (segid " A" and resid 154 and name HN) (segid " A" and resid 153 and name HA) 2.564 0.822 0.822 weight 1.000 ! spec=15N, no=313, id=260, vol=1.611620e+01
assign (segid " A" and resid 154 and name HN) (segid " A" and resid 154 and name HA) 3.161 1.249 1.249 weight 1.000 ! spec=15N, no=315, id=261, vol=4.591300e+00
assign (segid " A" and resid 155 and name HN) (segid " A" and resid 156 and name HN) 2.739 0.938 0.938 weight 1.000 ! spec=15N, no=319, id=265, vol=1.083740e+01
assign (segid " A" and resid 155 and name HN) (segid " A" and resid 145 and name HA) 2.971 1.104 1.104 weight 1.000 ! spec=15N, no=321, id=266, vol=6.650500e+00
assign (segid " A" and resid 155 and name HN) (segid " A" and resid 154 and name HA) 2.433 0.740 0.740 weight 1.000 ! spec=15N, no=322, id=267, vol=2.206400e+01
assign (segid " A" and resid 155 and name HN) (segid " A" and resid 156 and name HN) 2.723 0.927 0.927 weight 1.000 ! spec=15N, no=327, id=272, vol=1.122390e+01
assign (segid " A" and resid 156 and name HN) (segid " A" and resid 156 and name HA) 2.769 0.958 0.958 weight 1.000 ! spec=15N, no=328, id=273, vol=1.015680e+01
assign (segid " A" and resid 156 and name HN) (segid " A" and resid 155 and name HA) 2.837 1.006 1.006 weight 1.000 ! spec=15N, no=329, id=274, vol=8.773900e+00
assign (segid " A" and resid 156 and name HN) (segid " A" and resid 155 and name HB) 2.729 0.931 0.931 weight 1.000 ! spec=15N, no=332, id=277, vol=1.108030e+01
assign (segid " A" and resid 158 and name HN) (segid " A" and resid 158 and name HA) 2.926 1.070 1.070 weight 1.000 ! spec=15N, no=340, id=284, vol=7.296100e+00
assign (segid " A" and resid 158 and name HN) (segid " A" and resid 157 and name HA) 2.368 0.701 0.701 weight 1.000 ! spec=15N, no=341, id=285, vol=2.595560e+01
assign (segid " A" and resid 125 and name HN) (segid " A" and resid 158 and name HN) 3.343 1.397 1.397 weight 1.000 ! spec=15N, no=345, id=288, vol=3.277100e+00
assign (segid " A" and resid 160 and name HN) (segid " A" and resid 161 and name HN) 3.306 1.366 1.366 weight 1.000 ! spec=15N, no=347, id=289, vol=3.507100e+00
assign (segid " A" and resid 160 and name HN) (segid " A" and resid 122 and name HA) 2.992 1.119 1.119 weight 1.000 ! spec=15N, no=348, id=290, vol=6.377800e+00
assign (segid " A" and resid 160 and name HN) (segid " A" and resid 160 and name HA) 3.384 1.432 1.432 weight 1.000 ! spec=15N, no=349, id=291, vol=3.046300e+00
assign (segid " A" and resid 160 and name HN) (segid " A" and resid 160 and name HB) 3.089 1.193 1.193 weight 1.000 ! spec=15N, no=350, id=292, vol=5.266700e+00
assign (segid " A" and resid 160 and name HN) (segid " A" and resid 161 and name HN) 3.283 1.347 1.347 weight 1.000 ! spec=15N, no=354, id=295, vol=3.655100e+00
assign (segid " A" and resid 161 and name HN) (segid " A" and resid 160 and name HA) 3.554 1.579 1.579 weight 1.000 ! spec=15N, no=356, id=296, vol=2.269900e+00
assign (segid " A" and resid 162 and name HN) (segid " A" and resid 161 and name HA) 2.448 0.749 0.749 weight 1.000 ! spec=15N, no=359, id=298, vol=2.128960e+01
assign (segid " A" and resid 162 and name HN) (segid " A" and resid 161 and name HG) 3.373 1.423 1.423 weight 1.000 ! spec=15N, no=365, id=304, vol=3.104900e+00
assign (segid " A" and resid 164 and name HN) (segid " A" and resid 165 and name HN) 3.250 1.321 1.321 weight 1.000 ! spec=15N, no=367, id=305, vol=3.881600e+00
assign (segid " A" and resid 164 and name HN) (segid " A" and resid 163 and name HA) 2.746 0.943 0.943 weight 1.000 ! spec=15N, no=368, id=306, vol=1.067150e+01
assign (segid " A" and resid 164 and name HN) (segid " A" and resid 165 and name HN) 2.684 0.901 0.901 weight 1.000 ! spec=15N, no=376, id=313, vol=1.224050e+01
