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 |
|
|
17037 |
2b6f   |
cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
set message=off echo=off end ! Q137 assign (resid 137 and name HA )(resid 137 and name HN ) 2.852 0.404 0.471 assign (resid 137 and name HN )(resid 137 and name HA ) 3.224 0.582 0.710 assign (resid 137 and name HB1 )(resid 137 and name HN ) 3.263 0.463 0.539 assign (resid 137 and name HB2 )(resid 137 and name HN ) 2.623 0.372 0.434 assign (resid 137 and name HG# )(resid 137 and name HN ) 2.646 0.375 0.437 assign (resid 137 and name HE22 )(resid 137 and name HN ) 3.972 0.563 0.657 assign (resid 137 and name HN )(resid 137 and name HE22 ) 4.944 0.701 0.817 assign ((resid 137 and name HE21 ) or ((resid 92 or resid 94) and name HE# ))(resid 137 and name HN ) 3.636 0.516 0.601 assign (resid 137 and name HN )(resid 137 and name HE22 ) 5.422 0.769 0.896 assign (resid 137 and name HG# )(resid 137 and name HA ) 2.819 0.508 0.620 assign (resid 137 and name HA )(resid 137 and name HE21 ) 4.505 0.639 0.745 assign (resid 137 and name HB1 )(resid 137 and name HE21 ) 4.489 0.637 0.742 assign (resid 137 and name HB2 )(resid 137 and name HE21 ) 4.757 0.675 0.786 assign (resid 137 and name HG# )(resid 137 and name HE21 ) 2.770 0.392 0.458 assign (resid 137 and name HA )(resid 137 and name HE22 ) 4.476 0.635 0.740 assign (resid 137 and name HB1 )(resid 137 and name HE22 ) 5.383 0.763 0.890 assign (resid 137 and name HB2 )(resid 137 and name HE22 ) 5.447 0.772 0.900 assign (resid 137 and name HG# )(resid 137 and name HE22 ) 3.172 0.450 0.524 assign ((resid 136 and name HN ) or (resid 92 and name HD# ))(resid 137 and name HN ) 3.789 0.537 0.626 assign (resid 137 and name HN )(resid 136 and name HN ) 4.632 0.657 0.766 assign (resid 136 and name HA )(resid 137 and name HN ) 1.995 0.283 0.330 assign (resid 137 and name HN )(resid 136 and name HA ) 2.350 0.424 0.517 assign (resid 136 and name HB1 )(resid 137 and name HN ) 3.708 0.526 0.613 assign (resid 136 and name HB2 )(resid 137 and name HN ) 3.251 0.461 0.537 assign (resid 136 and name HD2# )(resid 137 and name HN ) 3.157 0.448 0.521 assign (resid 137 and name HN )(resid 136 and name HD2# ) 3.593 0.648 0.791 assign (resid 136 and name HD1# )(resid 137 and name HA ) 4.000 0.500 999.0 assign (resid 136 and name HD2# )(resid 137 and name HA ) 4.000 0.500 999.0 assign ((resid 137 or resid 51) and name HN )(resid 92 and name HD# ) 4.064 0.672 0.821 assign ((resid 137 or resid 51) and name HN )(resid 92 and name HE# ) 3.811 0.630 0.770 assign (resid 88 and name HN )(resid 137 and name HA ) 3.004 0.542 0.661 assign (resid 137 and name HN )(resid 88 and name HN ) 5.000 0.500 999.0 assign (resid 137 and name HA )(resid 88 and name HN ) 2.659 0.377 0.440 assign (resid 137 and name HB1 )(resid 88 and name HN ) 4.084 0.579 0.675 assign (resid 137 and name HA )(resid 88 and name HE21 ) 4.508 0.639 0.745 assign (resid 137 and name HB1 )(resid 88 and name HE21 ) 3.515 0.499 0.581 assign (resid 137 and name HB2 )(resid 88 and name HE21 ) 4.221 0.599 0.698 assign (resid 137 and name HE21 )(resid 88 and name HE21 ) 5.000 0.500 999.0 assign (resid 137 and name HE22 )(resid 88 and name HE21 ) 5.000 0.500 999.0 assign (resid 137 and name HB1 )(resid 88 and name HE22 ) 3.673 0.521 0.608 assign (resid 137 and name HB2 )(resid 88 and name HE22 ) 4.460 0.633 0.737 assign (resid 87 and name HN )(resid 137 and name HN ) 4.143 0.588 0.685 assign (resid 87 and name HN )(resid 137 and name HA ) 2.737 0.494 0.602 assign (resid 137 and name HA )(resid 87 and name HN ) 2.378 0.337 0.393 assign (resid 137 and name HB1 )(resid 87 and name HN ) 4.175 0.592 0.690 assign (resid 137 and name HB2 )(resid 87 and name HN ) 5.000 0.500 999.0 assign (resid 137 and name HG1 )(resid 87 and name HN ) 5.000 0.500 999.0 assign (resid 137 and name HG2 )(resid 87 and name HN ) 5.000 0.500 999.0 assign (resid 87 and name HB# )(resid 137 and name HA ) 2.653 0.479 0.584 assign (resid 137 and name HA )(resid 87 and name HB# ) 2.869 0.518 0.631 assign (resid 87 and name HN )(resid 137 and name HE21 ) 5.000 0.500 999.0 assign (resid 87 and name HN )(resid 137 and name HE22 ) 5.000 0.500 999.0 assign (resid 87 and name HB# )(resid 137 and name HE21 ) 3.786 0.537 0.626 assign (resid 137 and name HE21 )(resid 87 and name HB# ) 4.104 0.740 0.903 assign (resid 87 and name HB# )(resid 137 and name HE22 ) 3.512 0.498 0.580 assign (resid 137 and name HE22 )(resid 87 and name HB# ) 3.287 0.593 0.723 assign (resid 86 and name HA2 )(resid 137 and name HA ) 3.335 0.602 0.734 assign (((resid 137 or resid 84) and name HA) or (resid 89 and name HA1 ))(resid 86 and name HN ) 4.001 0.568 0.661 ! L136 assign (resid 136 and name HA )(resid 136 and name HN ) 3.164 0.449 0.523 assign (resid 136 and name HN )(resid 136 and name HA ) 2.791 0.503 0.614 assign (resid 136 and name HB1 )(resid 136 and name HN ) 2.834 0.402 0.468 assign (resid 136 and name HB2 )(resid 136 and name HN ) 3.389 0.481 0.560 assign (resid 136 and name HG )(resid 136 and name HN ) 2.454 0.348 0.406 assign (resid 136 and name HD1# )(resid 136 and name HN ) 3.358 0.476 0.555 assign ((resid 136 and name HN) or (resid 92 and name HD#))((resid 136 and name HD1#) or (resid 125 and name HD2#)) 3.29 0.59 0.72 assign (resid 136 and name HD2# )(resid 136 and name HN ) 3.378 0.479 0.558 assign ((resid 136 and name HN ) or (resid 92 and name HD# ))(resid 136 and name HD2# ) 3.501 0.632 0.771 assign (resid 136 and name HD1# )(resid 136 and name HA ) 3.866 0.697 0.851 assign (resid 136 and name HA )(resid 136 and name HD2# ) 2.473 0.461 0.544 assign (resid 136 and name HD2# )(resid 136 and name HA ) 2.264 0.408 0.498 assign (resid 135 and name HN )(resid 136 and name HN ) 4.575 0.649 0.756 assign ((resid 136 and name HN ) or (resid 92 and name HD# ))(resid 135 and name HN ) 3.571 0.506 0.590 assign (resid 135 and name HA )(resid 136 and name HN ) 2.359 0.334 0.390 assign (resid 136 and name HN )(resid 135 and name HA ) 2.349 0.424 0.517 assign (resid 135 and name HB1 )(resid 136 and name HN ) 4.592 0.651 0.759 assign (resid 135 and name HB2 )(resid 136 and name HN ) 4.273 0.606 0.706 assign (resid 136 and name HG )(resid 135 and name HA ) 3.583 0.646 0.789 assign (resid 136 and name HD2# )(resid 135 and name HN ) 3.938 0.558 0.651 assign ((resid 136 and name HN ) or (resid 92 and name HD# ))(resid 135 and name HB2 ) 3.382 0.610 0.744 assign (resid 134 and name HG1 )(resid 136 and name HD2# ) 3.651 0.659 0.803 assign (resid 134 and (name HG2 or name HB2 ))(resid 136 and name HN ) 4.378 0.621 0.724 assign (resid 134 and (name HG2 or name HB2 ))(resid 136 and name HD2# ) 3.064 0.553 0.674 assign (resid 134 and name HD1 )((resid 136 and name HD1# ) or (resid 125 and name HD2#)) 4.102 0.740 0.903 assign (resid 122 and name HD1# )(resid 136 and name HN ) 3.751 0.532 0.620 assign (resid 136 and name HN )((resid 122 and name HD1# ) or (resid 125 and name HD2#)) 4.017 0.725 0.884 assign (resid 136 and name HN )(resid 122 and name HD2# ) 3.852 0.695 0.848 assign ((resid 136 and name HD1#) or (resid 125 and name HD*))(resid 94 and name HD#) 2.971 0.491 0.600 assign ((resid 136 and name HD1#) or (resid 125 and name HD*))(resid 94 and name HE#) 2.468 0.408 0.499 assign ((resid 122 or resid 82) and name HD*)((resid 125 and name HD2#) or (resid 136 and name HD1#)) 2.812 0.507 0.619 assign (resid 84 and (name HD* or name HG2#))((resid 125 and name HD2#) or (resid 136 and name HD1#)) 2.803 0.506 0.617 assign (resid 136 and name HD2# )(resid 122 and name HD1# ) 4.500 0.500 999.0 assign (resid 136 and name HD2# )(resid 122 and name HD2# ) 4.500 0.500 999.0 assign (resid 136 and name HD2# )(resid 94 and name HE# ) 3.206 0.530 0.648 assign ((resid 136 and name HB1 ) or (resid 84 and name HG11 ))(resid 92 and name HD# ) 4.336 0.717 0.876 assign ((resid 136 and name HB2 ) or (resid 48 and name HG* ))(resid 92 and name HD# ) 3.960 0.655 0.800 assign ((resid 136 and name HD1# ) or (resid 125 and name HD2# ))(resid 92 and name HD# ) 3.307 0.547 0.668 assign (resid 136 and name HD2# )(resid 92 and name HD# ) 3.419 0.551 0.673 assign ((resid 92 or resid 94) and name HE# )((resid 136 and name HD1# ) or (resid 125 and name HD2#)) 3.217 0.580 0.708 assign ((resid 92 or resid 94) and name HE# )(resid 136 and name HD2# ) 3.386 0.611 0.745 assign ((resid 136 or resid 87) and name HA )(resid 92 and name HE# ) 3.800 0.628 0.768 assign ((resid 136 and name HB1 ) or (resid 84 and name HG11 ))(resid 92 and name HE# ) 3.782 0.625 0.764 assign ((resid 136 and name HB2 ) or (resid 48 and name HG* ))(resid 92 and name HE# ) 3.291 0.544 0.665 assign (resid 136 and name HD2# )(resid 92 and name HE# ) 3.186 0.527 0.644 assign ((resid 136 and name HB1 ) or (resid 85 and name HG1 ))(resid 86 and name HN ) 4.338 0.615 0.717 assign (resid 136 and name HB2 )(resid 86 and name HN ) 4.590 0.651 0.759 assign (resid 136 and name HD1# )(resid 86 and name HN ) 4.748 0.673 0.785 assign (resid 86 and name HN )((resid 136 and name HD1# ) or (resid 125 and name HD2#)) 3.911 0.706 0.861 assign (resid 136 and name HD1# )(resid 85 and name HA ) 3.977 0.718 0.875 assign (resid 85 and name HA )((resid 136 and name HD1# ) or (resid 125 and name HD2#)) 4.045 0.730 0.890 assign (resid 136 and name HD2# )(resid 85 and name HA ) 4.388 0.792 0.966 assign (resid 85 and name HA )(resid 136 and name HD2# ) 4.456 0.804 0.980 assign ((resid 125 and name HD* ) or (resid 136 and name HD1# ))(resid 84 and name HD* ) 2.475 0.446 0.545 assign ((resid 125 and name HD* ) or (resid 136 and name HD1# ))(resid 84 and name HG2# ) 2.556 0.461 0.563 assign ((resid 125 and name HD* ) or (resid 136 and name HD1# ))(resid 82 and name HD1# ) 3.301 0.595 0.726 assign (resid 136 and name HD2# )(resid 84 and name HG2# ) 4.500 0.500 999.0 assign (resid 136 and name HD2# )(resid 84 and name HD* ) 4.500 0.500 999.0 ! D135 assign (resid 135 and name HA )(resid 135 and name HN ) 2.799 0.397 0.463 assign (resid 135 and name HN )(resid 135 and name HA ) 3.497 0.631 0.770 assign (resid 135 and name HB1 )(resid 135 and name HN ) 2.348 0.333 0.388 assign (resid 135 and name HB2 )(resid 135 and name HN ) 2.285 0.324 0.378 assign (resid 134 and name HA )(resid 135 and name HN ) 2.168 0.307 0.358 assign (resid 135 and name HN )(resid 134 and name HA ) 2.395 0.432 0.527 assign (resid 134 and name HB1 )(resid 135 and name HN ) 2.643 0.375 0.437 assign (resid 134 and name HB2 )(resid 135 and name HN ) 2.856 0.405 0.472 assign (resid 122 and name HD1# )(resid 135 and name HA ) 3.412 0.616 0.751 assign (resid 135 and name HA )(resid 122 and name HD1# ) 3.949 0.712 0.869 assign (resid 135 and name HA )(resid 122 and name HD2# ) 3.945 0.712 0.868 ! P134 assign (resid 134 and name HD2 )(resid 134 and name HA ) 3.233 0.583 0.712 assign (resid 133 and name HG2# )(resid 134 and name HD1 ) 2.327 0.420 0.512 assign (resid 134 and name HD1 )(resid 133 and name HG2# ) 3.059 0.552 0.673 assign (resid 134 and name HD1 )(resid 133 and name HA ) 2.085 0.376 0.459 assign (resid 134 and name HD1 )(resid 133 and name HB ) 3.383 0.610 0.744 assign (resid 134 and name HD1 )(resid 129 and name HD2# ) 3.539 0.639 0.779 assign ((resid 134 and name HD2 ) or (resid 133 and name HA ))(resid 129 and name HD2# ) 3.011 0.543 0.663 assign (resid 134 and name HD1 )(resid 125 and name HD2# ) 4.007 0.723 0.882 ! T133 assign (resid 133 and name HN )(resid 133 and name HA ) 2.796 0.504 0.615 assign (resid 133 and name HN )(resid 133 and name HB ) 2.609 0.471 0.574 assign (resid 133 and name HG2# )(resid 133 and name HN ) 3.794 0.538 0.627 assign ((resid 132 or resid 123) and name HN )((resid 133 or resid 124) and name HN ) 2.558 0.363 0.423 assign ((resid 133 or resid 124) and name HN )((resid 132 or resid 123) and name HN ) 3.039 0.431 0.502 assign (resid 132 and name HA )(resid 133 and name HN ) 3.287 0.466 0.543 assign (resid 133 and name HN )(resid 132 and name HA ) 3.354 0.605 0.738 assign (resid 131 and name HA )(resid 133 and name HN ) 3.818 0.541 0.631 assign (resid 133 and name HN )(resid 131 and name HA ) 3.204 0.578 0.705 assign (resid 131 and name HB# )(resid 133 and name HN ) 4.790 0.679 0.792 assign (resid 133 and name HG2# )(resid 130 and name HN ) 5.000 0.500 999.0 assign (resid 133 and name HG2# )(resid 129 and name HN ) 4.008 0.568 0.663 assign (resid 129 and name HB1 )(resid 133 and name HN ) 4.298 0.609 0.710 assign (resid 129 and name HD* )(resid 133 and name HN ) 3.780 0.536 0.624 assign (resid 129 and name HD* )(resid 133 and name HA ) 2.494 0.450 0.549 assign (resid 133 and name HG2# )(resid 126 and name HN ) 3.782 0.536 0.625 assign (resid 126 and name HN )(resid 133 and name HG2# ) 3.613 0.652 0.795 assign (resid 126 and name HA )(resid 133 and name HG2# ) 3.486 0.629 0.767 assign (resid 133 and name HG2# )(resid 126 and name HA ) 3.691 0.666 0.812 assign (resid 126 and name HB# )(resid 133 and name HG2# ) 3.338 0.602 0.735 assign (resid 125 and name HG )(resid 133 and name HG2# ) 3.317 0.598 0.730 assign ((resid 125 and name HD* ) or (resid 136 and name HD1#))(resid 133 and name HA ) 3.123 0.563 0.687 assign ((resid 125 and name HD* ) or (resid 136 and name HD1#))(resid 133 and name HG2# ) 2.723 0.492 0.600 assign ((resid 122 and name HA ) or (resid 133 and name HB ))(resid 122 and name HD1# ) 3.361 0.606 0.740 assign ((resid 122 and name HA ) or (resid 133 and name HB ))(resid 122 and name HD2# ) 2.743 0.495 0.604 assign (resid 133 and name HG2# )(resid 125 and name HD1# ) 3.678 0.664 0.810 assign (resid 133 and name HG2# )(resid 122 and name HD1# ) 2.824 0.527 0.644 assign (resid 133 and name HG2# )(resid 122 and name HD2# ) 3.487 0.629 0.767 ! S132 assign (resid 132 and name HN )(resid 132 and name HA ) 3.387 0.611 0.746 assign (resid 132 and name HN )(resid 131 and name HA ) 3.540 0.639 0.779 assign (resid 131 and name HB# )(resid 132 and name HN ) 2.806 0.398 0.464 assign ((resid 129 or resid 122) and name HD* )((resid 132 or resid 123) and name HN ) 3.708 0.526 0.613 assign (resid 129 and name HD* )(resid 132 and name HB1 ) 3.376 0.609 0.743 ! A131 assign (resid 131 and name HA )(resid 131 and name HN ) 2.993 0.424 0.495 assign (resid 131 and name HB# )(resid 131 and name HN ) 2.613 0.371 0.432 assign (resid 130 and name HA1 )(resid 131 and name HN ) 3.528 0.500 0.583 assign (resid 130 and name HA2 )(resid 131 and name HN ) 3.973 0.563 0.657 ! G130 assign (resid 130 and name HA1 )(resid 130 and name HN ) 2.509 0.356 0.415 assign (resid 130 and name HN )(resid 130 and name HA1 ) 2.498 0.451 0.550 assign (resid 130 and name HA2 )(resid 130 and name HN ) 2.359 0.334 0.390 assign (resid 130 and name HN )(resid 130 and name HA2 ) 2.377 0.429 0.523 assign (resid 129 and name HN )(resid 130 and name HN ) 2.665 0.378 0.440 assign (resid 130 and name HN )(resid 129 and name HN ) 2.444 0.347 0.404 assign (resid 129 and name HA )(resid 130 and name HN ) 3.379 0.479 0.559 assign (resid 129 and name HB1 )(resid 130 and name HN ) 3.872 0.549 0.640 assign (resid 129 and name HB2 )(resid 130 and name HN ) 4.771 0.677 0.789 assign ((resid 129 and name HG ) or (resid 126 and name HG1 ))(resid 130 and name HN ) 3.763 0.534 0.622 assign ((resid 129 and name HD* ) or (resid 127 and name HG1# ))(resid 130 and name HN ) 4.125 0.585 0.682 assign (resid 130 and name HA1 )(resid 129 and name HN ) 3.787 0.537 0.626 assign (resid 130 and name HA2 )(resid 129 and name HN ) 4.271 0.606 0.706 assign (resid 128 and name HN )(resid 130 and name HN ) 3.845 0.545 0.636 assign (resid 130 and name HN )(resid 128 and name HN ) 3.866 0.548 0.639 assign (resid 128 and name HA )(resid 130 and name HN ) 4.101 0.582 0.678 assign (resid 128 and name HB1 )(resid 130 and name HN ) 5.257 0.745 0.869 assign (resid 127 and name HN )(resid 130 and name HN ) 4.685 0.664 0.774 assign (resid 127 and name HA )(resid 130 and name HN ) 5.424 0.769 0.897 assign (resid 126 and name HA )(resid 130 and name HN ) 2.872 0.407 0.475 assign (resid 130 and name HN )(resid 126 and name HA ) 2.840 0.512 0.625 assign (resid 126 and name HD1 )(resid 130 and name HN ) 5.296 0.751 0.875 ! L129 assign (resid 129 and name HA )(resid 129 and name HN ) 2.708 0.384 0.448 assign (resid 129 and name HN )(resid 129 and name HA ) 2.786 0.503 0.613 assign (resid 129 and name HB1 )(resid 129 and name HN ) 2.597 0.368 0.429 assign (resid 129 and name HB2 )(resid 129 and name HN ) 3.010 0.427 0.498 assign (resid 129 and name HG )(resid 129 and name HN ) 2.620 0.372 0.433 assign (resid 129 and name HD* )(resid 129 and name HN ) 2.784 0.395 0.460 assign (resid 129 and name HN )(resid 129 and name HD1# ) 3.685 0.665 0.811 assign (resid 129 and name HN )(resid 129 and name HD2# ) 4.010 0.723 0.883 assign (resid 129 and name HG )(resid 129 and name HA ) 2.972 0.536 0.654 assign (resid 129 and name HD* )(resid 129 and name HA ) 2.142 0.386 0.471 assign (resid 129 and name HA )(resid 129 and name HD1# ) 2.145 0.387 0.472 assign (resid 129 and name HA )(resid 129 and name HD2# ) 3.527 0.636 0.776 assign (resid 128 and name HN )(resid 129 and name HN ) 2.309 0.327 0.382 assign (resid 129 and name HN )(resid 128 and name HN ) 2.462 0.349 0.407 assign (resid 128 and name HA )(resid 129 and name HN ) 3.031 0.430 0.501 assign (resid 129 and name HN )(resid 128 and name HA ) 3.256 0.587 0.717 assign (resid 128 and name HB1 )(resid 129 and name HN ) 2.787 0.395 0.461 assign (resid 128 and name HB2 )(resid 129 and name HN ) 3.114 0.442 0.515 assign (resid 128 and name HD# )(resid 129 and name HN ) 3.371 0.478 0.557 assign (resid 129 and name HN )(resid 128 and name HD# ) 3.795 0.627 0.767 assign (resid 129 and name HB1 )(resid 128 and name HN ) 4.023 0.571 0.664 assign (resid 129 and name HG )(resid 128 and name HN ) 4.227 0.600 0.699 assign (resid 128 and name HB1 )(resid 129 and name HD1# ) 3.668 0.662 0.807 assign (resid 127 and name HN )(resid 129 and name HN ) 4.395 0.623 0.726 assign (resid 129 and name HN )(resid 127 and name HN ) 4.269 0.605 0.706 assign (resid 126 and name HA )(resid 129 and name HN ) 2.814 0.399 0.465 assign (resid 129 and name HN )(resid 126 and name HA ) 3.198 0.577 0.704 assign (resid 125 and name HD* )(resid 129 and name HN ) 3.884 0.551 0.642 assign (((resid 129 or resid 125) and name HB1) or (resid 82 and (name HB1 or name HG)))(resid 96 and name HD#) 3.513 0.581 0.710 assign (((resid 129 or resid 125) and name HB1) or (resid 82 and (name HB1 or name HG)))(resid 96 and name HE#) 3.456 0.571 0.698 assign (((resid 129 or resid 125) and name HB1) or (resid 82 and (name HB1 or name HG)))(resid 96 and name HZ ) 4.132 0.683 0.835 assign ((resid 129 and name HG ) or (resid 53 and name HB2 ))(resid 96 and name HD# ) 3.360 0.555 0.679 assign ((resid 129 and name HG ) or (resid 53 and name HB2 ))(resid 96 and name HE# ) 3.217 0.532 0.650 assign ((resid 129 and name HG ) or (resid 53 and name HB2 ))(resid 96 and name HZ ) 3.334 0.551 0.674 assign (resid 96 and (name HZ or name HE# ))(resid 129 and name HD1# ) 3.017 0.544 0.664 assign ((resid 129 and name HD* ) or (resid 82 and name HD1# ))(resid 96 and name HD# ) 2.836 0.469 0.573 assign ((resid 129 and name HD* ) or (resid 82 and name HD1# ))(resid 96 and name HE# ) 2.918 0.482 0.590 assign ((resid 129 and name HD* ) or (resid 82 and name HD1# ))(resid 96 and name HZ ) 3.191 0.527 0.645 assign ((resid 129 and name HG ) or (resid 84 and name HB ))(resid 94 and name HE# ) 3.807 0.629 0.769 assign ((resid 129 and name HD* ) or (resid 82 and name HD1# ))(resid 94 and name HD# ) 3.340 0.552 0.675 assign ((resid 129 and name HD* ) or (resid 82 and name HD1# ))(resid 94 and name HE# ) 2.834 0.468 0.573 assign (resid 53 and name HD1# )(resid 129 and name HD1# ) 2.699 0.487 0.594 assign (resid 52 and name HG# )(resid 129 and name HD1# ) 2.843 0.513 0.626 ! Y128 assign ((resid 128 or resid 125) and name HA )(resid 128 and name HN ) 2.497 0.354 0.413 assign (resid 128 and name HN )(resid 128 and name HA ) 2.830 0.511 0.623 assign (resid 128 and name HN )(resid 125 and name HA ) 3.406 0.614 0.750 assign (resid 128 and name HB1 )(resid 128 and name HN ) 2.797 0.397 0.462 assign (resid 128 and name HB2 )(resid 128 and name HN ) 3.186 0.452 0.527 assign (resid 128 and (name HD# or name