NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
11178 1r2u 5975 cing 1-original 1 XPLOR/CNS distance NOE ambi


assign (resid 4 and name HN) (resid 3 and name HN) 	 2.786 1.086 1.086
assign (resid 3 and name HA) (resid 3 and name HN) 	 2.436 0.736 0.736
assign ((resid 3 and name HB1) or (resid 3 and name HB2)) (resid 3 and name HN) 	 2.308 0.608 1.108
assign (resid 5 and name HN) (resid 4 and name HN) 	 2.348 0.648 0.648
assign (resid 3 and name HA) (resid 4 and name HN) 	 2.550 0.850 0.950
assign (resid 4 and name HA) (resid 4 and name HN) 	 2.413 0.713 0.713
assign ((resid 3 and name HB1) or (resid 3 and name HB2)) (resid 4 and name HN) 	 2.546 0.846 1.846
assign (resid 4 and name HB) (resid 4 and name HN) 	 2.263 0.563 1.463
assign ((resid 4 and name HG11) or (resid 4 and name HG12)) (resid 4 and name HN) 	 2.408 0.708 1.108
assign (resid 4 and name HG2*) (resid 4 and name HN) 	 2.400 0.700 0.700
assign (resid 4 and name HD*) (resid 4 and name HN) 	 2.408 0.708 2.592
assign (resid 6 and name HN) (resid 5 and name HN) 	 2.309 0.609 0.609
assign (resid 5 and name HD*) (resid 5 and name HN) 	 2.410 0.710 1.710
assign (resid 5 and name HE*) (resid 5 and name HN) 	 2.960 1.260 2.260
assign (resid 5 and name HA) (resid 5 and name HN) 	 2.412 0.712 0.712
assign (resid 3 and name HA) (resid 5 and name HN) 	 2.950 1.250 1.250
assign (resid 5 and name HB2) (resid 5 and name HN) 	 2.493 0.793 1.093
assign (resid 5 and name HB1) (resid 5 and name HN) 	 2.493 0.793 1.093
assign (resid 4 and name HB) (resid 5 and name HN) 	 2.410 0.710 1.910
assign ((resid 4 and name HG12) or (resid 4 and name HG11)) (resid 5 and name HN) 	 2.609 0.909 0.909
assign (resid 4 and name HA) (resid 5 and name HN) 	 2.595 0.895 0.895
assign (resid 8 and name HN) (resid 6 and name HN) 	 2.826 1.126 1.126
assign (resid 5 and name HA) (resid 6 and name HN) 	 2.768 1.068 1.068
assign (resid 3 and name HA) (resid 6 and name HN) 	 2.710 1.010 1.010
assign (resid 6 and name HA) (resid 6 and name HN) 	 2.410 0.710 0.710
assign (resid 5 and name HB1) (resid 6 and name HN) 	 2.841 1.141 1.341
assign (resid 6 and name HB*) (resid 6 and name HN) 	 2.227 0.527 0.727
assign ((resid 4 and name HG12) or (resid 4 and name HG11)) (resid 6 and name HN) 	 2.954 1.254 2.146
assign (resid 5 and name HD*) (resid 6 and name HN) 	 3.011 1.312 1.812
assign (resid 5 and name HB2) (resid 6 and name HN) 	 2.841 1.141 1.341
assign ((resid 6 and name HG2) or (resid 6 and name HG1)) (resid 6 and name HN) 	 2.498 0.797 0.997
assign ((resid 4 and name HG2*) or (resid 4 and name HD1*)) (resid 6 and name HN) 	 2.495 0.795 3.015
assign ((resid 6 and name HE1) or (resid 6 and name HE2)) (resid 6 and name HN) 	 2.495 0.795 2.515
assign (resid 8 and name HN) (resid 7 and name HN) 	 2.446 0.746 0.746
assign (resid 5 and name HN) (resid 7 and name HN) 	 2.840 1.140 1.140
assign (resid 7 and name HA) (resid 7 and name HN) 	 2.408 0.708 0.708
assign (resid 6 and name HB*) (resid 7 and name HN) 	 2.402 0.702 1.102
assign (resid 7 and name HB*) (resid 7 and name HN) 	 2.147 0.447 0.447
assign (resid 5 and name HA) (resid 7 and name HN) 	 3.105 1.405 1.405
assign (resid 3 and name HA) (resid 7 and name HN) 	 3.133 1.433 1.433
assign (resid 6 and name HA) (resid 7 and name HN) 	 2.720 1.020 1.020
assign (resid 4 and name HA) (resid 7 and name HN) 	 2.865 1.165 1.165
assign (resid 6 and name HD*) (resid 7 and name HN) 	 3.127 1.427 1.627
assign ((resid 6 and name HG2) or (resid 6 and name HG1)) (resid 7 and name HN) 	 2.772 1.072 1.372
assign (resid 9 and name HN) (resid 8 and name HN) 	 2.416 0.716 0.716
assign (resid 5 and name HA) (resid 8 and name HN) 	 2.721 1.021 1.021
assign (resid 8 and name HA) (resid 8 and name HN) 	 2.406 0.706 0.706
assign (resid 9 and name HB) (resid 8 and name HN) 	 3.087 1.387 1.387
assign (resid 8 and name HB*) (resid 8 and name HN) 	 2.213 0.513 0.513
assign (resid 7 and name HB*) (resid 8 and name HN) 	 2.412 0.712 1.012
assign ((resid 82 and name HG1*) or (resid 82 and name HG2*)) (resid 8 and name HN) 	 2.913 1.213 2.087
assign (resid 6 and name HA) (resid 9 and name HN) 	 2.652 0.952 0.952
assign (resid 9 and name HA) (resid 9 and name HN) 	 2.411 0.711 0.711
assign (resid 9 and name HB) (resid 9 and name HN) 	 2.169 0.469 0.469
assign (resid 8 and name HB*) (resid 9 and name HN) 	 2.364 0.664 1.164
assign (resid 9 and name HG2*) (resid 9 and name HN) 	 2.629 0.929 1.829
assign (resid 9 and name HG1*) (resid 9 and name HN) 	 2.629 0.929 1.829
assign (resid 10 and name HN) (resid 9 and name HN) 	 2.380 0.680 0.680
assign (resid 8 and name HN) (resid 9 and name HN) 	 2.416 0.716 0.716
assign (resid 11 and name HN) (resid 9 and name HN) 	 3.068 1.368 1.368
assign (resid 8 and name HA) (resid 9 and name HN) 	 2.635 0.935 0.935
assign (resid 9 and name HN) (resid 10 and name HN) 	 2.380 0.680 0.680
assign (resid 8 and name HN) (resid 10 and name HN) 	 2.757 1.057 2.057
assign (resid 11 and name HN) (resid 10 and name HN) 	 2.374 0.674 0.674
assign (resid 10 and name HA) (resid 10 and name HN) 	 2.410 0.710 0.710
assign (resid 9 and name HA) (resid 10 and name HN) 	 2.777 1.077 1.077
assign ((resid 10 and name HG2) or (resid 10 and name HG1)) (resid 10 and name HN) 	 2.472 0.772 0.772
assign (resid 10 and name HB*) (resid 10 and name HN) 	 2.191 0.491 0.491
assign ((resid 9 and name HG1*) or (resid 9 and name HG2*)) (resid 10 and name HN) 	 2.574 0.874 1.174
assign (resid 9 and name HN) (resid 11 and name HN) 	 3.068 1.368 1.368
assign ((resid 11 and name HE22) or (resid 11 and name HE21)) (resid 11 and name HN) 	 2.989 1.289 1.489
assign (resid 11 and name HA) (resid 11 and name HN) 	 2.409 0.709 0.709
assign (resid 8 and name HA) (resid 11 and name HN) 	 2.562 0.862 0.862
assign (resid 10 and name HA) (resid 11 and name HN) 	 2.625 0.925 0.925
assign (resid 9 and name HA) (resid 11 and name HN) 	 2.831 1.131 1.131
assign ((resid 11 and name HG2) or (resid 11 and name HG1)) (resid 11 and name HN) 	 2.394 0.694 0.694
assign (resid 11 and name HB1) (resid 11 and name HN) 	 2.473 0.773 1.173
assign (resid 10 and name HB*) (resid 11 and name HN) 	 2.399 0.699 1.999
assign (resid 11 and name HB2) (resid 11 and name HN) 	 2.473 0.773 1.173
assign ((resid 12 and name HD1*) or (resid 12 and name HD2*)) (resid 11 and name HN) 	 2.844 1.144 2.156
assign (resid 13 and name HN) (resid 12 and name HN) 	 3.100 1.400 1.500
assign (resid 12 and name HA) (resid 12 and name HN) 	 2.408 0.708 0.708
assign (resid 11 and name HA) (resid 12 and name HN) 	 2.587 0.887 0.887
assign (resid 10 and name HA) (resid 12 and name HN) 	 2.855 1.155 2.155
assign (resid 9 and name HA) (resid 12 and name HN) 	 2.617 0.917 0.917
assign ((resid 11 and name HG1) or (resid 11 and name HG2)) (resid 12 and name HN) 	 2.968 1.268 1.468
assign (resid 11 and name HB1) (resid 12 and name HN) 	 2.770 1.070 1.270
assign (resid 12 and name HG) (resid 12 and name HN) 	 2.168 0.468 0.468
assign (resid 11 and name HB2) (resid 12 and name HN) 	 2.770 1.070 1.270
assign (resid 12 and name HB2) (resid 12 and name HN) 	 2.482 0.782 1.082
assign (resid 12 and name HB1) (resid 12 and name HN) 	 2.482 0.782 1.082
assign ((resid 12 and name HD1*) or (resid 12 and name HD2*)) (resid 12 and name HN) 	 2.493 0.793 0.893
assign (resid 15 and name HN) (resid 13 and name HN) 	 3.350 1.650 1.650
assign (resid 17 and name HN) (resid 13 and name HN) 	 3.350 1.650 1.650
assign (resid 16 and name HN) (resid 13 and name HN) 	 3.350 1.650 1.650
assign (resid 13 and name HB) (resid 13 and name HN) 	 3.350 1.650 1.650
assign (resid 12 and name HA) (resid 13 and name HN) 	 2.683 0.983 0.983
assign ((resid 12 and name HB2) or (resid 12 and name HB1)) (resid 13 and name HN) 	 3.350 1.650 1.650
assign (resid 13 and name HG2*) (resid 13 and name HN) 	 2.785 1.085 1.285
assign ((resid 12 and name HD2*) or (resid 12 and name HD1*)) (resid 13 and name HN) 	 3.350 1.650 1.650
assign (resid 15 and name HN) (resid 14 and name HN) 	 2.540 0.840 0.840