assign (segid " A" and resid 165 and name HN) (segid " A" and resid 165 and name HA) 2.639 0.870 0.870 weight 1.000 ! spec=15N, no=378, id=314, vol=1.355230e+01
assign (segid " A" and resid 165 and name HN) (segid " A" and resid 163 and name HA) 3.082 1.187 1.187 weight 1.000 ! spec=15N, no=379, id=315, vol=5.340600e+00
assign (segid " A" and resid 166 and name HN) (segid " A" and resid 165 and name HA) 2.403 0.722 0.722 weight 1.000 ! spec=15N, no=384, id=320, vol=2.379320e+01
assign (segid " A" and resid 167 and name HN) (segid " A" and resid 166 and name HA) 3.026 1.144 1.144 weight 1.000 ! spec=15N, no=391, id=326, vol=5.965700e+00
assign (segid " A" and resid 171 and name HN) (segid " A" and resid 172 and name HN) 2.782 0.967 0.967 weight 1.000 ! spec=15N, no=400, id=333, vol=9.876100e+00
assign (segid " A" and resid 171 and name HN) (segid " A" and resid 171 and name HA) 2.550 0.813 0.813 weight 1.000 ! spec=15N, no=403, id=335, vol=1.665640e+01
assign (segid " A" and resid 171 and name HN) (segid " A" and resid 168 and name HN) 3.432 1.473 1.473 weight 1.000 ! spec=15N, no=407, id=339, vol=2.799100e+00
assign (segid " A" and resid 172 and name HN) (segid " A" and resid 173 and name HN) 2.715 0.921 0.921 weight 1.000 ! spec=15N, no=409, id=340, vol=1.143590e+01
assign (segid " A" and resid 171 and name HN) (segid " A" and resid 172 and name HN) 2.687 0.903 0.903 weight 1.000 ! spec=15N, no=415, id=346, vol=1.215110e+01
assign (segid " A" and resid 173 and name HN) (segid " A" and resid 171 and name HN) 3.498 1.529 1.529 weight 1.000 ! spec=15N, no=416, id=347, vol=2.498200e+00
assign (segid " A" and resid 172 and name HN) (segid " A" and resid 173 and name HN) 2.643 0.873 0.873 weight 1.000 ! spec=15N, no=417, id=348, vol=1.342270e+01
assign (segid " A" and resid 173 and name HN) (segid " A" and resid 174 and name HN) 2.651 0.878 0.878 weight 1.000 ! spec=15N, no=419, id=349, vol=1.319150e+01
assign (segid " A" and resid 173 and name HN) (segid " A" and resid 173 and name HB) 2.266 0.642 0.642 weight 1.000 ! spec=15N, no=421, id=351, vol=3.379540e+01
assign (segid " A" and resid 173 and name HN) (segid " A" and resid 173 and name HA) 2.516 0.791 0.791 weight 1.000 ! spec=15N, no=422, id=352, vol=1.802890e+01
assign (segid " A" and resid 174 and name HN) (segid " A" and resid 175 and name HN) 2.672 0.893 0.893 weight 1.000 ! spec=15N, no=425, id=355, vol=1.256590e+01
assign (segid " A" and resid 173 and name HN) (segid " A" and resid 174 and name HN) 2.575 0.829 0.829 weight 1.000 ! spec=15N, no=426, id=356, vol=1.569500e+01
assign (segid " A" and resid 174 and name HN) (segid " A" and resid 173 and name HB) 2.593 0.841 0.841 weight 1.000 ! spec=15N, no=429, id=357, vol=1.504760e+01
assign (segid " A" and resid 174 and name HN) (segid " A" and resid 175 and name HN) 2.750 0.945 0.945 weight 1.000 ! spec=15N, no=437, id=364, vol=1.058130e+01
assign (segid " A" and resid 176 and name HN) (segid " A" and resid 176 and name HA) 2.741 0.939 0.939 weight 1.000 ! spec=15N, no=442, id=369, vol=1.078920e+01
assign (segid " A" and resid 176 and name HN) (segid " A" and resid 177 and name HA) 3.436 1.476 1.476 weight 1.000 ! spec=15N, no=443, id=370, vol=2.779600e+00
assign (segid " A" and resid 176 and name HN) (segid " A" and resid 175 and name HA) 2.788 0.971 0.971 weight 1.000 ! spec=15N, no=444, id=371, vol=9.754200e+00
assign (segid " A" and resid 177 and name HN) (segid " A" and resid 178 and name HN) 2.619 0.857 0.857 weight 1.000 ! spec=15N, no=450, id=377, vol=1.419650e+01
assign (segid " A" and resid 177 and name HN) (segid " A" and resid 177 and name HA) 2.636 0.869 0.869 weight 1.000 ! spec=15N, no=451, id=378, vol=1.363130e+01