HE# ))(resid 128 and name HN ) 2.548 0.361 0.421 assign ((resid 128 and name HN ) or (resid 96 and name HD# ))(resid 128 and name HD# ) 2.912 0.481 0.588 assign ((resid 128 and name HN ) or (resid 96 and name HD# ))(resid 128 and name HE# ) 3.412 0.564 0.689 assign (resid 128 and name HD# )(resid 128 and name HA ) 3.292 0.594 0.725 assign ((resid 128 or resid 125) and name HA )(resid 128 and name HD# ) 2.735 0.452 0.553 assign ((resid 128 or resid 125) and name HA )(resid 128 and name HE# ) 3.430 0.567 0.693 assign (resid 127 and name HN )(resid 128 and name HN ) 2.915 0.413 0.482 assign (resid 128 and name HN )(resid 127 and name HN ) 2.909 0.413 0.481 assign (resid 127 and name HA )(resid 128 and name HN ) 3.470 0.492 0.574 assign (resid 128 and name HN )(resid 127 and name HA ) 3.803 0.686 0.837 assign (resid 127 and name HB )(resid 128 and name HN ) 2.665 0.378 0.441 assign ((resid 127 and name HG1# ) or ((resid 129 or resid 82 )and name HD* ))(resid 128 and name HN ) 2.975 0.422 0.492 assign (resid 128 and name HN )(resid 127 and name HG1# ) 3.761 0.679 0.828 assign ((resid 127 and name HG2# ) or (resid 125 and name HD* ))(resid 128 and name HN ) 3.263 0.463 0.540 assign (resid 128 and name HN )(resid 127 and name HG2# ) 3.876 0.699 0.853 assign (resid 128 and name HD# )(resid 127 and name HN ) 4.368 0.619 0.722 assign (resid 127 and name HN )(resid 128 and name HD# ) 4.060 0.671 0.821 assign (resid 127 and name HN )(resid 128 and name HE# ) 4.925 0.814 0.995 assign ((resid 127 and name HG1# ) or (resid 129 and name HD* ))(resid 128 and name HA ) 3.794 0.684 0.835 assign ((resid 128 or resid 125) and name HA )(resid 127 and name HG1# ) 4.062 0.733 0.894 assign ((resid 127 and name HG2# ) or (resid 125 and name HD* ))(resid 128 and name HA ) 3.358 0.606 0.739 assign ((resid 128 or resid 125) and name HA )(resid 127 and name HG2# ) 3.836 0.692 0.844 assign (resid 127 and name HB )(resid 128 and name HD# ) 3.954 0.654 0.799 assign (resid 127 and name HB )(resid 128 and name HE# ) 4.077 0.674 0.824 assign (resid 128 and (name HD# or name HE# ))(resid 127 and name HG1# ) 4.434 0.800 0.976 assign (resid 128 and (name HD# or name HE# ))(resid 127 and name HG2# ) 4.516 0.815 0.994 assign ((resid 127 and name HG1#) or (resid 82 and name HD1#))(resid 128 and name HD#) 3.299 0.545 0.667 assign (resid 128 and (name HD# or name HE# ))(resid 82 and name HD1# ) 3.183 0.574 0.701 assign ((resid 127 and name HG2# ) or (resid 125 and name HD1# ))(resid 128 and name HD# ) 3.310 0.547 0.669 assign ((resid 127 and name HG1#) or (resid 82 and name HD1#))(resid 128 and name HE#) 3.180 0.526 0.643 assign ((resid 127 and name HG2# ) or (resid 125 and name HD1# ))(resid 128 and name HE# ) 3.738 0.618 0.756 assign (resid 126 and name HN )(resid 128 and name HN ) 4.553 0.646 0.753 assign (resid 128 and (name HD# or name HE# ))(resid 125 and name HN ) 4.616 0.654 0.763 assign (resid 125 and name HN )(resid 128 and name HD# ) 5.232 0.865 1.057 assign ((resid 124 or resid 96) and name HB1 )(resid 128 and name HD# ) 4.199 0.694 0.848 assign ((resid 124 or resid 96) and name HB1 )(resid 128 and name HE# ) 4.058 0.671 0.820 assign ((resid 128 and name HB2 ) or (resid 96 and name HB1 ))(resid 128 and name HE# ) 3.708 0.613 0.749 assign ((resid 128 or resid 125) and name HA )(resid 96 and name HD# ) 4.820 0.797 0.974 assign ((resid 128 or resid 125) and name HA )(resid 96 and name HE# ) 3.989 0.659 0.806 assign ((resid 128 or resid 125) and name HA )(resid 96 and name HZ ) 4.055 0.670 0.819 assign (resid 128 and name HB2 )(resid 96 and name HD# ) 4.204 0.634 0.775 assign ((resid 128 and name HB1 ) or (resid 96 and name HB2 ))(resid 96 and name HE# ) 3.798 0.628 0.768 assign (resid 128 and name HB2 )(resid 96 and name HE# ) 4.120 0.681 0.833 assign ((resid 128 and name HB1 ) or (resid 96 and name HB2 ))(resid 96 and name HZ ) 3.980 0.658 0.804 assign (resid 128 and name HB2 )(resid 96 and name HZ ) 4.131 0.683 0.835 assign ((resid 128 and (name HD# or name HE# )) or (resid 96 and name HZ ))(resid 125 and name HD2# ) 3.514 0.634 0.773 assign (resid 96 and (name HE# or name HZ ))(resid 128 and name HD# ) 3.508 0.580 0.709 assign (resid 96 and (name HE# or name HZ ))(resid 128 and name HE# ) 3.652 0.604 0.738 assign ((resid 128 and (name HD# or name HE# )) or (resid 94 and name HE#))(resid 96 and name HD# ) 3.237 0.535 0.654 assign ((resid 128 and (name HD# or name HE# )) or (resid 94 and name HE#))(resid 96 and name HE# ) 3.209 0.530 0.648 assign ((resid 128 and (name HD# or name HE#)) or (resid 94 and (name HE# or name HD#)))(resid 96 and name HZ) 3.318 0.548 0.671 assign (resid 53 and name HD1# )(resid 128 and name HD# ) 4.033 0.667 0.815 ! V127 assign (resid 127 and name HA )(resid 127 and name HN ) 2.776 0.394 0.459 assign (resid 127 and name HN )(resid 127 and name HA ) 3.003 0.542 0.661 assign ((resid 127 and name HB ) or (resid 126 and name HB# ))(resid 127 and name HN ) 2.356 0.334 0.389 assign (resid 127 and name HN )(resid 127 and name HB ) 2.495 0.450 0.549 assign (resid 127 and name HG1# )(resid 127 and name HN ) 2.328 0.330 0.385 assign (resid 127 and name HN )(resid 127 and name HG1# ) 2.633 0.475 0.580 assign (resid 127 and name HG2# )(resid 127 and name HN ) 3.177 0.451 0.525 assign (resid 127 and name HN )(resid 127 and name HG2# ) 3.642 0.657 0.802 assign (resid 127 and name HG1# )(resid 127 and name HA ) 2.499 0.451 0.550 assign (resid 127 and name HA )(resid 127 and name HG1# ) 2.637 0.476 0.580 assign (resid 127 and name HG2# )(resid 127 and name HA ) 2.649 0.478 0.583 assign (resid 127 and name HA )(resid 127 and name HG2# ) 2.838 0.512 0.625 assign (resid 126 and name HN )(resid 127 and name HN ) 3.174 0.450 0.525 assign (resid 127 and name HN )(resid 126 and name HN ) 3.082 0.437 0.509 assign (resid 126 and name HA )(resid 127 and name HN ) 3.817 0.541 0.631 assign (resid 127 and name HN )(resid 126 and name HA ) 3.714 0.670 0.817 assign (resid 126 and name HG2 )(resid 127 and name HN ) 4.531 0.642 0.749 assign (resid 127 and name HG1# )(resid 126 and name HN ) 3.778 0.536 0.625 assign (resid 125 and name HN )(resid 127 and name HN ) 4.856 0.689 0.803 assign (resid 127 and name HN )(resid 125 and name HN ) 4.897 0.694 0.809 assign ((resid 125 or resid 123) and name HA )(resid 127 and name HN ) 3.739 0.530 0.618 assign (resid 124 and name HA )(resid 127 and name HN ) 3.825 0.542 0.632 assign (resid 127 and name HN )(resid 124 and name HA ) 3.758 0.678 0.827 assign (resid 127 and name HG1# )(resid 124 and name HA ) 2.724 0.491 0.600 assign (resid 124 and name HA )(resid 127 and name HG1# ) 3.109 0.561 0.684 ! R126 assign (resid 126 and name HA )(resid 126 and name HN ) 2.895 0.411 0.479 assign (resid 126 and name HN )(resid 126 and name HA ) 2.943 0.531 0.648 assign (resid 126 and name HB# )(resid 126 and name HN ) 2.325 0.330 0.384 assign (resid 126 and name HD2 )(resid 126 and name HN ) 4.390 0.623 0.726 assign ((resid 125 or resid 124) and name HN )(resid 126 and name HN ) 2.790 0.396 0.461 assign (resid 126 and name HN )(resid 125 and name HN ) 2.732 0.387 0.452 assign ((resid 125 or resid 123) and name HA )(resid 126 and name HN ) 2.886 0.409 0.477 assign (resid 126 and name HN )(resid 125 and name HA ) 3.660 0.660 0.805 assign (resid 125 and name HB2 )(resid 126 and name HN ) 3.751 0.532 0.620 assign (resid 125 and name HD* )(resid 126 and name HN ) 4.237 0.601 0.700 assign (resid 124 and name HA )(resid 126 and name HN ) 5.077 0.720 0.839 assign (resid 126 and name HN )(resid 123 and name HA ) 3.410 0.615 0.751 assign (resid 126 and name HB# )(resid 123 and name HA ) 2.841 0.513 0.625 assign (resid 122 and name HA )(resid 126 and name HN ) 3.853 0.546 0.637 assign (resid 126 and name HN )(resid 126 and name HA ) 3.556 0.641 0.783 ! L125 assign ((resid 125 or resid 123) and name HA )(resid 125 and name HN ) 2.692 0.382 0.445 assign (resid 125 and name HN )(resid 125 and name HA ) 2.970 0.536 0.654 assign (resid 125 and name HB1 )(resid 125 and name HN ) 2.672 0.379 0.442 assign (resid 125 and name HB2 )(resid 125 and name HN ) 2.625 0.372 0.434 assign (resid 125 and name HG )(resid 125 and name HN ) 3.828 0.543 0.633 assign (resid 125 and name HD* )(resid 125 and name HN ) 3.234 0.459 0.535 assign (resid 125 and name HG )(resid 125 and name HA ) 3.218 0.581 0.708 assign (resid 125 and name HN )(resid 125 and name HD1# ) 3.981 0.718 0.876 assign (resid 125 and name HN )((resid 125 and name HD2# ) or (resid 136 and name HD1#)) 4.216 0.761 0.928 assign (resid 125 and name HA )(resid 125 and name HD1# ) 2.552 0.460 0.562 assign (resid 125 and name HA )((resid 125 and name HD2# ) or (resid 136 and name HD1#)) 3.939 0.709 0.865 assign (resid 124 and name HA )(resid 125 and name HN ) 3.581 0.508 0.592 assign ((resid 124 or resid 125) and name HN )(resid 124 and name HA ) 2.907 0.524 0.640 assign ((resid 124 or resid 125) and name HN )(resid 122 and name HA ) 2.788 0.503 0.614 assign (resid 124 and name HB1 )(resid 125 and name HN ) 3.090 0.438 0.511 assign (resid 124 and name HB2 )(resid 125 and name HN ) 3.422 0.485 0.566 assign (resid 122 and name HA )(resid 125 and name HN ) 3.173 0.450 0.525 assign (resid 122 and name HD* )(resid 125 and name HN ) 3.642 0.516 0.602 assign (resid 122 and name HA )((resid 136 and name HD1#) or (resid 125 and name HD2#)) 3.305 0.596 0.727 assign (resid 125 and name HD* )(resid 122 and name HA ) 2.931 0.529 0.645 assign (resid 125 and name HB1 )(resid 122 and name HA ) 3.178 0.573 0.699 assign (resid 125 and name HB2 )(resid 122 and name HA ) 3.529 0.637 0.777 assign ((resid 122 or resid 82) and name HD* )(resid 125 and name HD1# ) 2.393 0.432 0.527 assign ((resid 125 and name HD* ) or (resid 136 and name HD1# ))(resid 122 and name HD1# ) 2.987 0.539 0.657 assign ((resid 125 and name HD* ) or (resid 136 and name HD1# ))(resid 122 and name HD2# ) 2.805 0.506 0.617 assign (resid 121 and name HN )(resid 125 and name HN ) 4.113 0.583 0.670 assign ((resid 125 or resid 124) and name HN )(resid 121 and name HN ) 3.412 0.484 0.564 assign (resid 96 and (name HZ or name HE# ))(resid 