assign (resid 16 and name HN) (resid 14 and name HN) 	 3.106 1.405 1.405
assign (resid 13 and name HB) (resid 14 and name HN) 	 2.226 0.526 0.526
assign (resid 13 and name HA) (resid 14 and name HN) 	 2.173 0.473 0.473
assign (resid 14 and name HA) (resid 14 and name HN) 	 2.408 0.708 0.708
assign (resid 14 and name HB*) (resid 14 and name HN) 	 2.233 0.533 0.533
assign (resid 13 and name HG2*) (resid 14 and name HN) 	 2.691 0.991 0.991
assign (resid 16 and name HN) (resid 15 and name HN) 	 2.423 0.723 0.723
assign (resid 13 and name HG1) (resid 15 and name HN) 	 2.909 1.209 1.209
assign (resid 13 and name HB) (resid 15 and name HN) 	 2.389 0.689 0.689
assign (resid 13 and name HA) (resid 15 and name HN) 	 2.945 1.245 1.245
assign (resid 14 and name HA) (resid 15 and name HN) 	 2.780 1.080 1.080
assign (resid 15 and name HA) (resid 15 and name HN) 	 2.406 0.707 0.707
assign (resid 14 and name HB*) (resid 15 and name HN) 	 2.385 0.685 0.685
assign ((resid 15 and name HG1) or (resid 15 and name HG2)) (resid 15 and name HN) 	 2.651 0.951 0.951
assign (resid 15 and name HB2) (resid 15 and name HN) 	 2.477 0.777 1.077
assign (resid 15 and name HB1) (resid 15 and name HN) 	 2.477 0.777 1.077
assign (resid 13 and name HG2*) (resid 15 and name HN) 	 2.977 1.277 1.677
assign (resid 17 and name HN) (resid 16 and name HN) 	 2.310 0.610 0.610
assign (resid 13 and name HG1) (resid 16 and name HN) 	 2.640 0.940 0.940
assign (resid 13 and name HB) (resid 16 and name HN) 	 2.750 1.050 1.050
assign (resid 15 and name HA) (resid 16 and name HN) 	 2.686 0.986 0.986
assign (resid 16 and name HA) (resid 16 and name HN) 	 2.410 0.710 0.710
assign ((resid 16 and name HB1) or (resid 16 and name HB2)) (resid 16 and name HN) 	 2.142 0.442 1.042
assign (resid 15 and name HB2) (resid 16 and name HN) 	 2.526 0.826 1.226
assign (resid 15 and name HB1) (resid 16 and name HN) 	 2.526 0.826 1.226
assign ((resid 16 and name HG1) or (resid 16 and name HG2)) (resid 16 and name HN) 	 2.142 0.442 1.042
assign (resid 14 and name HA) (resid 17 and name HN) 	 2.618 0.918 1.318
assign (resid 17 and name HA) (resid 17 and name HN) 	 2.409 0.709 0.709
assign (resid 16 and name HA) (resid 17 and name HN) 	 2.731 1.031 1.031
assign ((resid 16 and name HB1) or (resid 16 and name HB2)) (resid 17 and name HN) 	 2.389 0.689 1.589
assign (resid 17 and name HB*) (resid 17 and name HN) 	 2.182 0.482 0.782
assign (resid 17 and name HN) ((resid 17 and name HD1) or (resid 17 and name HD2))  	 2.335 0.635 0.635
assign (resid 17 and name HG*) (resid 17 and name HN) 	 2.672 0.973 1.473
assign (resid 18 and name HB1) (resid 18 and name HN) 	 2.488 0.788 0.988
assign (resid 15 and name HA) (resid 18 and name HN) 	 2.638 0.938 0.938
assign (resid 19 and name HN) (resid 18 and name HN) 	 2.252 0.552 0.552
assign (resid 18 and name HN) ((resid 18 and name HD22) or (resid 18 and name HD21))  	 2.856 1.156 1.156
assign (resid 18 and name HA) (resid 18 and name HN) 	 2.411 0.711 0.711
assign (resid 18 and name HB2) (resid 18 and name HN) 	 2.488 0.788 0.988
assign (resid 20 and name HN) (resid 19 and name HN) 	 2.257 0.557 0.557
assign (resid 18 and name HA) (resid 19 and name HN) 	 2.799 1.099 1.099
assign (resid 19 and name HA) (resid 19 and name HN) 	 2.408 0.708 0.708
assign (resid 15 and name HA) (resid 19 and name HN) 	 3.051 1.351 1.351
assign (resid 17 and name HA) (resid 19 and name HN) 	 3.122 1.421 1.421
assign (resid 16 and name HA) (resid 19 and name HN) 	 2.692 0.992 0.992
assign (resid 18 and name HB2) (resid 19 and name HN) 	 2.669 0.969 1.369
assign (resid 18 and name HB1) (resid 19 and name HN) 	 2.669 0.969 1.369
assign (resid 19 and name HG2) (resid 19 and name HN) 	 2.742 1.042 1.242
assign (resid 19 and name HG1) (resid 19 and name HN) 	 2.742 1.042 1.242
assign (resid 19 and name HN) ((resid 19 and name HB2) or (resid 19 and name HB1))  	 2.279 0.579 0.579
assign (resid 21 and name HN) (resid 20 and name HN) 	 2.357 0.658 0.658
assign (resid 77 and name HE*) (resid 20 and name HN) 	 2.553 0.853 2.353
assign (resid 20 and name HD*) (resid 20 and name HN) 	 2.462 0.762 0.762
assign (resid 20 and name HA) (resid 20 and name HN) 	 2.412 0.712 0.712
assign (resid 17 and name HA) (resid 20 and name HN) 	 2.635 0.935 0.935
assign (resid 16 and name HA) (resid 20 and name HN) 	 2.913 1.213 1.213
assign (resid 20 and name HN) ((resid 19 and name HG1) or (resid 19 and name HG2))  	 2.953 1.253 1.353
assign (resid 20 and name HN) ((resid 19 and name HB1) or (resid 19 and name HB2))  	 2.408 0.708 1.108
assign (resid 20 and name HN) ((resid 20 and name HB1) or (resid 20 and name HB2))  	 2.408 0.708 2.592
assign (resid 19 and name HN) (resid 21 and name HN) 	 2.898 1.198 1.198
assign (resid 22 and name HN) (resid 21 and name HN) 	 2.552 0.852 0.852
assign (resid 23 and name HN) (resid 21 and name HN) 	 2.904 1.204 1.204
assign (resid 74 and name HE*) (resid 21 and name HN) 	 2.667 0.967 1.967
assign (resid 20 and name HA) (resid 21 and name HN) 	 2.836 1.136 1.136
assign (resid 18 and name HA) (resid 21 and name HN) 	 2.539 0.839 1.139
assign (resid 21 and name HA) (resid 21 and name HN) 	 2.414 0.714 0.714
assign (resid 20 and name HB*) (resid 21 and name HN) 	 2.431 0.731 1.731
assign (resid 21 and name HB2) (resid 21 and name HN) 	 2.216 0.516 0.716
assign (resid 21 and name HB1) (resid 21 and name HN) 	 2.216 0.516 0.716
assign (resid 23 and name HN) (resid 22 and name HN) 	 2.478 0.779 0.779
assign (resid 18 and name HA) (resid 22 and name HN) 	 3.202 1.502 1.502
assign (resid 22 and name HA) (resid 22 and name HN) 	 2.405 0.705 0.705
assign (resid 21 and name HA) (resid 22 and name HN) 	 3.026 1.326 1.326
assign (resid 21 and name HB2) (resid 22 and name HN) 	 2.746 1.046 1.246
assign (resid 21 and name HB1) (resid 22 and name HN) 	 2.746 1.046 1.246
assign (resid 22 and name HB*) (resid 22 and name HN) 	 2.246 0.546 0.546
assign (resid 22 and name HN) ((resid 21 and name HG1) or (resid 21 and name HG2))  	 3.271 1.571 1.571
assign (resid 25 and name HN) (resid 23 and name HN) 	 3.187 1.487 1.487
assign (resid 24 and name HN) (resid 23 and name HN) 	 2.843 1.143 1.143
assign (resid 26 and name HN) (resid 23 and name HN) 	 2.969 1.269 1.969
assign (resid 20 and name HA) (resid 23 and name HN) 	 2.837 1.137 1.137
assign (resid 23 and name HA) (resid 23 and name HN) 	 2.406 0.706 0.706
assign (resid 23 and name HB*) (resid 23 and name HN) 	 2.217 0.517 0.517
assign (resid 22 and name HB*) (resid 23 and name HN) 	 2.402 0.702 0.702
assign (resid 23 and name HN) ((resid 24 and name HB1) or (resid 24 and name HB2))  	 2.408 0.708 2.592
assign (resid 24 and name HD*) (resid 24 and name HN) 	 3.350 1.650 1.650
assign (resid 21 and name HA) (resid 24 and name HN) 	 3.289 1.589 1.589
assign (resid 24 and name HB2) (resid 24 and name HN) 	 2.866 1.166 1.366
assign (resid 24 and name HB1) (resid 24 and name HN) 	 2.866 1.166 1.366
assign (resid 23 and name HB*) (resid 24 and name HN) 	 2.779 1.079 1.579
assign (resid 26 and name HG1*) (resid 24 and name HN) 	 3.350 1.650 1.650
assign (resid 24 and name HN) (resid 25 and name HN) 	 2.347 0.647 0.647
assign (resid 26 and name HN) (resid 25 and name HN) 	 2.524 0.824 0.824
assign (resid 24 and name HD*) (resid 25 and name HN) 	 2.758 1.058 1.558
assign (resid 25 and name HA) (resid 25 and name HN) 	 2.410 0.710 0.710
assign (resid 22 and name HA) (resid 25 and name HN) 	 2.624 0.924 0.924
assign (resid 21 and name HA) (resid 25 and name HN) 	 2.832 1.132 2.132
assign (resid 24 and name HA) (resid 25 and name HN) 	 2.841 1.141 1.141
assign ((resid 24 and name HB2) or (resid 24 and name HB1)) (resid 25 and name HN) 	 2.374 0.674 0.674
assign (resid 25 and name HB2) (resid 25 and name HN) 	 2.523 0.823 1.023
assign (resid 25 and name HB1) (resid 25 and name HN) 	 2.523 0.823 1.023
assign (resid 28 and name HB) (resid 25 and name HN) 	 2.960 1.260 1.960
assign (resid 27 and name HN) (resid 26 and name HN) 	 2.360 0.660 0.660