assign (segid " A" and resid 177 and name HN) (segid " A" and resid 178 and name HN) 2.502 0.783 0.783 weight 1.000 ! spec=15N, no=458, id=385, vol=1.864190e+01
assign (segid " A" and resid 178 and name HN) (segid " A" and resid 178 and name HA) 2.676 0.895 0.895 weight 1.000 ! spec=15N, no=460, id=386, vol=1.245890e+01
assign (segid " A" and resid 178 and name HN) (segid " A" and resid 177 and name HA) 3.086 1.191 1.191 weight 1.000 ! spec=15N, no=461, id=387, vol=5.295900e+00
assign (segid " A" and resid 178 and name HN) (segid " A" and resid 175 and name HA) 3.017 1.137 1.137 weight 1.000 ! spec=15N, no=462, id=388, vol=6.073100e+00
assign (segid " A" and resid 179 and name HN) (segid " A" and resid 179 and name HA) 2.243 0.629 0.629 weight 1.000 ! spec=15N, no=467, id=393, vol=3.591260e+01
assign (segid " A" and resid 181 and name HN) (segid " A" and resid 181 and name HA) 2.530 0.800 0.800 weight 1.000 ! spec=15N, no=471, id=397, vol=1.746170e+01
assign (segid " A" and resid 183 and name HN) (segid " A" and resid 181 and name HA) 2.665 0.888 0.888 weight 1.000 ! spec=15N, no=474, id=400, vol=1.276600e+01
assign (segid " A" and resid 183 and name HN) (segid " A" and resid 182 and name HA) 2.946 1.085 1.085 weight 1.000 ! spec=15N, no=475, id=401, vol=7.007100e+00
assign (segid " A" and resid 183 and name HN) (segid " A" and resid 183 and name HA) 2.809 0.986 0.986 weight 1.000 ! spec=15N, no=480, id=406, vol=9.323300e+00
assign (segid " A" and resid 185 and name HN) (segid " A" and resid 184 and name HA) 2.860 1.022 1.022 weight 1.000 ! spec=15N, no=485, id=408, vol=8.364700e+00
assign (segid " A" and resid 186 and name HN) (segid " A" and resid 107 and name HA) 3.701 1.712 1.712 weight 1.000 ! spec=15N, no=490, id=412, vol=1.780900e+00
assign (segid " A" and resid 107 and name HA) (segid " A" and resid 107 and name HB) 2.551 0.813 0.813 weight 1.000 ! spec=C13H, no=3, id=1200, vol=2.412000e-01
assign (segid " A" and resid 108 and name HN) (segid " A" and resid 107 and name HA) 2.630 0.864 0.864 weight 1.000 ! spec=C13H, no=4, id=1201, vol=2.009000e-01
assign (segid " A" and resid 107 and name HB) (segid " A" and resid 107 and name HN) 2.841 1.009 1.009 weight 1.000 ! spec=C13H, no=6, id=1203, vol=1.262000e-01
assign (segid " A" and resid 111 and name HN) (segid " A" and resid 110 and name HA) 2.429 0.738 0.738 weight 1.000 ! spec=C13H, no=16, id=1211, vol=3.231000e-01
assign (segid " A" and resid 111 and name HN) (segid " A" and resid 111 and name HA) 2.965 1.099 1.099 weight 1.000 ! spec=C13H, no=36, id=1230, vol=9.770000e-02
assign (segid " A" and resid 112 and name HN) (segid " A" and resid 111 and name HA) 2.409 0.725 0.725 weight 1.000 ! spec=C13H, no=37, id=1231, vol=3.402000e-01
assign (segid " A" and resid 116 and name HN) (segid " A" and resid 115 and name HA) 2.252 0.634 0.634 weight 1.000 ! spec=C13H, no=47, id=1240, vol=5.095000e-01
assign (segid " A" and resid 115 and name HA) (segid " A" and resid 115 and name HN) 2.988 1.116 1.116 weight 1.000 ! spec=C13H, no=48, id=1241, vol=9.340000e-02
assign (segid " A" and resid 116 and name HN) (segid " A" and resid 116 and name HB) 2.644 0.874 0.874 weight 1.000 ! spec=C13H, no=55, id=1248, vol=1.943000e-01
assign (segid " A" and resid 117 and name HA) (segid " A" and resid 117 and name HN) 3.092 1.195 1.195 weight 1.000 ! spec=C13H, no=63, id=1256, vol=7.600000e-02
assign (segid " A" and resid 118 and name HA) (segid " A" and resid 119 and name HN) 3.033 1.150 1.150 weight 1.000 ! spec=C13H, no=69, id=1262, vol=8.530000e-02
assign (segid " A" and resid 121 and name HN) (segid " A" and resid 120 and name HA) 2.399 0.720 0.720 weight 1.000 ! spec=C13H, no=85, id=1276, vol=3.483000e-01