125 and name HD1# ) 2.747 0.496 0.605 assign (resid 125 and name HD* )(resid 96 and name HD# ) 3.647 0.603 0.737 assign (resid 125 and name HD* )(resid 96 and name HE# ) 2.797 0.462 0.565 assign (resid 125 and name HD* )(resid 96 and name HZ ) 2.774 0.459 0.561 assign (resid 84 and (name HD* or name HG2# ))(resid 125 and name HN ) 3.744 0.531 0.619 assign (resid 84 and name HB )(resid 125 and name HD1# ) 3.621 0.653 0.798 assign (resid 84 and (name HD* or name HG2# ))(resid 125 and name HD1# ) 2.814 0.508 0.619 assign (resid 125 and name HB1 )(resid 84 and name HD* ) 3.084 0.556 0.679 ! D124 assign (resid 124 and name HA )(resid 124 and name HN ) 2.722 0.386 0.450 assign (resid 124 and name HB1 )(resid 124 and name HN ) 2.598 0.368 0.429 assign (resid 124 and name HB2 )(resid 124 and name HN ) 2.839 0.403 0.469 assign (resid 123 and (name HA or name HB1 ))(resid 124 and name HN ) 3.035 0.430 0.502 assign (resid 124 and name HN )(resid 123 and name HA ) 3.488 0.629 0.768 assign (resid 123 and name HB2 )(resid 124 and name HN ) 2.760 0.391 0.456 assign (resid 121 and name HN )(resid 124 and name HN ) 3.421 0.485 0.566 assign (resid 124 and name HA )(resid 121 and name HN ) 4.693 0.665 0.776 assign (resid 124 and name HB1 )(resid 121 and name HN ) 2.889 0.410 0.478 assign (resid 124 and name HB2 )(resid 121 and name HN ) 3.264 0.463 0.540 assign (resid 124 and name HB1 )(resid 120 and name HB1 ) 2.549 0.460 0.561 assign (resid 120 and name HB1 )(resid 124 and name HB1 ) 2.591 0.467 0.570 assign (resid 124 and name HB2 )(resid 120 and name HB1 ) 2.735 0.493 0.602 assign (resid 120 and name HB1 )(resid 124 and name HB2 ) 2.863 0.516 0.630 ! S123 assign (resid 123 and name HN )(resid 123 and name HA ) 3.487 0.629 0.768 assign (resid 123 and name HN )(resid 123 and name HB1 ) 3.050 0.550 0.671 assign (resid 123 and name HN )(resid 123 and name HB2 ) 2.596 0.468 0.571 assign (resid 123 and name HN )(resid 122 and name HN ) 3.505 0.497 0.580 ! L122 assign (resid 122 and name HA )(resid 122 and name HN ) 2.909 0.412 0.481 assign (resid 122 and name HN )(resid 122 and name HA ) 3.227 0.582 0.710 assign (resid 122 and (name HB1 or name HG ))(resid 122 and name HN ) 2.296 0.326 0.380 assign (resid 122 and name HB2 )(resid 122 and name HN ) 3.020 0.428 0.499 assign (resid 122 and name HD2# )(resid 122 and name HN ) 3.824 0.542 0.632 assign (resid 122 and name HN )(resid 122 and name HD2# ) 4.466 0.806 0.983 assign (resid 122 and name HD* )(resid 122 and name HA ) 2.804 0.506 0.617 assign (resid 121 and name HN )(resid 122 and name HN ) 4.339 0.615 0.717 assign (resid 122 and name HN )(resid 121 and name HN ) 4.487 0.636 0.742 assign (resid 121 and name HA )(resid 122 and name HN ) 2.653 0.376 0.439 assign (resid 122 and name HN )(resid 121 and name HA ) 2.397 0.432 0.528 assign (resid 121 and name HB )(resid 122 and name HN ) 2.501 0.354 0.413 assign (resid 121 and name HG2# )(resid 122 and name HN ) 3.257 0.462 0.538 assign (resid 84 and (name HD* or name HG2# ))(resid 122 and name HN ) 3.613 0.512 0.597 assign (resid 84 and (name HD* or name HG2# ))(resid 122 and name HA ) 2.931 0.529 0.645 assign (resid 84 and (name HD* or name HG2# ))(resid 122 and name HD1# ) 3.530 0.637 0.777 assign (resid 84 and (name HD* or name HG2# ))(resid 122 and name HD2# ) 3.279 0.592 0.722 ! T121 assign (resid 121 and name HA )(resid 121 and name HN ) 3.463 0.491 0.572 assign (resid 121 and name HN )(resid 121 and name HA ) 3.387 0.611 0.746 assign (resid 121 and name HN )(resid 121 and name HB ) 3.003 0.542 0.661 assign (resid 121 and name HG2# )(resid 121 and name HN ) 2.732 0.387 0.452 assign (resid 121 and name HN )(resid 121 and name HG2# ) 3.113 0.562 0.685 assign (resid 121 and name HG2# )(resid 121 and name HA ) 2.396 0.432 0.527 assign (resid 121 and name HA )(resid 121 and name HG2# ) 2.780 0.502 0.612 assign (resid 120 and name HN )(resid 121 and name HN ) 4.478 0.635 0.740 assign (resid 121 and name HN )(resid 120 and name HN ) 4.849 0.687 0.801 assign (resid 120 and name HA )(resid 121 and name HN ) 2.278 0.323 0.377 assign (resid 121 and name HN )(resid 120 and name HA ) 2.507 0.452 0.552 assign (resid 120 and name HB1 )(resid 121 and name HN ) 2.618 0.371 0.433 assign (resid 121 and name HN )(resid 120 and name HB1 ) 2.454 0.443 0.540 assign (resid 120 and name HB2 )(resid 121 and name HN ) 3.235 0.459 0.535 assign (resid 121 and name HN )(resid 120 and name HB2 ) 2.733 0.493 0.602 assign (resid 121 and name HG2# )(resid 120 and name HA ) 3.211 0.579 0.707 assign (resid 120 and name HA )(resid 121 and name HG2# ) 3.769 0.680 0.829 assign (resid 84 and (name HD* or name HG2# ))(resid 121 and name HN ) 3.925 0.557 0.649 assign (resid 84 and (name HD* or name HG2# ))(resid 121 and name HA ) 2.772 0.500 0.610 assign (resid 121 and name HA )(resid 84 and name HG2# ) 3.219 0.581 0.709 assign (resid 121 and name HG2# )(resid 84 and name HG2# ) 3.982 0.718 0.876 assign (resid 121 and name HA )(resid 84 and name HD* ) 3.999 0.721 0.880 ! S120 assign (resid 120 and name HA )(resid 120 and name HN ) 3.189 0.452 0.527 assign (resid 120 and name HN )(resid 120 and name HA ) 3.065 0.553 0.675 assign (resid 120 and name HB1 )(resid 120 and name HN ) 3.370 0.478 0.557 assign (resid 120 and name HN )(resid 120 and name HB1 ) 3.050 0.550 0.671 assign (resid 120 and name HB2 )(resid 120 and name HN ) 2.945 0.418 0.487 assign (resid 120 and name HN )(resid 120 and name HB2 ) 2.488 0.449 0.548 assign ((resid 119 or resid 84) and name HN )(resid 120 and name HN ) 4.926 0.699 0.814 assign ((resid 120 or resid 92) and name HN )(resid 84 and name HN ) 3.513 0.498 0.581 assign (resid 119 and name HA )(resid 120 and name HN ) 2.110 0.299 0.349 assign (resid 120 and name HN )(resid 119 and name HA ) 2.117 0.382 0.466 assign (resid 119 and (name HB# or name HG2 ))(resid 120 and name HN ) 2.955 0.419 0.488 assign (resid 119 and name HG1 )(resid 120 and name HN ) 4.503 0.638 0.744 assign (resid 84 and name HA )(resid 120 and name HN ) 3.824 0.542 0.632 assign (resid 120 and name HN )(resid 84 and name HA ) 3.248 0.586 0.715 assign (resid 84 and name HG2# )(resid 120 and name HN ) 4.576 0.649 0.756 assign (resid 84 and (name HD* or name HG2# ))(resid 120 and name HA ) 3.986 0.719 0.877 assign (resid 84 and (name HD* or name HG2# ))(resid 120 and name HB1 ) 2.833 0.511 0.624 assign (resid 84 and (name HD* or name HG2# ))(resid 120 and name HB2 ) 2.707 0.488 0.596 assign (resid 120 and name HB1 )(resid 84 and name HG11 ) 3.089 0.557 0.680 assign (resid 84 and name HG11 )(resid 120 and name HB1 ) 2.770 0.500 0.610 assign (resid 120 and name HB1 )(resid 84 and name HD* ) 3.546 0.640 0.781 assign (resid 120 and name HB2 )(resid 84 and name HD* ) 3.302 0.596 0.727 assign (resid 120 and name HB1 )(resid 84 and name HG2# ) 3.572 0.644 0.786 assign (resid 120 and name HB2 )(resid 84 and name HG2# ) 4.709 0.849 1.036 assign (resid 83 and name HB1 )(resid 120 and name HN ) 3.671 0.521 0.607 assign (resid 83 and name HB2 )(resid 120 and name HN ) 4.677 0.664 0.773 assign (resid 83 and name HE3 )(resid 120 and name HN ) 4.513 0.746 0.912 assign ((resid 120 and name HN ) or (resid 83 and name HN))(resid 83 and name HE3 ) 4.027 0.666 0.814 assign ((resid 82 and name HD* ) or (resid 118 and name HG* ))(resid 120 and name HA ) 3.236 0.584 0.712 assign ((resid 82 and name HD* ) or (resid 118 and name HG* ))(resid 120 and name HB1 ) 2.521 0.455 0.555 assign ((resid 82 and name HD* ) or (resid 118 and name HG* ))(resid 120 and name HB2 ) 2.481 0.448 0.546 ! Q119 assign (resid 119 and (name HB# or name HG2 ))(resid 119 and name HN ) 2.752 0.390 0.455 assign (resid 119 and name HG1 )(resid 119 and name HA ) 3.423 0.617 0.753 assign (resid 119 and (name HB# or name HG2 ))(resid 119 and name HE22 ) 3.034 0.430 0.503 assign (resid 119 and name HG1 )(resid 119 and name HE22 ) 3.363 0.477 0.556 assign (resid 119 and (name HB# or name HG2 ))(resid 119 and name HE21 ) 2.747 0.390 0.455 assign (resid 119 and name HE21 )(resid 119 and name HA ) 3.401 0.614 0.749 assign (resid 119 and name HG1 )(resid 119 and name HE21 ) 2.872 0.408 0.474 assign (resid 119 and name HN )(resid 118 and name HA ) 2.602 0.469 0.573 assign (resid 118 and name HG* )(resid 119 and name HN ) 3.446 0.489 0.570 assign (resid 119 and name HN )(resid 118 and name HG1# ) 4.108 0.741 0.904 assign (resid 118 and name HG* )(resid 119 and name HE21 ) 4.623 0.656 0.764 assign ((resid 119 or resid 84) and name HN )(resid 93 and name HD# ) 4.296 0.710 0.868 assign ((resid 119 or resid 84 or resid 82) and name HN )(resid 83 and name HN ) 3.366 0.477 0.556 assign (resid 119 and name HA )(resid 83 and name HN ) 3.128 0.444 0.517 assign (resid 83 and name HB1 )(resid 119 and name HA ) 2.773 0.500 0.610 assign (resid 83 and name HB2 )(resid 119 and name HA ) 3.154 0.569 0.694 assign (resid 83 and name HE3 )(resid 119 and name HA ) 3.511 0.633 0.773 assign ((resid 119 or resid 39) and name HA )(resid 83 and name HE3 ) 3.869 0.640 0.782 assign (resid 119 and name HG1 )(resid 83 and name HE3 ) 4.494 0.743 0.908 assign (resid 119 and (name HB# or name HG2 ))(resid 83 and name HE3 ) 3.568 0.590 0.721 assign ((resid 119 or resid 39) and name HA )(resid 83 and name HZ3 ) 4.861 0.803 0.982 assign (resid 119 and (name HB# or name HG2 ))(resid 83 and name HZ3 ) 4.233 0.700 0.856 assign (resid 119 and name HG1 )(resid 83 and name HZ3 ) 4.625 0.765 0.935 assign (resid 119 and name HG1 )(resid 83 and name HH2 ) 4.659 0.770 0.942 assign (resid 119 and (name HB# or name HG2 ))(resid 39 and name HB# ) 4.500 0.500 999.0 ! V118 assign (resid 118 and name HA )(resid 118 and name HN ) 2.797 0.397 0.462 assign (resid 118 and name HN )(resid 118 and name HA ) 3.043 0.549 0.670 assign (resid 118 and name HB )(resid 118 and name HN ) 2.380 0.337 0.393 assign (resid 118 and name HG* )(resid 118 and name HN ) 2.337 0.331 0.386 assign (resid 118 and name HN )(resid 118 and name HG1# ) 3.087 0.557 0.680 assign (resid 118 and name HN )(resid 118 and name HG2# ) 3.786 0.683 0.833 assign (resid 118 and name HB )(resid 118 and name HA ) 2.903 