assign (resid 25 and name HA) (resid 26 and name HN) 	 2.844 1.144 1.144
assign (resid 23 and name HA) (resid 26 and name HN) 	 2.668 0.968 2.368
assign (resid 26 and name HA) (resid 26 and name HN) 	 2.409 0.709 0.709
assign (resid 25 and name HB2) (resid 26 and name HN) 	 2.789 1.089 1.389
assign (resid 25 and name HB1) (resid 26 and name HN) 	 2.789 1.089 1.389
assign (resid 26 and name HB) (resid 26 and name HN) 	 2.206 0.506 1.406
assign (resid 26 and name HG12) (resid 26 and name HN) 	 2.543 0.843 1.043
assign (resid 26 and name HG11) (resid 26 and name HN) 	 2.543 0.843 1.043
assign (resid 26 and name HD1*) (resid 26 and name HN) 	 2.820 1.120 1.420
assign ((resid 26 and name HG2*) or (resid 26 and name HD1*)) (resid 26 and name HN) 	 2.820 1.120 1.120
assign (resid 26 and name HA) (resid 27 and name HN) 	 2.736 1.036 1.036
assign (resid 27 and name HB1) (resid 27 and name HN) 	 2.522 0.822 1.022
assign (resid 27 and name HA) (resid 27 and name HN) 	 2.413 0.713 0.713
assign (resid 24 and name HA) (resid 27 and name HN) 	 2.814 1.114 1.114
assign (resid 27 and name HB2) (resid 27 and name HN) 	 2.522 0.822 1.022
assign (resid 26 and name HB) (resid 27 and name HN) 	 2.389 0.690 1.690
assign (resid 26 and name HG2*) (resid 27 and name HN) 	 2.628 0.928 2.128
assign (resid 28 and name HD1*) (resid 27 and name HN)   3.161 1.461 1.461
assign (resid 27 and name HN) (resid 28 and name HN) 	 2.248 0.548 0.548
assign (resid 27 and name HA) (resid 28 and name HN) 	 2.787 1.087 1.087
assign (resid 25 and name HA) (resid 28 and name HN) 	 2.738 1.038 1.038
assign (resid 28 and name HA) (resid 28 and name HN) 	 2.412 0.712 0.712
assign ((resid 27 and name HB2) or (resid 27 and name HB1)) (resid 28 and name HN) 	 2.953 1.253 1.253
assign (resid 28 and name HB) (resid 28 and name HN) 	 2.464 0.764 1.464
assign (resid 28 and name HG12) (resid 28 and name HN) 	 2.813 1.113 1.313
assign (resid 28 and name HG11) (resid 28 and name HN) 	 2.813 1.113 1.313
assign (resid 28 and name HD1*) (resid 28 and name HN) 	 2.392 0.692 0.692
assign (resid 30 and name HN) (resid 29 and name HN) 	 2.727 1.027 1.027
assign (resid 29 and name HA) (resid 29 and name HN) 	 2.405 0.705 0.705
assign (resid 29 and name HG*) (resid 29 and name HN) 	 2.696 0.996 1.196
assign (resid 29 and name HB*) (resid 29 and name HN) 	 2.696 0.996 1.196
assign (resid 28 and name HB) (resid 29 and name HN) 	 3.098 1.398 1.398
assign ((resid 28 and name HG12) or (resid 28 and name HG11)) (resid 29 and name HN) 	 3.077 1.377 2.277
assign (resid 28 and name HD1*) (resid 29 and name HN) 	 3.073 1.373 1.773
assign (resid 30 and name HA) (resid 30 and name HN) 	 2.405 0.705 0.705
assign (resid 31 and name HN) (resid 30 and name HN) 	 2.595 0.895 0.895
assign (resid 29 and name HA) (resid 30 and name HN) 	 2.654 0.954 0.954
assign ((resid 30 and name HB1) or (resid 30 and name HB2)) (resid 30 and name HN) 	 2.724 1.024 1.024
assign (resid 29 and name HG*) (resid 30 and name HN) 	 3.153 1.453 1.653
assign (resid 29 and name HB*) (resid 30 and name HN) 	 3.153 1.453 1.653
assign (resid 32 and name HN) (resid 31 and name HN) 	 3.048 1.348 1.548
assign (resid 31 and name HA) (resid 31 and name HN) 	 2.409 0.709 0.709
assign (resid 28 and name HA) (resid 31 and name HN) 	 2.679 0.979 1.579
assign ((resid 30 and name HB1) or (resid 30 and name HB2)) (resid 31 and name HN) 	 2.983 1.283 1.483
assign (resid 28 and name HB) (resid 31 and name HN) 	 3.004 1.304 1.996
assign (resid 31 and name HB*) (resid 31 and name HN) 	 2.189 0.489 0.489
assign ((resid 29 and name HG1) or (resid 29 and name HG2)) (resid 31 and name HN) 	 3.037 1.337 1.837
assign (resid 33 and name HN) (resid 32 and name HN) 	 2.688 0.988 0.988
assign (resid 31 and name HA) (resid 32 and name HN) 	 2.119 0.419 0.419
assign (resid 32 and name HA) (resid 32 and name HN) 	 2.426 0.726 0.726
assign (resid 32 and name HG*) (resid 32 and name HN) 	 2.588 0.888 0.888
assign (resid 32 and name HB*) (resid 32 and name HN) 	 2.281 0.581 0.581
assign (resid 31 and name HB*) (resid 32 and name HN) 	 2.425 0.725 0.725
assign (resid 34 and name HN) (resid 33 and name HN) 	 2.924 1.224 1.224
assign (resid 35 and name HN) (resid 33 and name HN) 	 3.060 1.360 1.360
assign (resid 33 and name HA) (resid 33 and name HN) 	 2.406 0.706 0.706
assign (resid 31 and name HA) (resid 33 and name HN) 	 3.134 1.434 1.434
assign (resid 32 and name HA) (resid 33 and name HN) 	 2.610 0.910 0.910
assign (resid 33 and name HB2) (resid 33 and name HN) 	 2.744 1.045 1.245
assign (resid 33 and name HB1) (resid 33 and name HN) 	 2.744 1.045 1.245
assign (resid 32 and name HB*) (resid 33 and name HN) 	 2.785 1.085 1.085
assign (resid 31 and name HB*) (resid 33 and name HN) 	 2.669 0.969 0.969
assign (resid 35 and name HN) (resid 34 and name HN) 	 3.010 1.310 1.310
assign (resid 33 and name HA) (resid 34 and name HN) 	 3.005 1.305 1.305
assign (resid 32 and name HA) (resid 34 and name HN) 	 3.350 1.650 1.650
assign (resid 34 and name HA2) (resid 34 and name HN) 	 2.952 1.252 1.452
assign (resid 34 and name HA1)  (resid 34 and name HN) 	 2.952 1.252 1.452
assign (resid 33 and name HB2) (resid 34 and name HN) 	 3.350 1.650 1.650
assign (resid 33 and name HB1) (resid 34 and name HN) 	 3.350 1.650 1.650
assign (resid 31 and name HB*) (resid 34 and name HN) 	 3.081 1.381 1.381
assign (resid 28 and name HG2*) (resid 34 and name HN) 	 3.350 1.650 1.650
assign (resid 35 and name HA) (resid 35 and name HN) 	 2.412 0.712 0.712
assign ((resid 34 and name HA1) or (resid 34 and name HA2)) (resid 35 and name HN) 	 2.481 0.781 0.781
assign (resid 35 and name HB2)  (resid 35 and name HN) 	 2.541 0.841 1.341
assign (resid 35 and name HB1) (resid 35 and name HN) 	 2.541 0.841 1.341
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assign (resid 24 and name HE*) (resid 74 and name HN) 	 2.732 1.032 1.532
assign (resid 74 and name HD*) (resid 74 and name HN) 	 2.783 1.083 1.783
assign (resid 73 and name HA) (resid 74 and name HN) 	 2.266 0.566 0.566
assign (resid 74 and name HA) (resid 74 and name HN) 	 2.415 0.715 0.715
assign (resid 73 and name HB2) (resid 74 and name HN) 	 2.410 0.710 0.910
assign (resid 73 and name HB1) (resid 74 and name HN) 	 2.410 0.710 0.910
assign (resid 74 and name HB2) (resid 74 and name HN) 	 2.272 0.572 0.772
assign (resid 74 and name HB1) (resid 74 and name HN) 	 2.272 0.572 0.772
assign (resid 77 and name HN) (resid 75 and name HN) 	 3.044 1.344 1.344
assign (resid 76 and name HN) (resid 75 and name HN) 	 2.371 0.671 0.671
assign (resid 74 and name HD*) (resid 75 and name HN) 	 3.027 1.327 1.927
assign (resid 75 and name HA) (resid 75 and name HN) 	 2.409 0.709 0.709
assign (resid 74 and name HA) (resid 75 and name HN) 	 2.852 1.152 1.152
assign (resid 75 and name HN) ((resid 73 and name HB2) or (resid 73 and name HB1))  	 2.796 1.096 1.096
assign (resid 75 and name HN) ((resid 76 and name HG2) or (resid 76 and name HG1))  	 2.907 1.207 1.207
assign (resid 75 and name HB1) (resid 75 and name HN) 	 2.388 0.688 1.088
assign (resid 75 and name HB2) (resid 75 and name HN) 	 2.388 0.688 1.088
assign (resid 77 and name HN) (resid 76 and name HN) 	 2.416 0.716 0.716
assign (resid 76 and name HG2) (resid 76 and name HN) 	 2.480 0.780 0.980
assign (resid 76 and name HA) (resid 76 and name HN) 	 2.413 0.713 0.713
assign (resid 76 and name HN) ((resid 75 and name HB1) or (resid 75 and name HB2))  	 2.495 0.795 0.795
assign (resid 76 and name HG1) (resid 76 and name HN) 	 2.480 0.780 0.980
assign (resid 76 and name HN) ((resid 76 and name HB2) or (resid 76 and name HB1))  	 2.345 0.645 0.645
assign (resid 76 and name HN) ((resid 72 and name HG2*) or (resid 72 and name HG1*))      2.345 0.645 2.655
assign (resid 78 and name HN) (resid 77 and name HN) 	 2.472 0.772 0.772
assign (resid 79 and name HN) (resid 77 and name HN) 	 2.702 1.002 1.802
assign (resid 76 and name HA) (resid 77 and name HN) 	 2.708 1.008 1.008