assign (segid " A" and resid 121 and name HB) (segid " A" and resid 161 and name HN) 3.208 1.287 1.287 weight 1.000 ! spec=C13H, no=96, id=1287, vol=6.090000e-02
assign (segid " A" and resid 123 and name HN) (segid " A" and resid 122 and name HA) 2.425 0.735 0.735 weight 1.000 ! spec=C13H, no=104, id=1295, vol=3.268000e-01
assign (segid " A" and resid 122 and name HA) (segid " A" and resid 122 and name HB) 2.820 0.994 0.994 weight 1.000 ! spec=C13H, no=107, id=1298, vol=1.321000e-01
assign (segid " A" and resid 122 and name HN) (segid " A" and resid 122 and name HB) 2.645 0.875 0.875 weight 1.000 ! spec=C13H, no=108, id=1299, vol=1.939000e-01
assign (segid " A" and resid 122 and name HA) (segid " A" and resid 122 and name HB) 2.974 1.106 1.106 weight 1.000 ! spec=C13H, no=110, id=1301, vol=9.600000e-02
assign (segid " A" and resid 123 and name HN) (segid " A" and resid 123 and name HB) 2.841 1.009 1.009 weight 1.000 ! spec=C13H, no=123, id=1314, vol=1.262000e-01
assign (segid " A" and resid 125 and name HN) (segid " A" and resid 124 and name HA) 2.270 0.644 0.644 weight 1.000 ! spec=C13H, no=124, id=1315, vol=4.855000e-01
assign (segid " A" and resid 124 and name HA) (segid " A" and resid 157 and name HA) 2.593 0.841 0.841 weight 1.000 ! spec=C13H, no=125, id=1316, vol=2.183000e-01
assign (segid " A" and resid 126 and name HN) (segid " A" and resid 125 and name HA) 2.378 0.707 0.707 weight 1.000 ! spec=C13H, no=137, id=1328, vol=3.673000e-01
assign (segid " A" and resid 125 and name HA) (segid " A" and resid 154 and name HB) 2.635 0.868 0.868 weight 1.000 ! spec=C13H, no=138, id=1329, vol=1.983000e-01
assign (segid " A" and resid 125 and name HA) (segid " A" and resid 154 and name HN) 3.194 1.275 1.275 weight 1.000 ! spec=C13H, no=140, id=1331, vol=6.260000e-02
assign (segid " A" and resid 128 and name HB) (segid " A" and resid 130 and name HG) 2.914 1.061 1.061 weight 1.000 ! spec=C13H, no=169, id=1349, vol=1.086000e-01
assign (segid " A" and resid 131 and name HN) (segid " A" and resid 130 and name HA) 2.422 0.733 0.733 weight 1.000 ! spec=C13H, no=170, id=1350, vol=3.294000e-01
assign (segid " A" and resid 178 and name HN) (segid " A" and resid 178 and name HA) 2.797 0.978 0.978 weight 1.000 ! spec=C13H, no=171, id=1351, vol=1.388000e-01
assign (segid " A" and resid 130 and name HA) (segid " A" and resid 130 and name HN) 2.751 0.946 0.946 weight 1.000 ! spec=C13H, no=172, id=1352, vol=1.534000e-01
assign (segid " A" and resid 132 and name HA) (segid " A" and resid 152 and name HB) 2.725 0.928 0.928 weight 1.000 ! spec=C13H, no=186, id=1363, vol=1.622000e-01
assign (segid " A" and resid 137 and name HN) (segid " A" and resid 134 and name HA) 2.539 0.806 0.806 weight 1.000 ! spec=C13H, no=198, id=1375, vol=2.480000e-01
assign (segid " A" and resid 135 and name HB) (segid " A" and resid 135 and name HA) 2.726 0.929 0.929 weight 1.000 ! spec=C13H, no=212, id=1383, vol=1.617000e-01
assign (segid " A" and resid 135 and name HN) (segid " A" and resid 135 and name HB) 3.003 1.128 1.128 weight 1.000 ! spec=C13H, no=215, id=1386, vol=9.050000e-02
assign (segid " A" and resid 135 and name HN) (segid " A" and resid 135 and name HA) 2.775 0.962 0.962 weight 1.000 ! spec=C13H, no=217, id=1388, vol=1.455000e-01
assign (segid " A" and resid 135 and name HB) (segid " A" and resid 135 and name HA) 2.789 0.973 0.973 weight 1.000 ! spec=C13H, no=219, id=1389, vol=1.410000e-01
assign (segid " A" and resid 139 and name HN) (segid " A" and resid 139 and name HB1) 2.708 0.917 0.917 weight 1.000 ! spec=C13H, no=237, id=1406, vol=1.683000e-01
assign (segid " A" and resid 139 and name HN) (segid " A" and resid 139 and name HA) 2.663 0.886 0.886 weight 1.000 ! spec=C13H, no=238, id=1407, vol=1.864000e-01