0.524 0.639 assign (resid 118 and name HA )(resid 118 and name HG1# ) 2.958 0.534 0.651 assign (resid 118 and name HA )(resid 118 and name HG2# ) 2.908 0.525 0.640 assign ((resid 117 or resid 83) and name HN )(resid 118 and name HN ) 3.410 0.484 0.564 assign ((resid 118 or resid 116 or resid 42) and name HN )(resid 117 and name HN ) 3.417 0.484 0.565 assign (resid 117 and name HA )(resid 118 and name HN ) 1.981 0.281 0.328 assign (resid 118 and name HN )(resid 117 and name HA ) 2.177 0.393 0.479 assign (resid 117 and name HB1 )(resid 118 and name HN ) 3.408 0.483 0.563 assign (resid 117 and name HB2 )(resid 118 and name HN ) 3.154 0.447 0.521 assign (resid 117 and name HD1# )(resid 118 and name HN ) 3.154 0.447 0.521 assign (resid 118 and name HN )(resid 117 and name HD1# ) 3.383 0.610 0.745 assign (resid 118 and name HN )(resid 117 and name HD2# ) 4.031 0.727 0.887 assign (resid 118 and name HN )(resid 83 and name HN ) 3.247 0.460 0.537 assign (resid 118 and name HB )(resid 83 and name HN ) 3.624 0.514 0.599 assign (resid 118 and name HB )(resid 82 and name HA ) 2.740 0.494 0.603 assign ((resid 118 and name HG* ) or (resid 82 and name HD2# ))(resid 83 and name HN ) 3.077 0.436 0.509 assign ((resid 82 or resid 117) and name HA )(resid 118 and name HG1# ) 3.624 0.654 0.798 assign ((resid 82 or resid 117) and name HA )(resid 118 and name HG2# ) 3.903 0.704 0.859 assign ((resid 82 and name HD2# ) or (resid 118 and name HG* ))(resid 82 and name HA ) 2.337 0.422 0.514 assign (resid 81 and name HN )(resid 118 and name HG1# ) 4.045 0.730 0.890 assign (resid 118 and name HG* )(resid 81 and name HN ) 3.637 0.516 0.601 assign ((resid 40 or resid 118) and name HA )(resid 40 and name HN ) 2.690 0.381 0.445 assign ((resid 40 or resid 118) and name HA )(resid 39 and name HB# ) 3.384 0.610 0.745 assign (resid 39 and name HB# )(resid 118 and name HA ) 4.000 0.500 999.0 assign ((resid 118 and name HG1# ) or (resid 38 and name HG2# ))(resid 39 and name HN ) 3.127 0.443 0.517 assign ((resid 38 and (name HG2# or name HD*)) or (resid 118 and name HG1# ))(resid 39 and name HB# ) 3.158 0.570 0.695 ! L117 assign (resid 117 and name HA )(resid 117 and name HN ) 3.026 0.429 0.500 assign (resid 117 and name HN )(resid 117 and name HA ) 3.017 0.544 0.664 assign ((resid 117 and name HB1 ) or (resid 81 and name HB ))(resid 117 and name HN ) 2.557 0.363 0.423 assign (resid 117 and (name HB2 or name HG ))(resid 117 and name HN ) 2.545 0.361 0.421 assign (resid 117 and name HD1# )(resid 117 and name HN ) 3.677 0.521 0.608 assign (resid 117 and name HD2# )(resid 117 and name HN ) 3.933 0.558 0.650 assign (resid 117 and name HD1# )(resid 117 and name HA ) 2.514 0.453 0.553 assign (resid 117 and name HA )(resid 117 and name HD1# ) 2.731 0.492 0.601 assign (resid 117 and name HA )(resid 117 and name HD2# ) 3.764 0.679 0.829 assign ((resid 117 and name HB1 ) or (resid 81 and name HB ))(resid 117 and name HD1# ) 2.718 0.490 0.598 assign ((resid 117 or resid 80) and name HN )(resid 116 and name HN ) 3.855 0.547 0.637 assign (resid 116 and name HA )(resid 117 and name HN ) 2.077 0.295 0.343 assign (resid 117 and name HN )(resid 116 and name HA ) 2.144 0.387 0.472 assign (resid 116 and name HB2 )(resid 117 and name HN ) 3.747 0.531 0.619 assign (resid 116 and name HG1 )(resid 117 and name HN ) 3.693 0.524 0.610 assign ((resid 117 or resid 43) and name HA )(resid 115 and name HB# ) 3.459 0.624 0.761 assign (resid 115 and name HB# )(resid 117 and name HD1# ) 3.116 0.562 0.686 assign (resid 117 and name HD1# )(resid 115 and name HB# ) 2.960 0.534 0.651 assign ((resid 117 or resid 82 or resid 94) and name HA )(resid 93 and name HD# ) 4.300 0.711 0.869 assign (resid 117 and name HD1# )(resid 93 and name HD# ) 3.239 0.535 0.654 assign (resid 117 and name HD2# )(resid 93 and name HD# ) 3.921 0.648 0.792 assign (resid 117 and name HD1# )(resid 93 and name HE# ) 3.434 0.568 0.694 assign (resid 117 and name HD2# )(resid 93 and name HE# ) 3.512 0.581 0.710 assign (resid 117 and name HD1# )(resid 93 and name HZ ) 4.516 0.746 0.913 assign (resid 117 and name HD2# )(resid 93 and name HZ ) 4.403 0.728 0.890 assign ((resid 117 or resid 82 or resid 94) and name HA )(resid 83 and name HE3 ) 4.563 0.754 0.922 assign (resid 117 and name HB1 )(resid 83 and name HE3 ) 3.805 0.629 0.769 assign ((resid 117 and (name HB2 or name HG)) or ((resid 39 or resid 40) and name HB#))(resid 83 and name HE3) 3.304 0.546 0.668 assign (((resid 117 or resid 37) and name HB1 ) or (resid 38 and name HB ))(resid 83 and name HZ3 ) 4.756 0.786 0.961 assign ((resid 39 and name HB# ) or (resid 117 and (name HB2 or name HG)))(resid 83 and name HZ3 ) 4.172 0.690 0.843 assign (resid 117 and name HD1# )(resid 83 and name HE3 ) 3.916 0.647 0.791 assign (resid 83 and name HE3 )(resid 117 and name HD2# ) 4.327 0.715 0.874 assign (resid 117 and name HD2# )(resid 83 and name HE3 ) 3.642 0.602 0.736 assign (resid 117 and name HD1# )(resid 83 and name HZ3 ) 5.057 0.836 1.022 assign (resid 83 and name HZ3 )(resid 117 and name HD2# ) 4.143 0.685 0.837 assign (resid 117 and name HD2# )(resid 83 and name HZ3 ) 4.204 0.695 0.850 assign (resid 117 and name HD2# )(resid 83 and name HH2 ) 5.365 0.887 1.084 assign (resid 117 and name HD1# )(resid 81 and name HN ) 3.946 0.560 0.652 assign (resid 81 and name HG1# )(resid 117 and name HD1# ) 2.815 0.508 0.619 assign (resid 81 and name HG2# )(resid 117 and name HD1# ) 3.282 0.592 0.722 assign (resid 81 and name HG1# )(resid 117 and name HD2# ) 3.913 0.706 0.861 assign (resid 117 and name HD2# )(resid 44 and name HG1# ) 3.926 0.708 0.865 assign (resid 117 and name HD2# )(resid 44 and name HG2# ) 3.937 0.711 0.867 assign (resid 117 and name HN )(resid 42 and name HN ) 4.268 0.605 0.705 assign (resid 117 and name HD2# )(resid 42 and name HN ) 4.244 0.602 0.702 assign (resid 42 and name HB1 )(resid 117 and name HD1# ) 3.518 0.635 0.774 assign (resid 42 and name HB2 )(resid 117 and name HD1# ) 3.893 0.702 0.857 assign (resid 42 and name HB1 )(resid 117 and name HD2# ) 3.515 0.634 0.774 assign (resid 42 and name HB2 )(resid 117 and name HD2# ) 3.521 0.635 0.775 assign (resid 42 and name HD2 )(resid 117 and name HN ) 4.350 0.617 0.719 assign (resid 117 and name HN )(resid 42 and name HD2 ) 3.992 0.660 0.807 assign ((resid 117 and name HB1 ) or (resid 41 and name HB ))(resid 42 and name HD2 ) 4.208 0.696 0.850 assign ((resid 117 and (name HB2 or name HG )) or (resid 40 and name HB#))(resid 42 and name HD2 ) 3.357 0.555 0.679 assign (resid 117 and name HD1# )(resid 42 and name HD2 ) 4.338 0.717 0.877 assign (resid 117 and name HD2# )(resid 42 and name HD2 ) 3.589 0.593 0.725 assign ((resid 117 and (name HB2 or name HG )) or (resid 40 and name HB#))(resid 42 and name HE1 ) 4.065 0.672 0.822 assign (resid 117 and name HD1# )(resid 42 and name HE1 ) 5.653 0.934 1.142 assign (resid 117 and name HD2# )(resid 42 and name HE1 ) 4.688 0.775 0.948 assign (resid 117 and name HN )(resid 41 and name HA ) 3.142 0.567 0.745 assign (resid 117 and name HN )(resid 40 and name HN ) 4.500 0.500 0.500 assign (resid 38 and (name HG2# or name HD* ))(resid 117 and name HD1# ) 4.500 0.500 999.0 assign (resid 38 and (name HG2# or name HD* ))(resid 117 and name HD2# ) 4.500 0.500 999.0 ! K116 assign (resid 116 and name HA )(resid 116 and name HN ) 3.175 0.450 0.525 assign (resid 116 and name HB1 )(resid 116 and name HN ) 2.701 0.383 0.446 assign (resid 116 and name HB2 )(resid 116 and name HN ) 2.905 0.412 0.480 assign (resid 116 and name HG1 )(resid 116 and name HN ) 3.476 0.493 0.575 assign ((resid 116 or resid 42) and name HN )(resid 115 and name HN ) 3.185 0.452 0.526 assign (resid 115 and name HA )(resid 116 and name HN ) 2.072 0.294 0.342 assign (resid 116 and name HN )(resid 115 and name HA ) 2.155 0.389 0.474 assign ((resid 115 and name HB# ) or (resid 79 and name HG12 ))(resid 116 and name HN ) 2.547 0.361 0.421 assign (resid 116 and name HN )(resid 115 and name HB# ) 2.933 0.529 0.646 assign ((resid 116 or resid 81) and name HN )(resid 80 and name HN ) 3.984 0.565 0.659 assign (resid 116 and name HB1 )(resid 80 and name HA ) 2.715 0.490 0.598 assign (resid 116 and name HB2 )(resid 80 and name HA ) 2.884 0.520 0.635 assign (resid 79 and name HN )(resid 116 and name HN ) 3.457 0.490 0.571 assign (resid 116 and name HN )(resid 79 and name HN ) 3.386 0.480 0.560 assign (resid 79 and name HA )(resid 116 and name HN ) 3.933 0.558 0.650 assign ((resid 79 and name HD* ) or (resid 81 and name HG2# ))(resid 116 and name HN ) 3.776 0.535 0.624 assign (resid 78 and name HB2 )(resid 116 and name HN ) 3.105 0.440 0.513 ! A115 assign (resid 115 and name HA )(resid 115 and name HN ) 3.160 0.448 0.522 assign (resid 115 and name HN )(resid 115 and name HA ) 3.073 0.554 0.676 assign (resid 115 and name HB# )(resid 115 and name HN ) 2.641 0.374 0.437 assign (resid 115 and name HN )(resid 115 and name HB# ) 2.819 0.509 0.621 assign (resid 114 and name HA )(resid 115 and name HN ) 2.104 0.298 0.348 assign (resid 115 and name HN )(resid 114 and name HA ) 2.194 0.396 0.483 assign (resid 114 and name HB1 )(resid 115 and name HN ) 3.122 0.443 0.516 assign (resid 114 and name HA )(resid 115 and name HB# ) 3.533 0.637 0.778 assign ((resid 114 or resid 78) and name HB2 )(resid 115 and name HN ) 3.514 0.498 0.581 assign (resid 115 and name HB# )(resid 113 and name HG2# ) 2.840 0.512 0.625 assign ((resid 81 and name HG2# ) or (resid 79 and (name HD* or name HG12)))(resid 115 and name HB# ) 2.357 0.425 0.519 assign (resid 115 and name HB# )(resid 81 and name HG2# ) 2.272 0.410 0.500 assign (resid 81 and name HB )(resid 115 and name HB# ) 3.075 0.555 0.677 assign ((resid 81 or resid 42) and name HA )(resid 115 and name HB# ) 3.736 0.674 0.822 assign (resid 79 and name HN )(resid 115 and name HA ) 2.428 0.438 0.534 assign (resid 115 and name HA )(resid 79 and name HN ) 2.404 0.341 0.397 assign (resid 79 and name HG11 )(resid 115 and name HB# ) 3.051 0.550 0.672 assign ((resid 79 and name HG12 ) or (resid 115 and name HB# ))(resid 79 and name HN ) 2.274 0.323 0.376 assign ((resid 78 and name HB1 ) or (resid 41 