assign (resid 77 and name HA) (resid 77 and name HN) 	 2.413 0.713 0.713
assign (resid 74 and name HA) (resid 77 and name HN) 	 2.573 0.873 0.873
assign (resid 77 and name HB2) (resid 77 and name HN) 	 2.278 0.578 0.778
assign (resid 77 and name HB1) (resid 77 and name HN) 	 2.278 0.578 0.778
assign (resid 77 and name HN) ((resid 76 and name HG1) or (resid 76 and name HG2))  	 2.821 1.120 1.320
assign (resid 76 and name HB2) (resid 77 and name HN) 	 2.641 0.941 1.541
assign (resid 76 and name HB1) (resid 77 and name HN) 	 2.641 0.941 1.541
assign (resid 77 and name HN) ((resid 78 and name HB2) or (resid 78 and name HB1))        2.345 0.645 2.655
assign (resid 79 and name HN) (resid 78 and name HN) 	 2.338 0.638 2.238
assign (resid 75 and name HA) (resid 78 and name HN) 	 2.685 0.985 0.985
assign (resid 77 and name HA) (resid 78 and name HN) 	 2.820 1.120 1.120
assign (resid 78 and name HA) (resid 78 and name HN) 	 2.415 0.715 0.715
assign (resid 78 and name HN) ((resid 77 and name HB2) or (resid 77 and name HB1))  	 2.471 0.771 1.171
assign (resid 78 and name HB2) (resid 78 and name HN) 	 2.253 0.553 1.553
assign (resid 78 and name HB1) (resid 78 and name HN) 	 2.253 0.553 1.553
assign (resid 78 and name HN) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  	 2.598 0.898 1.298
assign (resid 78 and name HN) (resid 79 and name HN) 	 2.461 0.761 0.761
assign (resid 80 and name HN) (resid 79 and name HN) 	 2.362 0.662 0.662
assign (resid 76 and name HA) (resid 79 and name HN) 	 2.695 0.995 1.195
assign (resid 79 and name HA) (resid 79 and name HN) 	 2.409 0.709 0.709
assign (resid 79 and name HB) (resid 79 and name HN) 	 2.209 0.509 1.409
assign (resid 79 and name HN) ((resid 78 and name HB2) or (resid 78 and name HB1))  	 2.468 0.768 0.768
assign (resid 79 and name HG2*) (resid 79 and name HN) 	 2.677 0.977 1.777
assign (resid 79 and name HG1*) (resid 79 and name HN) 	 2.677 0.977 1.777
assign (resid 78 and name HA) (resid 79 and name HN) 	 2.827 1.127 1.127
assign (resid 81 and name HN) (resid 80 and name HN) 	 2.468 0.768 0.768
assign (resid 79 and name HG2*) (resid 80 and name HN) 	 2.671 0.971 2.271
assign (resid 80 and name HN) ((resid 64 and name HG1*) or (resid 64 and name HG2*))  	 2.472 0.772 1.572
assign (resid 77 and name HA) (resid 80 and name HN) 	 2.628 0.928 1.328
assign (resid 79 and name HG1*) (resid 80 and name HN) 	 2.671 0.971 2.271
assign (resid 80 and name HA) (resid 80 and name HN) 	 2.416 0.716 0.716
assign (resid 79 and name HA) (resid 80 and name HN) 	 2.704 1.004 1.004
assign (resid 80 and name HN) ((resid 80 and name HG2) or (resid 80 and name HG1))  	 2.635 0.935 0.935
assign (resid 79 and name HB) (resid 80 and name HN) 	 2.324 0.624 1.424
assign (resid 80 and name HB2) (resid 80 and name HN) 	 2.312 0.612 1.212
assign (resid 80 and name HB1) (resid 80 and name HN) 	 2.312 0.612 1.212
assign (resid 80 and name HN) ((resid 83 and name HG1) or (resid 83 and name HG2))  	 2.408 0.708 2.592
assign (resid 82 and name HN) (resid 81 and name HN) 	 2.510 0.811 0.811
assign (resid 79 and name HN) (resid 81 and name HN) 	 2.932 1.232 1.632
assign (resid 81 and name HA) (resid 81 and name HN) 	 2.412 0.712 0.712
assign (resid 80 and name HA) (resid 81 and name HN) 	 2.720 1.020 1.020
assign (resid 78 and name HA) (resid 81 and name HN) 	 2.562 0.862 1.462
assign (resid 80 and name HB2) (resid 81 and name HN) 	 2.551 0.851 1.551
assign (resid 80 and name HB1) (resid 81 and name HN) 	 2.551 0.851 1.551
assign (resid 81 and name HB2) (resid 81 and name HN) 	 2.557 0.857 1.357
assign (resid 81 and name HG2) (resid 81 and name HN) 	 2.530 0.830 1.930
assign (resid 81 and name HG1) (resid 81 and name HN) 	 2.530 0.830 1.930
assign (resid 81 and name HB1) (resid 81 and name HN) 	 2.557 0.857 1.357
assign (resid 82 and name HA) (resid 82 and name HN) 	 2.409 0.709 0.709
assign (resid 79 and name HA) (resid 82 and name HN) 	 2.780 1.080 1.080
assign (resid 82 and name HB) (resid 82 and name HN) 	 2.355 0.655 1.255
assign ((resid 81 and name HB2) or (resid 81 and name HB1)) (resid 82 and name HN) 	 2.524 0.824 1.324
assign (resid 82 and name HG2*) (resid 82 and name HN) 	 2.359 0.659 1.459
assign (resid 82 and name HG1*) (resid 82 and name HN) 	 2.359 0.659 1.459
assign (resid 82 and name HA) (resid 83 and name HN) 	 2.669 0.969 0.969
assign (resid 83 and name HA) (resid 83 and name HN) 	 2.410 0.710 0.710
assign (resid 80 and name HA) (resid 83 and name HN) 	 2.791 1.091 1.091
assign (resid 79 and name HA) (resid 83 and name HN) 	 3.023 1.323 1.623
assign (resid 83 and name HD*) (resid 83 and name HN) 	 3.015 1.315 1.715
assign (resid 82 and name HB) (resid 83 and name HN) 	 2.539 0.839 1.639
assign (resid 83 and name HB*) (resid 83 and name HN) 	 2.392 0.692 0.692
assign (resid 83 and name HG2) (resid 83 and name HN) 	 2.431 0.731 0.931
assign (resid 83 and name HG1) (resid 83 and name HN) 	 2.431 0.731 0.931
assign ((resid 82 and name HG1*) or (resid 82 and name HG2*)) (resid 83 and name HN) 	 2.717 1.017 1.017
assign (resid 83 and name HN) (resid 84 and name HN) 	 2.398 0.698 0.698
assign (resid 85 and name HN) (resid 84 and name HN) 	 2.374 0.674 0.674
assign (resid 84 and name HA) (resid 84 and name HN) 	 2.409 0.710 0.710
assign (resid 81 and name HA) (resid 84 and name HN) 	 2.621 0.921 1.621
assign (resid 83 and name HA) (resid 84 and name HN) 	 2.746 1.046 1.046
assign (resid 84 and name HB*) (resid 84 and name HN) 	 2.263 0.563 0.563
assign (resid 83 and name HB*) (resid 84 and name HN) 	 2.585 0.885 1.585
assign ((resid 83 and name HG2) or (resid 83 and name HG1)) (resid 84 and name HN) 	 2.588 0.888 2.188
assign (resid 86 and name HN) (resid 85 and name HN) 	 2.697 0.997 0.997
assign (resid 85 and name HA) (resid 85 and name HN) 	 2.407 0.707 0.707
assign (resid 82 and name HA) (resid 85 and name HN) 	 2.681 0.981 0.981
assign (resid 83 and name HA) (resid 85 and name HN) 	 3.144 1.444 1.444
assign (resid 84 and name HB*) (resid 85 and name HN) 	 2.606 0.906 0.906
assign (resid 85 and name HG2) (resid 85 and name HN) 	 2.754 1.054 1.454
assign (resid 85 and name HG1) (resid 85 and name HN) 	 2.754 1.054 1.454
assign (resid 85 and name HN) ((resid 85 and name HB1) or (resid 85 and name HB2))  	 2.331 0.631 0.931
assign (resid 87 and name HN) (resid 86 and name HN) 	 3.290 1.590 1.590
assign (resid 86 and name HA) (resid 86 and name HN) 	 2.404 0.704 0.704
assign (resid 86 and name HN) ((resid 85 and name HB1) or (resid 85 and name HB2))  	 2.997 1.297 1.497
assign (resid 86 and name HN) ((resid 86 and name HB1) or (resid 86 and name HB2))  	 2.614 0.914 0.914
assign (resid 86 and name HG*) (resid 86 and name HN) 	 2.874 1.174 1.174
assign (resid 83 and name HA) (resid 86 and name HN) 	 3.092 1.392 1.608
assign (resid 86 and name HA) (resid 87 and name HN) 	 2.687 0.987 0.987
assign (resid 87 and name HB2) (resid 87 and name HN) 	 3.272 1.572 1.772
assign (resid 87 and name HB1) (resid 87 and name HN) 	 3.272 1.572 1.772
assign (resid 87 and name HN) ((resid 86 and name HB2) or (resid 86 and name HB1))  	 3.293 1.593 1.593
assign (resid 86 and name HG*) (resid 87 and name HN) 	 3.350 1.650 1.650
assign (resid 88 and name HA) (resid 88 and name HN) 	 2.402 0.702 0.702
assign (resid 89 and name HN) (resid 88 and name HN) 	 3.350 1.650 1.650
assign (resid 88 and name HN) ((resid 88 and name HB1) or (resid 88 and name HB2))  	 3.293 1.593 1.593
assign (resid 88 and name HN) ((resid 86 and name HB2) or (resid 86 and name HB1))        2.345 0.645 2.655
assign (resid 88 and name HA) (resid 89 and name HN) 	 2.318 0.618 0.618
assign (resid 89 and name HA) (resid 89 and name HN) 	 2.428 0.728 0.728
assign (resid 89 and name HN) ((resid 89 and name HB2) or (resid 89 and name HB1))        2.345 0.645 2.655
assign (resid 5 and name HA) (resid 5 and name HD*) 3.400 1.6 0.9 
assign (resid 5 and name HD*) ((resid 5 and name HB1) or (resid 5 and name HB2))  3.400 1.6 0.0 