assign (segid " A" and resid 140 and name HN) (segid " A" and resid 140 and name HA) 2.591 0.839 0.839 weight 1.000 ! spec=C13H, no=250, id=1418, vol=2.193000e-01
assign (segid " A" and resid 141 and name HG) (segid " A" and resid 171 and name HA) 2.399 0.720 0.720 weight 1.000 ! spec=C13H, no=259, id=1427, vol=3.483000e-01
assign (segid " A" and resid 141 and name HG) (segid " A" and resid 171 and name HN) 3.371 1.420 1.420 weight 1.000 ! spec=C13H, no=263, id=1430, vol=4.530000e-02
assign (segid " A" and resid 142 and name HN) (segid " A" and resid 142 and name HA) 2.367 0.700 0.700 weight 1.000 ! spec=C13H, no=270, id=1435, vol=3.778000e-01
assign (segid " A" and resid 143 and name HN) (segid " A" and resid 142 and name HA) 2.830 1.001 1.001 weight 1.000 ! spec=C13H, no=271, id=1436, vol=1.292000e-01
assign (segid " A" and resid 143 and name HN) (segid " A" and resid 143 and name HA) 3.011 1.133 1.133 weight 1.000 ! spec=C13H, no=285, id=1447, vol=8.920000e-02
assign (segid " A" and resid 143 and name HB) (segid " A" and resid 138 and name HA) 2.981 1.111 1.111 weight 1.000 ! spec=C13H, no=286, id=1448, vol=9.470000e-02
assign (segid " A" and resid 143 and name HN) (segid " A" and resid 143 and name HB) 2.694 0.907 0.907 weight 1.000 ! spec=C13H, no=289, id=1451, vol=1.737000e-01
assign (segid " A" and resid 145 and name HN) (segid " A" and resid 144 and name HA) 2.134 0.569 0.569 weight 1.000 ! spec=C13H, no=291, id=1453, vol=7.039000e-01
assign (segid " A" and resid 146 and name HN) (segid " A" and resid 145 and name HA) 2.435 0.741 0.741 weight 1.000 ! spec=C13H, no=305, id=1457, vol=3.187000e-01
assign (segid " A" and resid 145 and name HN) (segid " A" and resid 145 and name HA) 2.911 1.059 1.059 weight 1.000 ! spec=C13H, no=306, id=1458, vol=1.091000e-01
assign (segid " A" and resid 155 and name HN) (segid " A" and resid 145 and name HA) 2.821 0.995 0.995 weight 1.000 ! spec=C13H, no=307, id=1459, vol=1.318000e-01
assign (segid " A" and resid 145 and name HA) (segid " A" and resid 145 and name HB) 2.470 0.763 0.763 weight 1.000 ! spec=C13H, no=308, id=1460, vol=2.923000e-01
assign (segid " A" and resid 147 and name HN) (segid " A" and resid 146 and name HA) 2.325 0.676 0.676 weight 1.000 ! spec=C13H, no=311, id=1463, vol=4.200000e-01
assign (segid " A" and resid 148 and name HN) (segid " A" and resid 147 and name HA) 2.476 0.766 0.766 weight 1.000 ! spec=C13H, no=326, id=1478, vol=2.885000e-01
assign (segid " A" and resid 150 and name HN) (segid " A" and resid 149 and name HA) 2.898 1.050 1.050 weight 1.000 ! spec=C13H, no=332, id=1483, vol=1.122000e-01
assign (segid " A" and resid 152 and name HN) (segid " A" and resid 151 and name HA) 2.507 0.786 0.786 weight 1.000 ! spec=C13H, no=343, id=1485, vol=2.676000e-01
assign (segid " A" and resid 151 and name HB) (segid " A" and resid 151 and name HA) 2.400 0.720 0.720 weight 1.000 ! spec=C13H, no=344, id=1486, vol=3.477000e-01
assign (segid " A" and resid 151 and name HB) (segid " A" and resid 151 and name HA) 2.806 0.984 0.984 weight 1.000 ! spec=C13H, no=347, id=1489, vol=1.360000e-01
assign (segid " A" and resid 151 and name HB) (segid " A" and resid 151 and name HG1) 2.888 1.042 1.042 weight 1.000 ! spec=C13H, no=348, id=1490, vol=1.146000e-01
assign (segid " A" and resid 152 and name HN) (segid " A" and resid 151 and name HB) 2.772 0.961 0.961 weight 1.000 ! spec=C13H, no=349, id=1491, vol=1.463000e-01
assign (segid " A" and resid 152 and name HN) (segid " A" and resid 152 and name HB) 2.959 1.094 1.094 weight 1.000 ! spec=C13H, no=381, id=1522, vol=9.900000e-02
assign (segid " A" and resid 155 and name HN) (segid " A" and resid 154 and name HA) 2.548 0.811 0.811 weight 1.000 ! spec=C13H, no=398, id=1537, vol=2.429000e-01