and name HB ))(resid 115 and name HN ) 4.046 0.573 0.669 assign (resid 78 and name HB1 )(resid 115 and name HA ) 3.057 0.551 0.672 assign (resid 78 and name HB2 )(resid 115 and name HA ) 2.744 0.495 0.604 assign (resid 44 and name HN )(resid 115 and name HN ) 3.776 0.535 0.624 assign (resid 115 and name HN )(resid 44 and name HN ) 3.853 0.546 0.637 assign (resid 115 and name HB# )(resid 44 and name HN ) 3.992 0.566 0.660 assign ((resid 79 or resid 44 or resid 78) and name HA )(resid 115 and name HN ) 4.024 0.571 0.666 assign ((resid 79 or resid 44 or resid 78) and name HA )(resid 115 and name HB# ) 3.520 0.635 0.775 assign (resid 44 and name HG* )(resid 115 and name HN ) 3.738 0.530 0.618 assign (resid 44 and name HB )(resid 115 and name HB# ) 3.481 0.628 0.766 assign ((resid 113 and (name HG2# or name HD* )) or (resid 44 and name HG* ))(resid 115 and name HB# ) 2.466 0.445 0.543 assign (resid 115 and name HB# )(resid 44 and name HG1# ) 2.697 0.487 0.594 assign (resid 115 and name HB# )(resid 44 and name HG2# ) 3.394 0.612 0.747 assign (resid 115 and name HN )(resid 43 and name HA ) 2.995 0.540 0.659 assign (resid 43 and name HA )(resid 115 and name HN ) 3.932 0.557 0.650 assign (resid 42 and name HN )(resid 115 and name HN ) 3.185 0.452 0.526 assign (resid 115 and name HN )(resid 42 and name HN ) 2.915 0.413 0.482 assign (resid 41 and name HG2# )(resid 115 and name HN ) 3.057 0.434 0.505 assign (resid 115 and name HN )(resid 41 and name HG2# ) 3.391 0.612 0.746 ! P114 assign (resid 114 and name HD1 )(resid 113 and name HA ) 2.517 0.454 0.554 assign (resid 114 and name HD2 )(resid 113 and name HA ) 2.306 0.416 0.508 assign (resid 113 and name HG12 )(resid 114 and name HD1 ) 2.217 0.400 0.488 assign (resid 113 and name HG12 )(resid 114 and name HD2 ) 2.243 0.405 0.494 assign (resid 114 and name HG1 )(resid 105 and name HE# ) 3.626 0.599 0.733 assign (resid 114 and name HD2 )(resid 105 and name HD# ) 4.179 0.691 0.845 assign ((resid 114 and name HD1 ) or (resid 101 and name HD2 ))(resid 105 and name HE# ) 3.258 0.538 0.658 assign (resid 114 and name HD2 )(resid 105 and name HE# ) 3.060 0.506 0.619 assign ((resid 105 or resid 102) and name HE# )(resid 114 and name HD2 ) 2.392 0.432 0.527 assign ((resid 105 or resid 102) and name HE# )(resid 114 and name HD2 ) 2.347 0.423 0.517 assign (resid 114 and name HA )(resid 44 and name HN ) 3.224 0.457 0.533 assign (resid 43 and name HA )(resid 114 and name HA ) 2.536 0.458 0.558 assign (resid 114 and name HA )(resid 43 and name HA ) 2.496 0.450 0.549 assign (resid 114 and name HA )(resid 42 and name HN ) 3.427 0.486 0.567 assign (resid 41 and name HG2# )(resid 114 and name HA ) 3.091 0.558 0.680 assign (resid 114 and name HA )(resid 41 and name HG2# ) 3.476 0.627 0.765 ! I113 assign (resid 113 and name HA )(resid 113 and name HN ) 3.188 0.452 0.527 assign (resid 113 and name HN )(resid 113 and name HA ) 3.178 0.573 0.700 assign (resid 113 and name HB )(resid 113 and name HN ) 3.393 0.481 0.561 assign (resid 113 and name HG2# )(resid 113 and name HN ) 2.345 0.332 0.388 assign (resid 113 and name HG12 )(resid 113 and name HN ) 4.937 0.700 0.816 assign ((resid 112 and name HG2# ) or (resid 113 and name HG11 ))(resid 113 and name HN ) 2.899 0.411 0.479 assign (resid 113 and name HN )(resid 113 and name HG2# ) 2.561 0.462 0.564 assign (resid 113 and name HN )(resid 113 and name HD* ) 4.327 0.781 0.952 assign (resid 113 and name HG11 )(resid 113 and name HA ) 2.858 0.516 0.629 assign (resid 113 and name HG12 )(resid 113 and name HA ) 2.858 0.516 0.629 assign (resid 113 and name HG2# )(resid 113 and name HA ) 3.038 0.548 0.669 assign (resid 113 and name HA )(resid 113 and name HG2# ) 3.024 0.545 0.666 assign (resid 113 and name HA )(resid 113 and name HD* ) 3.022 0.545 0.666 assign (resid 113 and name HG11 )(resid 113 and name HG2# ) 2.193 0.396 0.483 assign (resid 113 and name HG11 )(resid 113 and name HD* ) 2.134 0.385 0.470 assign (resid 113 and name HG12 )(resid 113 and name HG2# ) 3.452 0.623 0.760 assign (resid 113 and name HG12 )(resid 113 and name HD* ) 2.593 0.468 0.571 assign (resid 112 and name HN )(resid 113 and name HN ) 4.069 0.577 0.673 assign (resid 113 and name HN )(resid 112 and name HN ) 4.599 0.652 0.760 assign (resid 112 and name HA )(resid 113 and name HN ) 2.366 0.336 0.391 assign (resid 113 and name HN )(resid 112 and name HA ) 2.174 0.392 0.479 assign (resid 112 and name HB )(resid 113 and name HN ) 2.365 0.335 0.391 assign (resid 113 and name HN )(resid 112 and name HG2# ) 3.389 0.611 0.746 assign (resid 112 and name HG2# )(resid 113 and name HN ) 2.899 0.411 0.479 assign (resid 113 and name HA )(resid 105 and name HD# ) 3.372 0.557 0.681 assign (resid 113 and name HA )(resid 105 and name HE# ) 3.023 0.500 0.611 assign ((resid 113 and name HG11 ) or (resid 76 and name HG2# ))(resid 105 and name HD# ) 3.978 0.658 0.804 assign ((resid 113 and name HG11) or (resid 76 and name HG2#) or (resid 69 and name HG12))(resid 105 and name HE#) 3.34 0.55 0.68 assign (resid 113 and name HG12 )(resid 105 and name HD# ) 3.709 0.613 0.750 assign (resid 113 and name HG12 )(resid 105 and name HE# ) 3.537 0.585 0.715 assign ((resid 113 and name HG2# ) or (resid 108 and name HD2# ))(resid 105 and name HD# ) 3.886 0.642 0.785 assign ((resid 113 and name HD* ) or (resid 46 and name HD1# ))(resid 105 and name HD# ) 2.767 0.457 0.559 assign ((resid 113 and name HD* ) or (resid 46 and name HD1# ))(resid 105 and name HE# ) 3.282 0.543 0.663 assign ((resid 113 and name HD*) or (resid 46 and name HD*) or (resid 69 and name HG2#))(resid 105 and name HN ) 4.079 0.578 0.674 assign ((resid 105 or resid 102) and name HB1 )(resid 113 and name HD* ) 2.867 0.517 0.631 assign (resid 105 and name HB2 )(resid 113 and name HD* ) 3.626 0.654 0.799 assign (resid 105 and name HD# )(resid 113 and name HD* ) 2.925 0.528 0.644 assign ((resid 105 and name HE# ) or (resid 102 and name HD# ))(resid 113 and name HD* ) 3.134 0.565 0.690 assign ((resid 46 or resid 102) and name HA )(resid 113 and name HG2# ) 3.428 0.618 0.755 assign ((resid 46 or resid 102) and name HA )(resid 113 and name HD* ) 2.624 0.473 0.578 assign ((resid 113 and name HD*) or (resid 46 and name HD2#))(resid 102 and name HN ) 4.320 0.613 0.714 assign ((resid 113 and name HD*) or (resid 46 and name HD2#))(resid 102 and name HA ) 2.536 0.457 0.558 assign ((resid 113 and name HD*) or (resid 46 and name HD2#))(resid 102 and name HD#) 3.280 0.542 0.663 assign (resid 113 and name HG2# )(resid 79 and name HN ) 4.617 0.655 0.763 assign (resid 113 and name HD* )(resid 79 and name HN ) 4.397 0.624 0.727 assign (resid 113 and name HD* )(resid 79 and name HG2# ) 3.158 0.570 0.695 assign (resid 113 and name HD* )(resid 79 and name HD* ) 3.000 0.542 0.660 assign (resid 46 and name HN )(resid 113 and name HN ) 3.884 0.551 0.642 assign ((resid 46 and name HD1# ) or (resid 113 and (name HG2# or name HD*)))(resid 46 and name HN ) 2.680 0.380 0.443 assign (resid 113 and name HG2# )(resid 46 and name HN ) 4.033 0.728 999.0 assign (resid 113 and name HD* )(resid 46 and name HN ) 3.894 0.702 999.0 assign (resid 46 and name HA )(resid 113 and name HG2# ) 3.428 0.618 0.755 assign (resid 46 and name HG )(resid 113 and name HG2# ) 4.449 0.803 999.0 assign (resid 113 and name HN )(resid 46 and name HN ) 3.620 0.513 0.598 assign (resid 44 and name HN )(resid 113 and name HN ) 2.834 0.402 0.468 assign (resid 113 and name HN )(resid 44 and name HN ) 2.907 0.412 0.481 assign (resid 44 and name HN )(resid 113 and name HG2# ) 3.324 0.600 0.732 assign ((resid 113 and (name HG2# or name HD*)) or (resid 44 and name HG1#))(resid 44 and name HN ) 2.590 0.367 0.428 ! T112 assign (resid 112 and name HA )(resid 112 and name HN ) 3.471 0.492 0.574 assign (resid 112 and name HN )(resid 112 and name HA ) 2.844 0.513 0.626 assign (resid 112 and name HB )(resid 112 and name HN ) 4.409 0.625 0.729 assign (resid 112 and name HG2# )(resid 112 and name HN ) 3.213 0.456 0.531 assign (resid 112 and name HB )(resid 112 and name HA ) 2.286 0.412 0.503 assign (resid 112 and name HG2# )(resid 112 and name HA ) 2.263 0.408 0.498 assign (resid 111 and name HN )(resid 112 and name HN ) 3.086 0.438 0.510 assign ((resid 112 or resid 110) and name HN )(resid 111 and name HN ) 2.599 0.369 0.430 assign (resid 111 and name HA )(resid 112 and name HN ) 3.615 0.513 0.598 assign (resid 112 and name HN )(resid 111 and name HA ) 3.064 0.553 0.674 assign (resid 112 and name HG2# )(resid 111 and name HA ) 3.589 0.648 0.790 assign ((resid 111 and name HG2 ) or (resid 110 and name HB1 ))(resid 112 and name HN ) 3.344 0.474 0.553 assign (resid 111 and name HB# )(resid 112 and name HN ) 3.165 0.449 0.523 assign ((resid 111 and name HB# ) or (resid 45 and name HG1 ))(resid 112 and name HG2# ) 2.943 0.531 0.648 assign ((resid 111 and name HG# ) or (resid 45 and name HB1 ))(resid 112 and name HG2# ) 2.613 0.471 0.575 assign (resid 110 and name HA )(resid 112 and name HN ) 3.747 0.531 0.619 assign (resid 110 and name HB2 )(resid 112 and name HN ) 4.141 0.587 0.684 assign (resid 110 and name HD# )(resid 112 and name HN ) 4.714 0.669 0.779 assign (resid 105 and name HD# )(resid 112 and name HN ) 4.915 0.697 0.813 assign ((resid 112 or resid 110) and name HN )(resid 105 and name HD# ) 3.841 0.635 0.776 assign (resid 112 and name HA )(resid 47 and name HN ) 4.051 0.574 0.670 assign ((resid 112 and name HG2# ) or (resid 48 and name HG* ))(resid 47 and name HN ) 3.522 0.499 0.582 assign (resid 47 and name HN )(resid 112 and name HG2# ) 4.767 0.860 1.049 assign (resid 46 and name HN )(resid 112 and name HN ) 4.874 0.691 0.806 assign (resid 46 and name HD1# )(resid 112 and name HN ) 4.449 0.631 0.735 assign (resid 46 and name HN )(resid 112 and name HA ) 2.535 0.457 0.558 assign (resid 112 and name HA )(resid 46 and name HN ) 2.503 0.355 0.414 assign (resid 112 and name HB )(resid 46 and name HN ) 3.973 0.563 0.657 assign ((resid 112 and name HG2# ) or (resid 48 and name HG* ))(resid 46 and name HN ) 2.763 0.392 0.457 assign (resid 46 and name HN )(resid 112 and name HG2# ) 3.539 0.638 0.779 assign ((resid 46 and name HD1#) or (resid 44 and name HG2#))((resid 112 and name HG2#) or (resid 48 and name HG1#)) 2.84 0.51 0.63 assign ((resid 112 and name HG2# ) or (resid 48 and name HG* ))(resid 46 and name HD1# ) 3.304 0.596 0.727 assign (resid 45 and name HA )(resid 112 and name HA ) 2.178 0.393 0.479 assign (resid 112 and name HA )(resid 45 and name HA ) 2.127 0.383 0.468 assign (resid 45 and name HD2 )(resid 112 and name HG2# ) 3.650 0.658 0.803 assign (resid 112 and name HB )(resid 44 and name HN ) 3.260 0.462 0.539 assign ((resid 112 and name HG2# ) or (resid 48 and name HG* ))(resid 44 and name HN ) 3.822 0.542 0.632 assign (resid 112 and name HB )(resid 43 and name HD22 ) 4.836 0.686 0.799 assign ((resid 112 and name HG2# ) or (resid 48 and name HG* ))(resid 43 and name HD22 ) 5.498 0.780 0.909 assign (resid 112 and name HB )(resid 43 and name HD21 ) 4.105 0.582 0.679 assign ((resid 112 and name HG2# ) or (resid 48 and name HG* ))(resid 43 and name HD21 ) 4.683 0.664 0.774 ! E111 assign (resid 111 and name HA )(resid 111 and name HN ) 2.719 0.386 0.449 assign (resid 111 and name HN )(resid 111 and name HA ) 2.946 0.531 0.648 assign (resid 111 and name HB# )(resid 111 and name HN ) 2.543 0.361 0.420 assign (resid 111 and name HG1 )(resid 111 and name HN ) 3.434 0.487 0.568 assign ((resid 111 and name HG2 ) or (resid 110 and name HB1 ))(resid 111 and name HN ) 3.002 0.426 0.496 assign (resid 111 and name HG1 )(resid 111 and name HA ) 2.941 0.531 0.647 assign (resid 111 and name HG2 )(resid 111 and name HA ) 2.845 0.513 0.626 assign (resid 111 and name HN )(resid 110 and name HN ) 3.869 0.549 0.640 assign (resid 110 and name HA )(resid 111 and name HN ) 2.352 0.333 0.389 assign (resid 111 and name HN )(resid 110 and name HA ) 2.869 0.517 0.631 assign (resid 110 and name HB2 )(resid 111 and name HN ) 3.736 0.530 0.618 assign (resid 110 and name HD# )(resid 111 and name HN ) 3.510 0.498 0.580 assign (resid 111 and name HA )(resid 46 and name HN ) 4.064 0.576 0.672 assign (resid 46 and name HD1# )(resid 111 and name HA ) 3.512 0.634 0.773 assign (resid 111 and name HA )(resid 46 and name HD1# ) 3.784 0.683 0.833 ! R110 assign (resid 110 and name HA )(resid 110 and name HN ) 3.069 0.435 0.507 assign (resid 110 and name HN )(resid 110 and name HA ) 3.024 0.546 0.666 assign ((resid 110 and name HB1 ) or (resid 109 and (name HG# or name HB# )))(resid 110 and name HN ) 2.791 0.396 0.461 assign (resid 110 and name HB2 )(resid 110 and name HN ) 2.702 0.383 0.447 assign (resid 110 and name HG# )(resid 110 and name HN ) 2.841 0.403 0.470 assign (resid 110 and name HD# )(resid 110 and name HN ) 3.655 0.518 0.604 assign (resid 110 and name HG# )(resid 110 and name HA ) 3.313 0.592 0.729 assign (resid 110 and name HD# )(resid 110 and name HA ) 2.526 0.456 0.556 assign (resid 109 and name HN )(resid 110 and name HN ) 2.737 0.388 0.452 assign ((resid 110 or resid 108) and name HN )(resid 109 and name HN ) 2.514 0.357 0.416 assign (resid 109 and name HA )(resid 110 and name HN ) 2.662 0.377 0.440 assign (resid 110 and name HN )(resid 109 and name HA ) 2.663 0.480 0.586 assign (resid 105 and name HA )(resid 110 and name HN ) 4.445 0.630 0.735 assign (resid 105 and name HB2 )(resid 110 and name HN ) 4.976 0.706 0.823 assign (resid 105 and name HD# )(resid 110 and name HN ) 3.827 0.543 0.633 assign ((resid 110 and name HG1) or (resid 101 and (name HB2 or name HG#)))(resid 105 and name HD#) 2.922 0.483 0.591 assign ((resid 110 and name HB2) or (resid 101 and name HB1))(resid 105 and name HD#) 2.979 0.492 0.602 assign ((resid 110 and name HB1 ) or (resid 76 and name HB ))(resid 105 and name HD# ) 3.356 0.555 0.678 assign (resid 110 and name HG2 )(resid 105 and name HD# ) 3.556 0.588 0.719 assign (resid 110 and name HD# )(resid 105 and name HD# ) 3.718 0.615 0.751 assign ((resid 110 and name HB1 ) or (resid 76 and name HB ))(resid 105 and name HE# ) 4.313 0.713 0.872 assign ((resid 110 and name HD# ) or (resid 101 and name HD1 ))(resid 105 and name HE# ) 3.721 0.615 0.752 ! Q109 assign (resid 109 and name HA )(resid 109 and name HN ) 2.136 0.303 0.353 assign (resid 109 and name HN )(resid 109 and name HA ) 2.158 0.389 0.475 assign (resid 109 and (name HG# or name HB# ))(resid 109 and name HN ) 2.532 0.359 0.418 assign (resid 109 and name HN )(resid 109 and name HB1 ) 3.245 0.585 0.714 assign (resid 109 and name HN )(resid 109 and name HB2 ) 3.267 0.589 0.719 assign (resid 109 and name HA )(resid 109 and name HE22 ) 4.713 0.668 0.779 assign (resid 109 and name HA )(resid 109 and name HE21 ) 4.817 0.683 0.796 assign (resid 109 and name HN )(resid 108 and name HN ) 2.807 0.398 0.464 assign (resid 108 and name HA )(resid 109 and name HN ) 3.463 0.491 0.572 assign (resid 109 and name HN )(resid 108 and name HA ) 3.324 0.600 0.732 assign (resid 108 and (name HB1 or name HG ))(resid 109 and name HN ) 3.576 0.507 0.591 assign (resid 108 and name HB2 )(resid 109 and name HN ) 4.185 0.593 0.692 assign (resid 108 and name HD1# )(resid 109 and name HN ) 5.410 0.767 0.894 assign (resid 107 and name HN )(resid 109 and name HN ) 4.654 0.660 0.769 assign (resid 109 and name HN )(resid 107 and name HN ) 4.603 0.653 0.761 assign (resid 109 and name HN )(resid 107 and name HA ) 3.581 0.646 0.788 ! L108 assign (resid 108 and name HA )(resid 108 and name HN ) 2.784 0.395 0.460 assign (resid 108 and name HN )(resid 108 and name HA ) 2.888 0.521 0.636 assign (resid 108 and (name HB1 or name HG ))(resid 108 and name HN ) 2.356 0.334 0.389 assign (resid 108 and name HB2 )(resid 108 and name HN ) 2.814 0.399 0.465 assign (resid 108 and name HD1# )(resid 108 and name HN ) 3.060 0.434 0.506 assign (resid 108 and name HN )(resid 108 and name HD1# ) 3.074 0.555 0.677 assign (resid 108 and name HD2# )(resid 108 and name HN ) 3.307 0.469 0.547 assign (resid 108 and name HN )(resid 108 and name HD2# ) 3.356 0.605 0.739 assign (resid 108 and name HD1# )(resid 108 and name HA ) 2.263 0.408 0.498 assign (resid 108 and name HA )(resid 108 and name HD1# ) 2.115 0.381 0.465 assign (resid 108 and name HD2# )(resid 108 and name HA ) 3.433 0.619 0.756 assign (resid 108 and name HA )(resid 108 and name HD2# ) 3.368 0.608 0.741 assign (resid 107 and name HN )(resid 108 and name HN ) 2.865 0.406 0.474 assign ((resid 107 or resid 106) and name HA )(resid 108 and name HN ) 3.093 0.439 0.511 assign (resid 108 and name HN )(resid 107 and name HA ) 3.271 0.590 0.720 assign (resid 105 and name HA )(resid 108 and name HN ) 3.428 0.486 0.567 assign (resid 108 and name HN )(resid 105 and name HA ) 2.863 0.516 0.630 assign (resid 108 and name HD2# )(resid 105 and name HA ) 2.558 0.461 0.563 assign (resid 105 and name HA )(resid 108 and name HD2# ) 3.315 0.598 0.730 assign (resid 104 and name HA )(resid 108 and name HN ) 4.126 0.585 0.682 assign (resid 70 and name HD# )(resid 108 and name HD1# ) 2.949 0.532 0.649 assign (resid 108 and name HD2# )(resid 70 and name HN ) 3.917 0.555 0.648 assign (resid 108 and name HD2# )(resid 70 and name HA ) 3.888 0.701 0.856 assign (resid 70 and name HA )(resid 108 and name HD2# ) 3.592 0.648 0.791 assign ((resid 69 and name HG12) or (resid 66 and name HG2#) or (resid 108 and name HD1#))(resid 70 and name HN) 3.576 0.507 0.591 assign (resid 108 and name HD2# )(resid 69 and name HN ) 3.900 0.553 0.645 assign ((resid 69 and name HB) or (resid 70 and name HG2) or (resid 108 and name HB2))(resid 108 and name HD2#) 2.441 0.440 0.537 assign (resid 69 and name HG2# )(resid 108 and name HD2# ) 2.441 0.440 0.537 assign (resid 108 and name HD2# )(resid 69 and name HG2# ) 2.385 0.430 0.525 assign (resid 108 and name HD2# )(resid 69 and name HD* ) 2.882 0.520 0.634 assign (resid 108 and name HD2# )(resid 66 and name HA ) 2.978 0.537 0.655 assign (resid 108 and name HD2# )(resid 66 and name HN ) 4.185 0.593 0.692 assign (resid 66 and name HA )(resid 108 and name HD2# ) 2.923 0.527 0.643 assign (resid 108 and name HN )(resid 66 and name HG1# ) 3.414 0.616 0.751 assign (resid 66 and name HG1# )(resid 108 and name HN ) 4.092 0.580 0.676 assign (resid 108 and name HD2# )(resid 66 and name HG1# ) 3.674 0.663 0.809 assign (resid 108 and name HD2# )(resid 66 and name HG2# ) 3.414 0.616 0.751 ! Q107 assign ((resid 107 or resid 106) and name HA )(resid 107 and name HN ) 2.504 0.355 0.414 assign (resid 107 and name HN )(resid 107 and name HA ) 2.909 0.252 0.640 assign (resid 107 and name HB1 )(resid 107 and name HN ) 2.484 0.352 0.411 assign (resid 107 and name HB2 )(resid 107 and name HN ) 2.624 0.372 0.434 assign (resid 107 and name HG1 )(resid 107 and name HN ) 3.791 0.538 0.627 assign (resid 107 and name HG1 )(resid 107 and name HA ) 2.812 0.507 0.619 assign (resid 106 and name HN )(resid 107 and name HN ) 2.927 0.415 0.484 assign (resid 107 and name HN )(resid 106 and name HN ) 2.855 0.405 0.472 assign (resid 107 and name HN )(resid 106 and name HA ) 3.298 0.595 0.726 assign (resid 106 and name HB2 )(resid 107 and name HN ) 3.300 0.468 0.545 assign (resid 105 and name HA )(resid 107 and name HN ) 4.881 0.692 0.807 assign (resid 104 and name HA )(resid 107 and name HN ) 3.417 0.485 0.565 assign (resid 107 and name HN )(resid 104 and name HA ) 3.333 0.601 0.734 assign (resid 107 and name HB1 )(resid 104 and name HA ) 3.091 0.558 0.680 assign (resid 107 and name HB2 )(resid 104 and name HA ) 2.997 0.541 0.660 assign (resid 103 and name HA )(resid 107 and name HN ) 4.139 0.587 0.684 assign (resid 66 and name HG1# )(resid 107 and name HN ) 4.275 0.606 0.707 assign ((resid 66 or resid 62) and name HG2# )(resid 107 and name HN ) 4.343 0.606 0.707 assign (resid 66 and name HG1# )(resid 107 and name HE22 ) 4.926 0.698 0.814 assign ((resid 107 or resid 63) and name HE22 )(resid 66 and name HG1# ) 3.487 0.629 0.767 assign (resid 66 and name HG2# )(resid 107 and name HE22 ) 4.187 0.594 0.692 assign ((resid 107 or resid 63) and name HE22 )((resid 66 or resid 62) and name HG2# ) 3.458 0.624 0.761 assign (resid 66 and name HG1# )(resid 107 and name HE21 ) 4.946 0.701 0.816 assign ((resid 66 or resid 62) and name HG2# )(resid 107 and name HE21 ) 4.049 0.574 0.669 