assign (resid 20 and name HA) (resid 20 and name HD*) 2.800 1.0 1.3 
assign (resid 20 and name HB*) (resid 20 and name HD*) 3.400 1.6 0.0 
assign (resid 24 and name HA) (resid 24 and name HD*) 5.000 3.2 0.0
assign (resid 24 and name HD*) ((resid 24 and name HB1) or (resid 24 and name HB2))  3.400 1.6 0.0 
assign (resid 27 and name HA) (resid 27 and name HD*) 3.400 1.6 0.0 
assign (resid 27 and name HD*) ((resid 27 and name HB1) or (resid 27 and name HB2))  5.000 3.2 0.0 
assign (resid 28 and name HG2*) (resid 24 and name HE*) 3.400 1.6 0.6 
assign (resid 35 and name HA) (resid 24 and name HZ) 5.000 3.2 0.0 
assign (resid 73 and name HA) (resid 24 and name HZ) 5.000 3.2 0.0 
assign (resid 21 and name HB*) (resid 74 and name HE*) 5.000 3.2 0.0 
assign (resid 21 and name HA) (resid 74 and name HE*) 3.400 1.6 0.0 
assign (resid 74 and name HA) (resid 74 and name HD*) 2.800 1.0 0.0 
assign (resid 74 and name HD*) ((resid 74 and name HB1) or (resid 74 and name HB2))  3.400 1.6 0.0 
assign (resid 24 and name HD*) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 77 and name HE*) ((resid 44 and name HG1*) or (resid 44 and name HG2*))  5.000 3.2 0.0 
assign (resid 77 and name HD*) ((resid 72 and name HG2*) or (resid 72 and name HG1*))  5.000 3.2 0.0 
assign (resid 77 and name HB*) (resid 74 and name HD*) 5.000 3.2 0.0 
assign (resid 74 and name HD*) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 77 and name HD*) (resid 74 and name HE*) 5.000 3.2 0.0 
assign (resid 77 and name HA) (resid 77 and name HD*) 3.400 1.6 0.0 
assign (resid 77 and name HD*) ((resid 77 and name HB1) or (resid 77 and name HB2))  3.400 1.6 0.0 
assign (resid 21 and name HD1*) (resid 74 and name HE*) 5.000 3.2 0.0 
assign (resid 48 and name HD1*) (resid 20 and name HD*) 5.000 3.2 0.0 
assign (resid 48 and name HD2*) (resid 20 and name HD*) 5.000 3.2 0.0 
assign (resid 48 and name HD2*) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 24 and name HA) (resid 27 and name HD*) 5.000 3.2 0.0 
assign (resid 21 and name HB*) (resid 74 and name HZ) 5.000 3.2 0.0 
assign (resid 24 and name HB*) (resid 74 and name HE*) 5.000 3.2 0.0 
assign (resid 23 and name HB*) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 2 and name HB*) (resid 5 and name HD*) 3.400 1.6 0.0 
assign (resid 8 and name HB*) (resid 5 and name HD*) 5.000 3.2 0.3 
assign (resid 5 and name HA) (resid 5 and name HE*) 5.000 3.2 0.0 
assign (resid 5 and name HB*) (resid 5 and name HE*) 3.400 1.6 1.6 
assign (resid 17 and name HG*) (resid 20 and name HD*) 5.000 3.2 0.0 
assign (resid 81 and name HB*) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 25 and name HA) (resid 24 and name HD*) 5.000 3.2 0.0 
assign (resid 28 and name HD1*) (resid 24 and name HE*) 5.000 3.2 0.0 
assign (resid 28 and name HG2*) (resid 24 and name HD*) 5.000 3.2 0.0 
assign (resid 73 and name HA) (resid 24 and name HE*) 5.000 3.2 0.0 
assign (resid 17 and name HA) (resid 74 and name HZ) 5.000 3.2 0.0 
assign (resid 20 and name HB*) (resid 74 and name HZ) 3.400 1.6 0.0 
assign (resid 21 and name HA) (resid 74 and name HD*) 5.000 3.2 0.0 
assign (resid 21 and name HA) (resid 74 and name HZ) 5.000 3.2 0.0 
assign (resid 74 and name HA) (resid 24 and name HE*) 3.400 1.6 0.0 
assign (resid 77 and name HB*) (resid 74 and name HD*) 3.400 1.6 0.0 
assign (resid 24 and name HB*) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 77 and name HD*) ((resid 72 and name HG1*) or (resid 72 and name HG2*))  5.000 3.2 0.0 
assign (resid 77 and name HB*) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 74 and name HD*) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  5.000 3.2 0.0 
assign (resid 78 and name HG) (resid 74 and name HZ) 5.000 3.2 0.0 
assign (resid 74 and name HA) (resid 77 and name HD*) 3.400 1.6 0.8 
assign (resid 78 and name HG) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 77 and name HD*) ((resid 36 and name HD1*) or (resid 36 and name HG2*))  5.000 3.2 0.0 
assign (resid 17 and name HA) (resid 20 and name HD*) 2.800 1.0 2.2 
assign (resid 48 and name HD1*) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 5 and name HD*) ((resid 79 and name HG1*) or (resid 79 and name HG2*))  5.000 3.2 0.0 
assign (resid 5 and name HE*) ((resid 82 and name HG1*) or (resid 82 and name HG2*))  5.000 3.2 0.0 
assign (resid 5 and name HE*) ((resid 4 and name HD1*) or (resid 4 and name HG2*))  5.000 3.2 0.0 
assign (resid 5 and name HE*) ((resid 79 and name HG1*) or (resid 79 and name HG2*))  5.000 3.2 0.0 
assign (resid 20 and name HA) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 20 and name HB*) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 23 and name HB*) (resid 20 and name HD*) 5.000 3.2 0.0 
assign (resid 24 and name HB*) (resid 24 and name HE*) 5.000 1.6 1.5 
assign (resid 47 and name HB*) (resid 27 and name HE*) 5.000 3.2 0.0 
assign (resid 24 and name HE*) ((resid 28 and name HG11) or (resid 28 and name HG12))  5.000 3.2 0.0 
assign (resid 44 and name HA) (resid 27 and name HE*) 5.000 3.2 0.0 
assign (resid 27 and name HD*) ((resid 44 and name HG2*) or (resid 44 and name HG1*))  5.000 3.2 0.0 
assign (resid 27 and name HE*) ((resid 44 and name HG2*) or (resid 44 and name HG1*))  5.000 3.2 0.0 
assign (resid 19 and name HB*) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 48 and name HG) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 21 and name HD*) (resid 74 and name HZ) 5.000 3.2 0.0 
assign (resid 74 and name HB*) (resid 24 and name HE*) 5.000 3.2 0.0 
assign (resid 24 and name HD*) (resid 74 and name HD*) 3.400 1.6 0.0 
assign (resid 74 and name HA) (resid 74 and name HE*) 5.000 3.2 0.0 
assign (resid 74 and name HB*) (resid 74 and name HE*) 5.000 3.2 0.0 
assign (resid 20 and name HA) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 20 and name HB*) (resid 77 and name HE*) 3.400 1.6 0.0 
assign (resid 77 and name HB*) (resid 24 and name HD*) 5.000 3.2 0.0 
assign (resid 77 and name HB*) (resid 24 and name HE*) 5.000 3.2 0.0 
assign (resid 20 and name HB1) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 20 and name HB2) (resid 77 and name HE*) 5.000 3.2 0.0 
assign (resid 77 and name HD*) ((resid 36 and name HD1*) or (resid 36 and name HG2*))  5.000 3.2 0.0 
assign (resid 77 and name HE*) ((resid 48 and name HD1*) or (resid 48 and name HD2*))  5.000 3.2 0.0 
assign (resid 78 and name HG) (resid 74 and name HE*) 3.400 1.6 0.4 
assign (resid 78 and name HG) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 5 and name HD*) ((resid 79 and name HG1*) or (resid 79 and name HG2*))  5.000 3.2 0.0 
assign (resid 24 and name HE*) ((resid 28 and name HG11) or (resid 28 and name HG12))  3.400 1.6 1.4 
assign (resid 20 and name HE*) ((resid 81 and name HG1) or (resid 81 and name HG2))  2.800 1.0 0.2 
assign (resid 5 and name HD*) ((resid 82 and name HG2*) or (resid 82 and name HG1*))  5.000 3.2 0.0 
assign (resid 83 and name HA) (resid 5 and name HE*) 5.000 3.2 0.0 
assign (resid 4 and name HB) (resid 4 and name HA) 2.800 1.0 0.0 
assign (resid 4 and name HD1*) (resid 4 and name HA) 5.000 3.2 0.0 
assign (resid 4 and name HG2*) (resid 4 and name HA) 5.000 3.2 0.0 
assign (resid 6 and name HE*) (resid 5 and name HB*) 2.800 1.0 0.0 
assign (resid 6 and name HD*) (resid 6 and name HA) 5.000 3.2 0.0 
assign (resid 7 and name HB*) (resid 7 and name HA) 2.800 1.0 0.0 
assign (resid 8 and name HB*) (resid 8 and name HA) 2.800 1.0 0.0 
assign (resid 9 and name HG1*) (resid 9 and name HA) 3.400 1.6 0.4 
assign (resid 9 and name HG2*) (resid 9 and name HA) 5.000 3.2 0.0 
assign (resid 10 and name HG*) (resid 10 and name HA) 3.400 1.6 0.3 
assign (resid 11 and name HB*) (resid 11 and name HA) 2.800 1.0 0.0 
assign (resid 11 and name HB*) (resid 11 and name HA) 2.800 1.0 0.0 
assign (resid 12 and name HB*) (resid 12 and name HA) 2.800 1.0 0.0 
assign ((resid 12 and name HD1*) or (resid 12 and name HD2*)) (resid 12 and name HA) 5.000 3.2 0.0 