assign (segid " A" and resid 145 and name HA) (segid " A" and resid 154 and name HA) 2.871 1.030 1.030 weight 1.000 ! spec=C13H, no=399, id=1538, vol=1.186000e-01
assign (segid " A" and resid 156 and name HN) (segid " A" and resid 155 and name HB) 2.856 1.020 1.020 weight 1.000 ! spec=C13H, no=425, id=1563, vol=1.223000e-01
assign (segid " A" and resid 155 and name HN) (segid " A" and resid 155 and name HB) 2.708 0.917 0.917 weight 1.000 ! spec=C13H, no=426, id=1564, vol=1.685000e-01
assign (segid " A" and resid 155 and name HB) (segid " A" and resid 155 and name HA) 2.774 0.962 0.962 weight 1.000 ! spec=C13H, no=427, id=1565, vol=1.458000e-01
assign (segid " A" and resid 156 and name HA) (segid " A" and resid 157 and name HN) 2.289 0.655 0.655 weight 1.000 ! spec=C13H, no=429, id=1567, vol=4.613000e-01
assign (segid " A" and resid 158 and name HN) (segid " A" and resid 158 and name HA) 3.013 1.135 1.135 weight 1.000 ! spec=C13H, no=453, id=1588, vol=8.880000e-02
assign (segid " A" and resid 158 and name HN) (segid " A" and resid 158 and name HB) 2.860 1.023 1.023 weight 1.000 ! spec=C13H, no=456, id=1590, vol=1.213000e-01
assign (segid " A" and resid 167 and name HN) (segid " A" and resid 166 and name HA) 2.421 0.733 0.733 weight 1.000 ! spec=C13H, no=460, id=1594, vol=3.299000e-01
assign (segid " A" and resid 160 and name HB) (segid " A" and resid 160 and name HA) 2.651 0.879 0.879 weight 1.000 ! spec=C13H, no=472, id=1605, vol=1.912000e-01
assign (segid " A" and resid 160 and name HB) (segid " A" and resid 122 and name HA) 3.156 1.245 1.245 weight 1.000 ! spec=C13H, no=473, id=1606, vol=6.720000e-02
assign (segid " A" and resid 161 and name HG) (segid " A" and resid 161 and name HA) 3.068 1.177 1.177 weight 1.000 ! spec=C13H, no=481, id=1613, vol=7.960000e-02
assign (segid " A" and resid 162 and name HN) (segid " A" and resid 161 and name HA) 2.435 0.741 0.741 weight 1.000 ! spec=C13H, no=486, id=1617, vol=3.190000e-01
assign (segid " A" and resid 166 and name HN) (segid " A" and resid 165 and name HA) 2.192 0.601 0.601 weight 1.000 ! spec=C13H, no=507, id=1634, vol=5.982000e-01
assign (segid " A" and resid 167 and name HB) (segid " A" and resid 168 and name HN) 3.468 1.503 1.503 weight 1.000 ! spec=C13H, no=523, id=1650, vol=3.820000e-02
assign (segid " A" and resid 172 and name HA) (segid " A" and resid 172 and name HN) 2.800 0.980 0.980 weight 1.000 ! spec=C13H, no=558, id=1681, vol=1.377000e-01
assign (segid " A" and resid 173 and name HN) (segid " A" and resid 173 and name HA) 2.685 0.901 0.901 weight 1.000 ! spec=C13H, no=572, id=1686, vol=1.771000e-01
assign (segid " A" and resid 177 and name HN) (segid " A" and resid 177 and name HA) 2.516 0.792 0.792 weight 1.000 ! spec=C13H, no=619, id=1730, vol=2.616000e-01
assign (segid " A" and resid 178 and name HG) (segid " A" and resid 175 and name HA) 2.724 0.927 0.927 weight 1.000 ! spec=C13H, no=631, id=1742, vol=1.627000e-01
assign (segid " A" and resid 178 and name HG) (segid " A" and resid 123 and name HG12) 2.074 0.538 0.538 weight 1.000 ! spec=C13H, no=635, id=1746, vol=8.347000e-01
assign (segid " A" and resid 179 and name HA) (segid " A" and resid 180 and name HN) 2.674 0.893 0.893 weight 1.000 ! spec=C13H, no=639, id=1750, vol=1.819000e-01
assign (segid " A" and resid 179 and name HN) (segid " A" and resid 179 and name HA) 2.332 0.680 0.680 weight 1.000 ! spec=C13H, no=640, id=1751, vol=4.127000e-01
assign (segid " A" and resid 180 and name HB) (segid " A" and resid 180 and name HA) 3.127 1.223 1.223 weight 1.000 ! spec=C13H, no=651, id=1760, vol=7.100000e-02
assign (segid " A" and resid 180 and name HB) (segid " A" and resid 180 and name HN) 2.852 1.017 1.017 weight 1.000 ! spec=C13H, no=652, id=1761, vol=1.234000e-01