assign (resid 13 and name HA) (resid 13 and name HB) 2.800 1.0 0.0 
assign (resid 13 and name HG2*) (resid 13 and name HA) 2.800 1.0 0.0 
assign (resid 13 and name HG2*) (resid 13 and name HB) 2.800 1.0 0.0 
assign (resid 17 and name HB*) (resid 17 and name HA) 2.800 1.0 0.0 
assign (resid 17 and name HD*) (resid 17 and name HA) 5.000 3.2 0.0 
assign (resid 17 and name HG*) (resid 17 and name HE*) 5.000 3.2 0.0 
assign (resid 18 and name HB*) (resid 18 and name HA) 3.400 1.6 0.0 
assign (resid 19 and name HG*) (resid 18 and name HB*) 5.000 3.2 0.0 
assign (resid 20 and name HB*) (resid 20 and name HA) 3.400 1.6 0.0 
assign (resid 23 and name HB*) (resid 20 and name HA) 5.000 3.2 0.0 
assign (resid 23 and name HB*) (resid 23 and name HA) 3.400 1.6 0.0 
assign (resid 24 and name HB*) (resid 24 and name HA) 5.000 3.2 0.0 
assign (resid 29 and name HB*) (resid 26 and name HA) 5.000 3.2 0.0 
assign (resid 29 and name HG*) (resid 26 and name HA) 5.000 3.2 0.0 
assign (resid 26 and name HB) (resid 26 and name HA) 3.400 1.6 0.0 
assign (resid 26 and name HD1*) (resid 26 and name HA) 5.000 3.2 0.0 
assign (resid 26 and name HG1*) (resid 26 and name HA) 3.400 1.6 0.3 
assign (resid 26 and name HG2*) (resid 26 and name HA) 5.000 3.2 0.0 
assign ((resid 26 and name HG2*) or (resid 26 and name HD1*)) (resid 26 and name HB) 5.000 3.2 0.0 
assign (resid 26 and name HG2*) (resid 26 and name HD1*) 5.000 3.2 0.0 
assign ((resid 26 and name HG2*) or (resid 26 and name HD1*)) (resid 26 and name HG1*) 5.000 3.2 0.0 
assign (resid 27 and name HB*) (resid 27 and name HA) 5.000 3.2 0.0 
assign (resid 28 and name HG1*) (resid 25 and name HA) 3.400 1.6 0.0 
assign (resid 28 and name HB) (resid 28 and name HA) 2.800 1.0 0.2 
assign (resid 28 and name HD1*) (resid 28 and name HA) 5.000 3.2 0.0 
assign (resid 28 and name HD1*) (resid 28 and name HB) 5.000 3.2 0.0 
assign (resid 28 and name HD1*) (resid 28 and name HG1*) 5.000 3.2 0.0 
assign (resid 28 and name HG2*) (resid 28 and name HA) 5.000 3.2 0.0 
assign (resid 28 and name HD1*) (resid 28 and name HG2*) 5.000 3.2 0.0 
assign (resid 31 and name HB*) (resid 31 and name HA) 3.400 1.6 0.0 
assign (resid 32 and name HB*) (resid 33 and name HA) 5.000 3.2 0.0 
assign (resid 33 and name HB*) (resid 33 and name HA) 3.400 1.6 0.0 
assign (resid 28 and name HD1*) (resid 35 and name HA) 5.000 3.2 0.0 
assign (resid 35 and name HB*) (resid 35 and name HA) 3.400 1.6 0.0 
assign (resid 28 and name HD1*) (resid 36 and name HG1*) 5.000 3.2 0.0 
assign ((resid 36 and name HG2*) or (resid 36 and name HD1*)) (resid 35 and name HA) 5.000 3.2 0.0 
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assign (resid 36 and name HG2*) (resid 36 and name HA) 5.000 3.2 0.0 
assign (resid 37 and name HB*) (resid 37 and name HA) 5.000 3.2 0.0 
assign (resid 38 and name HA) (resid 38 and name HB) 2.800 1.0 0.0 
assign (resid 38 and name HG2*) (resid 38 and name HB) 3.400 1.6 0.0 
assign ((resid 61 and name HG11) or (resid 61 and name HG12)) (resid 38 and name HB) 5.000 3.2 0.0 
assign (resid 41 and name HB*) (resid 41 and name HA) 3.400 1.6 0.0 
assign ((resid 41 and name HD2*) or (resid 41 and name HD1*)) (resid 41 and name HA) 5.000 3.2 0.0 
assign (resid 44 and name HB) (resid 44 and name HA) 5.000 3.2 0.0 
assign (resid 44 and name HG1*) (resid 44 and name HA) 5.000 3.2 0.0 
assign (resid 44 and name HG1*) (resid 44 and name HB) 5.000 3.2 0.0 
assign (resid 44 and name HG2*) (resid 44 and name HA) 5.000 3.2 0.0 
assign (resid 44 and name HG2*) (resid 44 and name HB) 5.000 3.2 0.0 
assign (resid 46 and name HG*) (resid 46 and name HD*) 3.400 1.6 0.0 
assign (resid 47 and name HB*) (resid 44 and name HA) 5.000 3.2 0.0 
assign ((resid 48 and name HD2*) or (resid 48 and name HD1*)) (resid 48 and name HA) 3.400 1.6 1.2 
assign (resid 50 and name HB*) (resid 50 and name HA) 5.000 3.2 0.0 
assign (resid 46 and name HG*) (resid 51 and name HA) 5.000 3.2 0.3 
assign (resid 51 and name HB*) (resid 51 and name HA) 2.800 1.0 0.0 
assign (resid 52 and name HD*) (resid 51 and name HA) 2.800 1.0 1.0 
assign (resid 52 and name HG*) (resid 51 and name HA) 5.000 3.2 0.7 
assign (resid 52 and name HB*) (resid 52 and name HA) 5.000 3.2 0.0 
assign (resid 52 and name HD*) (resid 52 and name HA) 5.000 3.2 0.0 
assign (resid 52 and name HB*) (resid 52 and name HD*) 5.000 3.2 0.0 
assign (resid 52 and name HG*) (resid 52 and name HA) 5.000 3.2 0.0 
assign (resid 52 and name HG*) (resid 52 and name HD*) 3.400 1.6 0.0 
assign (resid 53 and name HA) (resid 53 and name HB) 2.800 1.0 0.0 
assign (resid 53 and name HG2*) (resid 53 and name HA) 3.400 1.6 0.0 
assign (resid 54 and name HD*) (resid 53 and name HA) 2.800 1.0 0.0 
assign (resid 54 and name HD*) (resid 53 and name HB) 2.800 1.0 0.0 
assign (resid 58 and name HA) (resid 59 and name HA) 5.000 3.2 0.0 
assign (resid 59 and name HB*) (resid 59 and name HA) 2.800 1.0 0.0 
assign (resid 60 and name HB*) (resid 61 and name HA) 5.000 3.2 0.0 
assign (resid 61 and name HB) (resid 61 and name HA) 5.000 3.2 0.0 
assign (resid 61 and name HD1*) (resid 61 and name HA) 5.000 3.2 0.0 
assign (resid 61 and name HG1*) (resid 61 and name HA) 3.400 1.6 0.0 
assign (resid 61 and name HG2*) (resid 61 and name HA) 5.000 3.2 0.0 
assign (resid 64 and name HA) ((resid 64 and name HG1*) or (resid 64 and name HG2*))  3.400 1.6 0.0 
assign (resid 65 and name HB*) (resid 65 and name HA) 5.000 3.2 0.0 
assign (resid 67 and name HB*) (resid 67 and name HA) 5.000 3.2 0.0 
assign (resid 69 and name HB*) (resid 69 and name HA) 2.800 1.0 0.0 
assign (resid 35 and name HB*) (resid 71 and name HB) 3.400 1.6 0.0 
assign (resid 71 and name HG2*) (resid 35 and name HB*) 5.000 3.2 0.0 
assign (resid 37 and name HA) (resid 71 and name HA) 3.400 1.6 0.0 
assign (resid 20 and name HA) ((resid 48 and name HD2*) or (resid 48 and name HD1*))  5.000 3.2 0.0 
assign (resid 71 and name HB) (resid 71 and name HA) 2.800 1.0 0.0 
assign (resid 71 and name HG2*) (resid 71 and name HA) 3.400 1.6 0.0 
assign (resid 71 and name HG2*) (resid 71 and name HB) 2.800 1.0 0.0 
assign (resid 71 and name HG2*) (resid 37 and name HA) 5.000 3.2 0.0 
assign (resid 72 and name HB) (resid 72 and name HA) 5.000 3.2 0.0 
assign (resid 72 and name HG1*) (resid 72 and name HA) 5.000 3.2 0.0 
assign (resid 72 and name HG2*) (resid 72 and name HA) 5.000 3.2 0.0 
assign (resid 35 and name HA) (resid 73 and name HA) 5.000 3.2 0.0 
assign (resid 73 and name HB*) (resid 73 and name HA) 3.400 1.6 0.0 
assign (resid 74 and name HB*) (resid 74 and name HA) 5.000 3.2 0.0 
assign (resid 76 and name HB*) (resid 72 and name HA) 5.000 3.2 0.0 
assign (resid 76 and name HB*) ((resid 72 and name HG2*) or (resid 72 and name HG1*))  5.000 3.2 0.0 
assign (resid 76 and name HB*) (resid 76 and name HG*) 5.000 3.2 0.0 
assign (resid 77 and name HB*) (resid 74 and name HA) 5.000 3.2 0.0 
assign (resid 77 and name HB*) (resid 77 and name HA) 5.000 3.2 0.0 
assign (resid 75 and name HA) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  5.000 3.2 0.4 
assign (resid 78 and name HG) (resid 75 and name HA) 5.000 3.2 0.0 
assign (resid 78 and name HB*) (resid 78 and name HA) 5.000 3.2 0.0 
assign (resid 78 and name HA) ((resid 78 and name HD2*) or (resid 78 and name HD1*))  5.000 3.2 0.0 
assign (resid 79 and name HB) (resid 79 and name HA) 5.000 3.2 0.0 
assign (resid 79 and name HG1*) (resid 79 and name HA) 5.000 3.2 0.0 
assign (resid 79 and name HG2*) (resid 79 and name HA) 3.400 1.6 1.6 
assign (resid 80 and name HA) ((resid 64 and name HG1*) or (resid 64 and name HG2*))  5.000 3.2 0.0 
assign (resid 80 and name HB*) (resid 80 and name HA) 5.000 3.2 0.0 
assign (resid 80 and name HG*) (resid 80 and name HA) 5.000 3.2 0.0 
assign (resid 81 and name HB*) (resid 78 and name HA) 5.000 3.2 0.0 
assign (resid 81 and name HG*) (resid 78 and name HA) 5.000 3.2 0.0 
assign (resid 80 and name HA) (resid 81 and name HA) 5.000 3.2 0.0 
assign (resid 79 and name HA) ((resid 82 and name HG2*) or (resid 82 and name HG1*))  5.000 3.2 0.0 
assign (resid 82 and name HA) ((resid 82 and name HG2*) or (resid 82 and name HG1*))  5.000 3.2 0.0 
assign (resid 83 and name HD*) ((resid 64 and name HG1*) or (resid 64 and name HG2*))  5.000 3.2 0.0 
assign (resid 83 and name HB*) (resid 83 and name HA) 3.400 1.6 0.0 
assign (resid 83 and name HB*) (resid 83 and name HD*) 5.000 3.2 0.0 
assign (resid 83 and name HG*) (resid 83 and name HD*) 5.000 3.2 0.0 
assign (resid 83 and name HG*) (resid 83 and name HA) 5.000 3.2 0.0 
assign (resid 84 and name HB*) (resid 84 and name HA) 3.400 1.6 0.0 
assign (resid 85 and name HB*) (resid 85 and name HA) 3.400 1.6 0.0 
assign (resid 86 and name HD*) (resid 86 and name HA) 5.000 3.2 0.0 
assign (resid 86 and name HG*) (resid 86 and name HA) 5.000 3.2 0.0 
assign (resid 87 and name HB*) (resid 89 and name HB*) 5.000 3.2 0.0 
assign (resid 4 and name HD1*) (resid 4 and name HB) 5.000 3.2 0.0 
assign ((resid 4 and name HD1*) or (resid 4 and name HG2*)) (resid 4 and name HG1*) 5.000 3.2 0.0 
assign (resid 4 and name HG1*) (resid 4 and name HB) 2.800 1.0 0.0 
assign (resid 4 and name HG2*) (resid 4 and name HB) 5.000 3.2 0.0 
assign (resid 12 and name HD1*) (resid 12 and name HB*) 5.000 3.2 0.0 
assign (resid 12 and name HD2*) (resid 12 and name HB*) 5.000 3.2 0.0 
assign (resid 17 and name HG*) (resid 17 and name HB*) 3.400 1.6 0.0 
assign (resid 21 and name HG*) (resid 21 and name HB*) 5.000 3.2 0.0 
assign (resid 21 and name HD*) (resid 21 and name HG*) 5.000 3.2 0.0 
assign (resid 28 and name HG1*) (resid 28 and name HB) 5.000 3.2 0.0 
assign (resid 28 and name HG2*) (resid 28 and name HG1*) 3.400 1.6 0.0 
assign ((resid 36 and name HD1*) or (resid 36 and name HG2*)) (resid 36 and name HB) 5.000 3.2 0.0 
assign ((resid 36 and name HD1*) or (resid 36 and name HG2*)) (resid 36 and name HG1*) 5.000 3.2 0.0 
assign ((resid 41 and name HD2*) or (resid 41 and name HD1*)) (resid 41 and name HB*) 5.000 3.2 0.0 
assign ((resid 41 and name HD2*) or (resid 41 and name HD1*)) (resid 41 and name HG) 5.000 3.2 0.0 
assign (resid 43 and name HG*) (resid 43 and name HB*) 5.000 3.2 0.0 
assign (resid 45 and name HE*) (resid 45 and name HB*) 3.400 1.6 0.0 
assign (resid 45 and name HE*) (resid 45 and name HG*) 5.000 3.2 0.0 
assign ((resid 48 and name HD1*) or (resid 48 and name HD2*)) (resid 48 and name HB*) 5.000 3.2 0.0 
assign (resid 48 and name HD1*) (resid 48 and name HG) 5.000 3.2 0.0 
assign (resid 48 and name HD2*) (resid 48 and name HG) 5.000 3.2 0.0 
assign (resid 50 and name HB*) (resid 50 and name HG*) 2.800 1.0 0.0 
assign (resid 61 and name HD1*) (resid 61 and name HB) 5.000 3.2 0.0 
assign (resid 61 and name HG1*) (resid 61 and name HB) 2.800 1.0 0.0 
assign (resid 61 and name HD1*) (resid 61 and name HG1*) 5.000 3.2 0.0 
assign (resid 61 and name HG2*) (resid 61 and name HG1*) 5.000 3.2 0.0 
assign ((resid 64 and name HG1*) or (resid 64 and name HG2*)) (resid 64 and name HB) 3.400 1.6 0.0 
assign ((resid 36 and name HD1*) or (resid 36 and name HG2*)) (resid 72 and name HB) 5.000 3.2 0.0 
assign (resid 72 and name HG1*) (resid 72 and name HB) 5.000 3.2 0.0 
assign (resid 72 and name HG2*) (resid 72 and name HB) 5.000 3.2 0.0 
assign (resid 72 and name HG1*) (resid 72 and name HG2*) 5.000 3.2 0.0 
assign ((resid 41 and name HD2*) or (resid 41 and name HD1*)) (resid 45 and name HG*) 5.000 3.2 0.0 
assign (resid 72 and name HG1*) (resid 76 and name HB*) 5.000 3.2 0.0 
assign (resid 72 and name HG2*) (resid 76 and name HB*) 5.000 3.2 0.0 
assign ((resid 78 and name HD2*) or (resid 78 and name HD1*)) (resid 78 and name HB*) 5.000 3.2 0.0 
assign (resid 79 and name HG1*) (resid 79 and name HB) 5.000 3.2 0.0 
assign (resid 79 and name HG2*) (resid 79 and name HB) 5.000 3.2 0.0 
assign ((resid 64 and name HG1*) or (resid 64 and name HG2*)) (resid 80 and name HG*) 5.000 3.2 0.0 
assign (resid 80 and name HB*) (resid 80 and name HG*) 5.000 3.2 0.0 
assign (resid 81 and name HG*) (resid 81 and name HB*) 5.000 3.2 0.0 
assign (resid 82 and name HG1*) (resid 82 and name HG2*) 3.400 1.6 0.0 
assign (resid 85 and name HB*) (resid 85 and name HG*) 5.000 3.2 0.0 
assign (resid 3 and name HN) (resid 2 and name HB*) 5.000 3.2 0.0 
assign (resid 4 and name HN) (resid 2 and name HB*) 5.000 3.2 0.0 
assign (resid 5 and name HN) (resid 2 and name HB*) 5.000 3.2 0.0 
assign (resid 5 and name HN) ((resid 4 and name HD1*) or (resid 4 and name HG2*)) 5.000 3.2 0.0 
assign (resid 8 and name HN) (resid 6 and name HA) 5.000 3.2 0.0 
assign (resid 9 and name HN) (resid 5 and name HA) 5.000 3.2 0.0 
assign (resid 9 and name HN) (resid 6 and name HD*) 5.000 3.2 0.2 
assign (resid 11 and name HN) (resid 8 and name HB*) 5.000 3.2 0.1 
assign (resid 13 and name HN) (resid 12 and name HN) 5.000 3.2 0.0 
assign (resid 13 and name HN) (resid 13 and name HG1) 5.000 3.2 0.0 
assign (resid 14 and name HN) (resid 15 and name HB*) 5.000 3.2 0.1 
assign (resid 13 and name HN) (resid 16 and name HB*) 2.800 1.0 0.4 
assign (resid 17 and name HN) (resid 17 and name HG*) 3.400 1.6 0.7 
assign (resid 15 and name HN) (resid 18 and name HB*) 5.000 3.2 0.0 
assign (resid 21 and name HN) (resid 19 and name HA) 5.000 3.2 0.0 
assign (resid 24 and name HN) (resid 21 and name HD*) 5.000 3.2 0.0 
assign (resid 21 and name HN) (resid 21 and name HG*) 5.000 3.2 0.0 
assign (resid 22 and name HN) (resid 21 and name HG*) 5.000 3.2 0.0 
assign (resid 23 and name HN) (resid 21 and name HA) 5.000 3.2 0.0 
assign (resid 23 and name HN) (resid 21 and name HN) 5.000 3.2 0.0 
assign (resid 25 and name HN) (resid 21 and name HD*) 5.000 3.2 0.0 
assign (resid 26 and name HN) (resid 24 and name HA) 5.000 3.2 0.0 
assign (resid 25 and name HN) (resid 26 and name HG1*) 5.000 3.2 0.0 
assign (resid 27 and name HN) (resid 23 and name HA) 5.000 3.2 0.0 
assign (resid 27 and name HN) (resid 25 and name HA) 5.000 3.2 0.0 
assign (resid 27 and name HN) (resid 26 and name HG1*) 5.000 3.2 0.0 
assign (resid 25 and name HN) (resid 21 and name HG*) 5.000 3.2 0.0 
assign (resid 27 and name HN) (resid 28 and name HG1*) 5.000 3.2 0.0 
assign (resid 29 and name HN) (resid 27 and name HA) 5.000 3.2 0.0 
assign (resid 31 and name HN) (resid 28 and name HD1*) 5.000 3.2 0.0 
assign (resid 30 and name HN) (resid 31 and name HB*) 5.000 3.2 0.0 
assign (resid 31 and name HN) (resid 30 and name HB*) 5.000 3.2 0.0 
assign (resid 33 and name HN) (resid 32 and name HG*) 5.000 3.2 0.0 
assign (resid 35 and name HN) (resid 33 and name HB*) 5.000 3.2 0.0 
assign (resid 35 and name HN) (resid 36 and name HN) 5.000 3.2 0.0 
assign (resid 40 and name HN) ((resid 36 and name HD1*) or (resid 36 and name HG2*)) 5.000 3.2 0.2 
assign (resid 40 and name HN) (resid 39 and name HG*) 5.000 3.2 0.0 
assign (resid 42 and name HN) (resid 40 and name HA) 5.000 3.2 0.0 
assign (resid 43 and name HN) (resid 40 and name HB*) 5.000 3.2 0.0 
assign (resid 43 and name HN) ((resid 57 and name HD1*) or (resid 57 and name HD2*)) 5.000 3.2 0.5 
assign (resid 46 and name HN) (resid 42 and name HA*) 5.000 3.2 0.4 
assign (resid 20 and name HN) ((resid 48 and name HD2*) or (resid 48 and name HD1*)) 5.000 3.2 0.0 
assign (resid 51 and name HN) (resid 50 and name HB*) 5.000 3.2 0.0 
assign (resid 53 and name HN) (resid 54 and name HD*) 5.000 3.2 0.0 
assign (resid 55 and name HN) (resid 54 and name HB*) 2.800 1.0 0.8 
assign (resid 56 and name HN) (resid 54 and name HA) 5.000 3.2 0.0 
assign (resid 60 and name HN) (resid 58 and name HA) 5.000 3.2 0.0 
assign (resid 60 and name HN) (resid 61 and name HB) 5.000 3.2 0.0 
assign (resid 60 and name HN) (resid 61 and name HG1*) 5.000 3.2 0.0 
assign (resid 63 and name HN) (resid 61 and name HA) 5.000 3.2 0.0 
assign (resid 64 and name HN) (resid 63 and name HG*) 5.000 3.2 0.0 
assign (resid 65 and name HN) (resid 62 and name HA) 5.000 3.2 0.0 
assign (resid 68 and name HN) (resid 65 and name HA) 5.000 3.2 0.0 
assign (resid 68 and name HN) (resid 65 and name HB*) 5.000 3.2 0.0 