assign (segid " A" and resid 183 and name HN) (segid " A" and resid 182 and name HA) 2.979 1.109 1.109 weight 1.000 ! spec=C13H, no=653, id=1762, vol=9.510000e-02
assign (segid " A" and resid 183 and name HN) (segid " A" and resid 183 and name HA) 2.838 1.007 1.007 weight 1.000 ! spec=C13H, no=663, id=1770, vol=1.271000e-01
assign (segid " A" and resid 185 and name HA) (segid " A" and resid 186 and name HN) 2.684 0.901 0.901 weight 1.000 ! spec=C13H, no=665, id=1772, vol=1.775000e-01
assign (segid " A" and resid 107 and name HA) (segid " A" and resid 107 and name HB) 2.412 0.727 0.727 weight 1.000 ! spec=C13HC, no=4, id=471, vol=2.157000e-01
assign (segid " A" and resid 107 and name HA) (segid " A" and resid 107 and name HB) 2.652 0.879 0.879 weight 1.000 ! spec=C13HC, no=7, id=474, vol=1.222000e-01
assign (segid " A" and resid 116 and name HB) (segid " A" and resid 116 and name HA) 2.947 1.086 1.086 weight 1.000 ! spec=C13HC, no=75, id=537, vol=6.490000e-02
assign (segid " A" and resid 121 and name HA) (segid " A" and resid 121 and name HB) 2.726 0.929 0.929 weight 1.000 ! spec=C13HC, no=118, id=574, vol=1.036000e-01
assign (segid " A" and resid 122 and name HA) (segid " A" and resid 122 and name HB) 2.788 0.971 0.971 weight 1.000 ! spec=C13HC, no=131, id=586, vol=9.060000e-02
assign (segid " A" and resid 122 and name HA) (segid " A" and resid 159 and name HA) 2.747 0.943 0.943 weight 1.000 ! spec=C13HC, no=133, id=588, vol=9.900000e-02
assign (segid " A" and resid 122 and name HB) (segid " A" and resid 121 and name HA) 3.083 1.188 1.188 weight 1.000 ! spec=C13HC, no=142, id=596, vol=4.950000e-02
assign (segid " A" and resid 122 and name HA) (segid " A" and resid 122 and name HB) 3.088 1.192 1.192 weight 1.000 ! spec=C13HC, no=143, id=597, vol=4.900000e-02
assign (segid " A" and resid 123 and name HA) (segid " A" and resid 123 and name HB) 2.947 1.086 1.086 weight 1.000 ! spec=C13HC, no=163, id=616, vol=6.490000e-02
assign (segid " A" and resid 123 and name HB) (segid " A" and resid 158 and name HB) 2.690 0.904 0.904 weight 1.000 ! spec=C13HC, no=168, id=621, vol=1.123000e-01
assign (segid " A" and resid 124 and name HA) (segid " A" and resid 157 and name HA) 2.618 0.857 0.857 weight 1.000 ! spec=C13HC, no=169, id=622, vol=1.320000e-01
assign (segid " A" and resid 125 and name HA) (segid " A" and resid 154 and name HB) 2.630 0.864 0.864 weight 1.000 ! spec=C13HC, no=182, id=635, vol=1.285000e-01
assign (segid " A" and resid 128 and name HA) (segid " A" and resid 128 and name HB) 2.556 0.817 0.817 weight 1.000 ! spec=C13HC, no=195, id=647, vol=1.524000e-01
assign (segid " A" and resid 130 and name HA) (segid " A" and resid 130 and name HG) 2.387 0.712 0.712 weight 1.000 ! spec=C13HC, no=223, id=666, vol=2.296000e-01
assign (segid " A" and resid 136 and name HA) (segid " A" and resid 139 and name HB1) 2.352 0.691 0.691 weight 1.000 ! spec=C13HC, no=276, id=707, vol=2.511000e-01
assign (segid " A" and resid 136 and name HA) (segid " A" and resid 139 and name HB1) 2.927 1.071 1.071 weight 1.000 ! spec=C13HC, no=294, id=724, vol=6.760000e-02
assign (segid " A" and resid 141 and name HG) (segid " A" and resid 171 and name HA) 2.558 0.818 0.818 weight 1.000 ! spec=C13HC, no=312, id=742, vol=1.517000e-01
assign (segid " A" and resid 143 and name HA) (segid " A" and resid 144 and name HD1) 2.018 0.509 0.509 weight 1.000 ! spec=C13HC, no=338, id=767, vol=6.302000e-01
assign (segid " A" and resid 143 and name HA) (segid " A" and resid 143 and name HB) 2.991 1.118 1.118 weight 1.000 ! spec=C13HC, no=341, id=770, vol=5.940000e-02
assign (segid " A" and resid 143 and name HA) (segid " A" and resid 143 and name HB) 3.040 1.155 1.155 weight 1.000 ! spec=C13HC, no=342, id=771, vol=5.390000e-02