assign (resid 70 and name HN) (resid 38 and name HG2*) 5.000 3.2 0.0 
assign (resid 36 and name HN) (resid 73 and name HA) 5.000 3.2 0.0 
assign (resid 73 and name HN) (resid 72 and name HB) 5.000 3.2 0.0 
assign (resid 21 and name HN) (resid 74 and name HZ) 3.400 1.6 0.0 
assign (resid 77 and name HN) (resid 24 and name HE*) 5.000 3.2 0.0 
assign (resid 77 and name HN) ((resid 72 and name HG1*) or (resid 72 and name HG2*)) 5.000 3.2 0.0 
assign (resid 77 and name HN) (resid 76 and name HG*) 5.000 3.2 0.0 
assign (resid 79 and name HN) (resid 80 and name HB*) 5.000 3.2 0.0 
assign (resid 77 and name HN) ((resid 79 and name HG2*) or (resid 79 and name HG1*)) 5.000 3.2 0.0 
assign (resid 79 and name HN) (resid 77 and name HA) 5.000 3.2 0.0 
assign (resid 81 and name HN) (resid 80 and name HG*) 5.000 3.2 0.0 
assign (resid 82 and name HN) (resid 81 and name HG*) 5.000 3.2 0.0 
assign (resid 84 and name HN) (resid 80 and name HA) 5.000 3.2 0.0 
assign (resid 84 and name HN) (resid 83 and name HG*) 5.000 3.2 0.0 
assign (resid 84 and name HN) (resid 85 and name HB*) 5.000 3.2 0.0 
assign (resid 86 and name HN) (resid 85 and name HG*) 5.000 3.2 0.0 
assign (resid 86 and name HN) (resid 86 and name HD*) 5.000 3.2 0.0 
assign (resid 2 and name HD21) (resid 2 and name HA) 3.400 1.6 0.0 
assign (resid 2 and name HD21) (resid 2 and name HB2) 5.000 3.2 0.0 
assign (resid 2 and name HD22) (resid 2 and name HA) 3.400 1.6 0.0 
assign (resid 2 and name HD21) (resid 2 and name HB1) 5.000 3.2 0.0 
assign (resid 16 and name HE2*) (resid 12 and name HD2*) 5.000 3.2 0.0 
assign (resid 16 and name HE21) (resid 16 and name HB*) 5.000 3.2 0.0 
assign (resid 16 and name HE22) (resid 16 and name HB*) 3.400 1.6 1.6 
assign (resid 18 and name HD2*) (resid 15 and name HA) 5.000 3.2 0.0 
assign (resid 18 and name HD21) (resid 18 and name HB1) 5.000 3.2 0.0 
assign (resid 18 and name HD21) (resid 18 and name HB2) 5.000 3.2 0.0 
assign (resid 18 and name HD22) (resid 18 and name HB1) 5.000 3.2 0.0 
assign (resid 18 and name HD22) (resid 18 and name HB2) 3.400 1.6 1.6 
assign (resid 29 and name HE21) (resid 29 and name HG*) 5.000 3.2 0.0 
assign (resid 29 and name HE22) (resid 29 and name HG*) 5.000 3.2 0.0 
assign (resid 50 and name HE21) (resid 50 and name HB*) 5.000 3.2 0.0 
assign (resid 50 and name HE22) (resid 50 and name HB*) 3.400 1.6 1.6 
assign (resid 51 and name HD21) (resid 51 and name HB1) 5.000 3.2 0.0 
assign (resid 51 and name HD21) (resid 51 and name HB2) 5.000 3.2 0.0 
assign (resid 51 and name HD22) (resid 51 and name HB1) 5.000 3.2 0.0 
assign (resid 51 and name HD22) (resid 51 and name HB2) 5.000 3.2 0.0 
assign (resid 58 and name HE2*) ((resid 57 and name HD1*) or (resid 57 and name HD2*)) 5.000 3.2 0.0 
assign (resid 58 and name HE2*) (resid 58 and name HA) 5.000 3.2 0.0 
assign (resid 58 and name HE21) (resid 58 and name HG*) 3.400 1.6 0.4 
assign (resid 58 and name HE22) (resid 58 and name HG*) 3.400 1.6 0.4 
assign (resid 58 and name HE21) (resid 61 and name HG2*) 5.000 3.2 0.0 
assign (resid 58 and name HE22) (resid 61 and name HG2*) 5.000 3.2 0.0 
assign (resid 28 and name HG1*) (resid 24 and name HD*) 5.000 3.2 0.0 
assign (resid 74 and name HZ) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  5.000 3.2 0.0 
assign (resid 20 and name HE*) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  3.400 1.6 1.6 
assign (resid 74 and name HE*) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  3.400 1.6 1.6 
assign (resid 77 and name HD*) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  5.000 3.2 0.0 
assign (resid 20 and name HB1) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  5.000 3.2 0.0 
assign (resid 20 and name HB2) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  5.000 3.2 0.0 
assign (resid 36 and name HN) ((resid 72 and name HG2*) or (resid 72 and name HG1*)) 5.000 3.2 0.3 
assign (resid 10 and name HN) (resid 7 and name HA) 5.000 3.2 0.2 
assign (resid 10 and name HN) (resid 11 and name HA) 	 2.471 0.771 2.729
assign (resid 10 and name HN) (resid 6 and name HA) 	 2.471 0.771 2.529
assign (resid 58 and name HA) (resid 62 and name HN) 	 2.785 1.085 2.215
assign (resid 38 and name HN) ((resid 37 and name HB2) or (resid 37 and name HB1))  	 2.785 1.085 2.215
assign (resid 38 and name HN) ((resid 72 and name HG2*) or (resid 72 and name HG1*))  	 2.785 1.085 2.215
assign (resid 57 and name HG) (resid 58 and name HN) 	 2.785 1.085 2.215
assign (resid 58 and name HE22) (resid 61 and name HB) 	 2.438 0.738 2.562
assign (resid 58 and name HE2*) (resid 58 and name HB*) 	 2.438 0.738 2.562
assign (resid 58 and name HE2*) (resid 58 and name HA) 	 2.438 0.738 2.562
assign (resid 58 and name HE21) (resid 61 and name HB) 	 2.438 0.738 2.562
assign (resid 58 and name HE2*) ((resid 57 and name HD1*) or (resid 57 and name HD2*))  	 2.438 0.738 2.562
assign (resid 40 and name HN) ((resid 39 and name HD1) or (resid 39 and name HD2))  	 2.438 0.738 2.562
assign (resid 22 and name HB*) (resid 25 and name HN) 	 2.438 0.738 3.262
assign (resid 84 and name HN) ((resid 82 and name HG1*) or (resid 82 and name HG2*))  	 2.438 0.738 3.062
assign (resid 52 and name HA) (resid 53 and name HN) 	 2.438 0.738 2.562
assign (resid 35 and name HN) ((resid 28 and name HD1*) or (resid 28 and name HD2*))  	 2.481 0.781 2.519
assign (resid 2 and name HD22) (resid 2 and name HB2) 5.000 3.2 0.0 
assign (resid 2 and name HD22) (resid 2 and name HB1) 5.000 3.2 0.0 
assign (resid 69 and name HA) (resid 68 and name HN) 5.000 3.2 0.0 
assign (resid 80 and name HE*) (resid 77 and name HD*) 5.000 3.2 0.0 
assign (resid 80 and name HB*) (resid 20 and name HE*) 5.000 3.2 0.0 
assign (resid 20 and name HE*) ((resid 78 and name HD1*) or (resid 78 and name HD2*))  5.000 3.2 0.0 
assign (resid 47 and name HA) (resid 47 and name HG*) 5.000 3.2 0.0 
assign (resid 25 and name HA) (resid 28 and name HG1*) 5.000 3.2 0.0 
assign (resid 59 and name HA) (resid 62 and name HB*) 5.000 3.2 0.0 
assign (resid 75 and name HA) (resid 75 and name HB*) 5.000 3.2 0.0 
assign (resid 28 and name HA) (resid 31 and name HB*) 5.000 3.2 0.0 
assign (resid 58 and name HA) (resid 58 and name HB*) 5.000 3.2 0.0 
assign (resid 16 and name HA) (resid 16 and name HG*) 5.000 3.2 0.0 
assign (resid 28 and name HG2*) (resid 34 and name HA*) 5.000 3.2 0.0 
assign (resid 10 and name HA) ((resid 9 and name HG2*) or (resid 9 and name HG1*))  5.000 3.2 0.0 
assign (resid 81 and name HB*) (resid 81 and name HA) 5.000 3.2 0.0 
assign (resid 4 and name HG1*) (resid 4 and name HA) 5.000 3.2 0.0 
assign (resid 61 and name HG2*) (resid 38 and name HA) 5.000 3.2 0.0 
assign (resid 9 and name HB) (resid 9 and name HA) 5.000 3.2 0.0 
assign (resid 36 and name HD1*) ((resid 72 and name HG2*) or (resid 72 and name HG1*)) 5.000 3.2 0.0 
assign (resid 41 and name HG) ((resid 41 and name HD2*) or (resid 41 and name HD1*))  5.000 3.2 0.0 
assign (resid 77 and name HN) (resid 74 and name HD*) 5.000 3.2 0.1 
assign (resid 12 and name HN) (resid 10 and name HN) 5.000 3.2 0.0 
assign (resid 22 and name HN) (resid 20 and name HN) 5.000 3.2 0.0
assign (resid 5 and name HD*) (resid 4 and name HN) 5.000 3.2 0.0 
assign (resid 5 and name HE*) (resid 4 and name HN) 5.000 3.2 0.3 
assign (resid 24 and name HE*) (resid 36 and name HN) 5.000 3.2 0.0 
assign (resid 24 and name HZ) (resid 36 and name HN) 5.000 3.2 0.0 
assign (resid 73 and name HN) (resid 74 and name HN) 5.000 3.2 0.0 
assign (resid 67 and name HN) (resid 69 and name HN) 5.000 3.2 0.0 
assign (resid 28 and name HN) (resid 26 and name HN) 5.000 3.2 0.0 
assign (resid 71 and name HG2*) (resid 70 and name HN) 5.000 3.2 0.0 
assign (resid 69 and name HB*) (resid 70 and name HN) 5.000 3.2 0.0 
assign (resid 65 and name HB*) (resid 67 and name HN) 5.000 3.2 0.0 
assign (resid 85 and name HN) ((resid 4 and name HG12) or (resid 4 and name HG11)) 5.000 3.2 0.4 


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