assign (segid " A" and resid 145 and name HA) (segid " A" and resid 145 and name HB) 2.478 0.768 0.768 weight 1.000 ! spec=C13HC, no=367, id=787, vol=1.835000e-01
assign (segid " A" and resid 145 and name HA) (segid " A" and resid 154 and name HA) 2.579 0.831 0.831 weight 1.000 ! spec=C13HC, no=368, id=788, vol=1.446000e-01
assign (segid " A" and resid 147 and name HB) (segid " A" and resid 147 and name HA) 3.183 1.266 1.266 weight 1.000 ! spec=C13HC, no=404, id=820, vol=4.090000e-02
assign (segid " A" and resid 147 and name HB) (segid " A" and resid 147 and name HA) 2.842 1.009 1.009 weight 1.000 ! spec=C13HC, no=411, id=827, vol=8.070000e-02
assign (segid " A" and resid 151 and name HB) (segid " A" and resid 151 and name HA) 2.821 0.995 0.995 weight 1.000 ! spec=C13HC, no=444, id=853, vol=8.440000e-02
assign (segid " A" and resid 152 and name HB) (segid " A" and resid 152 and name HA) 3.317 1.376 1.376 weight 1.000 ! spec=C13HC, no=464, id=871, vol=3.190000e-02
assign (segid " A" and resid 145 and name HA) (segid " A" and resid 154 and name HA) 2.837 1.006 1.006 weight 1.000 ! spec=C13HC, no=476, id=882, vol=8.160000e-02
assign (segid " A" and resid 155 and name HB) (segid " A" and resid 155 and name HA) 2.778 0.965 0.965 weight 1.000 ! spec=C13HC, no=495, id=900, vol=9.250000e-02
assign (segid " A" and resid 123 and name HB) (segid " A" and resid 158 and name HB) 2.632 0.866 0.866 weight 1.000 ! spec=C13HC, no=534, id=938, vol=1.279000e-01
assign (segid " A" and resid 158 and name HA) (segid " A" and resid 158 and name HB) 2.898 1.050 1.050 weight 1.000 ! spec=C13HC, no=542, id=944, vol=7.170000e-02
assign (segid " A" and resid 160 and name HB) (segid " A" and resid 160 and name HA) 2.549 0.812 0.812 weight 1.000 ! spec=C13HC, no=551, id=953, vol=1.550000e-01
assign (segid " A" and resid 161 and name HG) (segid " A" and resid 121 and name HB) 2.869 1.029 1.029 weight 1.000 ! spec=C13HC, no=574, id=976, vol=7.630000e-02
assign (segid " A" and resid 161 and name HG) (segid " A" and resid 161 and name HA) 3.355 1.407 1.407 weight 1.000 ! spec=C13HC, no=580, id=982, vol=2.980000e-02
assign (segid " A" and resid 160 and name HB) (segid " A" and resid 160 and name HA) 2.333 0.680 0.680 weight 1.000 ! spec=C13HC, no=586, id=986, vol=2.637000e-01
assign (segid " A" and resid 162 and name HA) (segid " A" and resid 120 and name HA) 2.683 0.900 0.900 weight 1.000 ! spec=C13HC, no=609, id=1008, vol=1.139000e-01
assign (segid " A" and resid 173 and name HB) (segid " A" and resid 173 and name HA) 2.983 1.112 1.112 weight 1.000 ! spec=C13HC, no=684, id=1074, vol=6.030000e-02
assign (segid " A" and resid 175 and name HA) (segid " A" and resid 175 and name HG) 2.385 0.711 0.711 weight 1.000 ! spec=C13HC, no=720, id=1109, vol=2.311000e-01
assign (segid " A" and resid 175 and name HA) (segid " A" and resid 175 and name HG) 2.929 1.072 1.072 weight 1.000 ! spec=C13HC, no=726, id=1115, vol=6.730000e-02
assign (segid " A" and resid 178 and name HG) (segid " A" and resid 175 and name HA) 2.781 0.967 0.967 weight 1.000 ! spec=C13HC, no=752, id=1138, vol=9.180000e-02
assign (segid " A" and resid 180 and name HB) (segid " A" and resid 180 and name HA) 3.066 1.175 1.175 weight 1.000 ! spec=C13HC, no=769, id=1153, vol=5.120000e-02
assign (segid " A" and resid 180 and name HB) (segid " A" and resid 180 and name HA) 2.755 0.949 0.949 weight 1.000 ! spec=C13HC, no=789, id=1172, vol=9.720000e-02
assign (segid " A" and resid 185 and name HA) (segid " A" and resid 107 and name HA) 2.397 0.718 0.718 weight 1.000 ! spec=C13HC, no=810, id=1192, vol=2.239000e-01
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