assign (resid 107 and name HE21 )((resid 66 or resid 62) and name HG2# ) 3.685 0.665 0.811 assign (resid 107 and name HB2 )(resid 66 and name HG1# ) 3.062 0.552 0.674 assign (resid 107 and name HG1 )(resid 66 and name HG1# ) 3.487 0.629 0.767 ! Q106 assign (resid 106 and name HA )(resid 106 and name HN ) 2.758 0.391 0.456 assign (resid 106 and name HN )(resid 106 and name HA ) 3.285 0.593 0.723 assign (resid 106 and (name HB1 or name HG2 ))(resid 106 and name HN ) 2.600 0.369 0.430 assign (resid 106 and name HB2 )(resid 106 and name HN ) 2.672 0.379 0.442 assign (resid 106 and name HG1 )(resid 106 and name HN ) 3.621 0.514 0.598 assign (resid 106 and name HG1 )(resid 106 and name HA ) 2.812 0.507 0.619 assign (resid 106 and name HE22 )(resid 106 and name HN ) 6.008 0.852 0.993 assign (resid 106 and name HN )(resid 106 and name HE22 ) 5.340 0.757 0.883 assign (resid 106 and name HA )(resid 106 and name HE22 ) 5.105 0.724 0.844 assign (resid 106 and name HA )(resid 106 and name HE21 ) 4.374 0.620 0.723 assign (resid 106 and name HB2 )(resid 106 and name HE21 ) 4.523 0.642 0.748 assign (resid 106 and (name HB1 or name HG2 ))(resid 106 and name HE22 ) 3.083 0.437 0.509 assign (resid 106 and (name HB1 or name HG2 ))(resid 106 and name HE21 ) 2.958 0.419 0.489 assign (resid 106 and name HG1 )(resid 106 and name HE22 ) 3.469 0.492 0.573 assign (resid 106 and name HG1 )(resid 106 and name HE21 ) 3.273 0.464 0.541 assign (resid 105 and name HN )(resid 106 and name HN ) 2.996 0.425 0.495 assign (resid 106 and name HN )(resid 105 and name HN ) 3.073 0.436 0.508 assign (resid 105 and name HA )(resid 106 and name HN ) 3.865 0.548 0.639 assign (resid 105 and name HB1 )(resid 106 and name HN ) 3.307 0.469 0.547 assign (resid 105 and name HB2 )(resid 106 and name HN ) 3.625 0.514 0.599 assign (resid 105 and name HD# )(resid 106 and name HN ) 4.107 0.582 0.679 assign (resid 106 and name HN )(resid 105 and name HD# ) 4.027 0.666 0.814 assign (resid 104 and name HN )(resid 106 and name HN ) 4.230 0.600 0.699 assign (resid 104 and name HA )(resid 106 and name HN ) 3.935 0.558 0.650 assign (resid 103 and name HA )(resid 106 and name HN ) 3.528 0.500 0.583 assign (resid 106 and name HN )(resid 103 and name HA ) 3.412 0.616 0.751 assign (resid 106 and (name HB1 or name HG2 ))(resid 103 and name HA ) 3.050 0.550 0.671 assign (resid 106 and name HB2 )(resid 103 and name HA ) 3.473 0.626 0.764 assign (resid 103 and name HB# )(resid 106 and name HN ) 4.641 0.658 0.767 assign ((resid 106 and name HE22 ) or (resid 102 and name HD# ))(resid 103 and name HA ) 3.529 0.637 0.777 assign (resid 103 and name HA )(resid 106 and name HE22 ) 4.407 0.625 0.728 assign (resid 103 and name HB# )(resid 106 and name HE22 ) 4.764 0.676 0.788 assign ((resid 106 or resid 107) and name HA )(resid 102 and name HD# ) 4.503 0.744 0.910 assign ((resid 106 and name HG1 ) or (resid 51 and name HD2 ))(resid 102 and name HD# ) 3.889 0.643 0.786 assign ((resid 106 or resid 107) and name HA )(resid 102 and name HE# ) 4.584 0.758 0.926 assign ((resid 106 and name HG1 ) or (resid 51 and name HD2 ))(resid 102 and name HE# ) 3.623 0.599 0.732 assign (resid 106 and name HE21 )(resid 102 and name HE# ) 4.186 0.692 0.846 assign (resid 46 and name HD1# )(resid 106 and name HN ) 4.305 0.610 0.712 assign (resid 106 and name HN )(resid 46 and name HD1# ) 3.942 0.711 0.868 assign (resid 46 and name HD2# )(resid 106 and name HN ) 3.833 0.544 0.634 assign (resid 106 and name HN )(resid 46 and name HD2# ) 4.271 0.770 0.940 assign (resid 46 and name HD1# )(resid 106 and name HA ) 3.373 0.608 0.742 assign (resid 106 and name HA )(resid 46 and name HD1# ) 3.205 0.578 0.705 ! Y105 assign (resid 105 and name HA )(resid 105 and name HN ) 2.928 0.415 0.484 assign (resid 105 and name HN )(resid 105 and name HA ) 2.534 0.457 0.558 assign (resid 105 and name HB1 )(resid 105 and name HN ) 2.499 0.354 0.413 assign (resid 105 and name HB2 )(resid 105 and name HN ) 2.808 0.398 0.464 assign (resid 105 and name HD# )(resid 105 and name HN ) 2.503 0.355 0.414 assign (resid 105 and name HN )(resid 105 and name HD# ) 2.727 0.451 0.551 assign (resid 105 and name HD# )(resid 105 and name HA ) 2.900 0.523 0.638 assign (resid 105 and name HA )(resid 105 and name HD# ) 3.093 0.511 0.625 assign (resid 104 and name HN )(resid 105 and name HN ) 2.921 0.414 0.483 assign (resid 105 and name HN )(resid 104 and name HN ) 3.005 0.426 0.497 assign ((resid 104 or resid 102) and name HA )(resid 105 and name HN ) 3.075 0.436 0.508 assign (resid 104 and name HB# )(resid 105 and name HN ) 2.768 0.393 0.458 assign (resid 105 and name HN )(resid 104 and name HB# ) 2.977 0.537 0.655 assign ((resid 104 or resid 102) and name HA )(resid 105 and name HD# ) 3.630 0.600 0.734 assign (resid 104 and name HB# )(resid 105 and name HD# ) 3.823 0.632 0.773 assign (resid 103 and name HN )(resid 105 and name HN ) 4.639 0.658 0.767 assign (resid 103 and name HN )(resid 105 and name HN ) 4.175 0.592 0.690 assign (resid 105 and name HB2 )(resid 102 and name HA ) 3.411 0.615 0.751 assign ((resid 76 and name HG1# ) or (resid 62 and name HG2# ))(resid 105 and name HN ) 4.383 0.599 0.731 assign (resid 76 and name HG1# )(resid 105 and name HE# ) 3.445 0.570 0.696 assign (resid 105 and name HA )(resid 69 and name HD* ) 3.665 0.661 0.807 assign ((resid 69 and (name HD* or name HG2#)) or (resid 46 and name HD2#))(resid 105 and name HD# ) 3.021 0.499 0.611 assign ((resid 69 and (name HD* or name HG2#)) or (resid 46 and name HD2#))(resid 105 and name HE# ) 2.732 0.452 0.552 assign ((resid 105 or resid 102) and name HE# )(resid 69 and name HD* ) 2.910 0.525 0.641 ! A104 assign ((resid 104 or resid 101) and name HA )(resid 104 and name HN ) 2.667 0.378 0.441 assign (resid 104 and name HN )(resid 104 and name HA ) 2.993 0.540 0.659 assign (resid 104 and name HB# )(resid 104 and name HN ) 2.286 0.324 0.378 assign (resid 104 and name HN )(resid 104 and name HB# ) 2.413 0.435 0.531 assign (resid 103 and name HN )(resid 104 and name HN ) 2.945 0.417 0.487 assign (resid 104 and name HN )(resid 103 and name HN ) 2.866 0.406 0.473 assign (resid 103 and name HA )(resid 104 and name HN ) 3.370 0.478 0.557 assign (resid 104 and name HN )(resid 103 and name HA ) 3.431 0.619 0.755 assign (resid 103 and name HB# )(resid 104 and name HN ) 2.658 0.377 0.439 assign (resid 104 and name HN )(resid 103 and name HB# ) 2.998 0.541 0.660 assign (resid 104 and name HN )(resid 101 and name HA ) 3.208 0.579 0.706 assign (resid 104 and name HB# )(resid 101 and name HA ) 2.944 0.531 0.648 assign (resid 69 and name HD* )(resid 104 and name HB# ) 2.441 0.440 0.537 assign ((resid 69 and name HB ) or (resid 104 and name HB# ))(resid 69 and name HD* ) 2.313 0.417 0.509 assign ((resid 69 and name HB ) or (resid 104 and name HB# ))(resid 66 and name HN ) 3.007 0.426 0.497 assign (resid 66 and name HG1# )(resid 104 and name HN ) 4.230 0.600 0.699 assign (resid 66 and name HG1# )(resid 104 and name HA ) 2.417 0.436 0.532 assign ((resid 69 and name HB ) or (resid 104 and name HB# ))(resid 66 and name HA ) 2.784 0.502 0.613 assign ((resid 104 or resid 63) and name HA )(resid 66 and name HG1# ) 2.328 0.420 0.512 assign (resid 104 and name HB# )(resid 66 and name HG1# ) 2.370 0.428 0.522 assign (resid 66 and name HG1# )(resid 104 and name HB# ) 2.312 0.417 0.509 assign ((resid 66 or resid 62) and name HG2# )(resid 104 and name HB# ) 2.345 0.423 0.516 assign (resid 65 and name HD2# )(resid 104 and name HN ) 4.442 0.630 0.734 assign (resid 104 and name HB# )(resid 65 and name HN ) 3.554 0.504 0.587 assign (resid 65 and name HD2# )(resid 104 and name HB# ) 3.598 0.649 0.792 assign (resid 62 and name HG2# )(resid 104 and name HA ) 2.530 0.456 0.557 assign (resid 104 and name HA )(resid 62 and name HG2# ) 2.692 0.486 0.592 assign (resid 104 and name HN )(resid 62 and name HG2# ) 3.509 0.633 0.772 assign ((resid 66 or resid 62) and name HG2# )(resid 104 and name HN ) 2.959 0.420 0.489 ! A103 assign ((resid 103 or resid 100) and name HA )(resid 103 and name HN ) 2.663 0.378 0.440 assign (resid 103 and name HN )(resid 103 and name HA ) 3.070 0.554 0.676 assign (resid 103 and name HB# )(resid 103 and name HN ) 2.286 0.324 0.378 assign (resid 103 and name HN )(resid 103 and name HB# ) 2.684 0.484 0.591 assign (resid 102 and name HN )(resid 103 and name HN ) 2.941 0.417 0.486 assign (resid 103 and name HN )(resid 102 and name HN ) 3.092 0.439 0.511 assign ((resid 102 or resid 99) and name HA )(resid 103 and name HN ) 3.423 0.485 0.566 assign (resid 102 and name HB1 )(resid 103 and name HN ) 2.845 0.404 0.470 assign (resid 102 and name HB2 )(resid 103 and name HN ) 3.354 0.476 0.554 assign (resid 102 and name HD# )(resid 103 and name HN ) 3.258 0.462 0.539 assign (resid 103 and name HN )(resid 102 and name HD# ) 3.416 0.565 0.690 assign (resid 103 and name HN )(resid 102 and name HE# ) 4.100 0.678 0.829 assign (resid 103 and name HA )(resid 102 and name HD# ) 3.351 0.554 0.677 assign (resid 103 and name HA )(resid 102 and name HE# ) 4.055 0.670 0.820 assign ((resid 103 and name HB# ) or (resid 46 and name HB1 ))(resid 102 and name HD# ) 3.737 0.618 0.755 assign ((resid 103 and name HB# ) or (resid 46 and name HB1 ))(resid 102 and name HE# ) 3.614 0.597 0.730 assign (resid 103 and name HN )(resid 100 and name HA ) 3.636 0.656 0.800 assign (resid 103 and name HB# )(resid 100 and name HA ) 2.754 0.497 0.606 assign (resid 66 and name HG1# )(resid 103 and name HB# ) 4.048 0.730 0.891 assign (resid 103 and name HB# )(resid 66 and name HG1# ) 3.499 0.631 0.770 assign (resid 62 and name HG1# )(resid 103 and name HN ) 4.572 0.648 0.756 assign (resid 62 and name HG2# )(resid 103 and name HN ) 4.492 0.637 0.743 assign (resid 62 and name HG1# )(resid 103 and name HB# ) 2.512 0.453 0.553 assign (resid 103 and name HB# )(resid 62 and name HG1# ) 2.273 0.410 0.500 assign (resid 62 and name HG2# )(resid 103 and name HB# ) 2.693 0.486 0.593 assign (resid 103 and name HB# )(resid 62 and name HG2# ) 2.538 0.458 0.559 assign ((resid 57 and name HD1# ) or (resid 65 and name HD2# ))(resid 103 and name HN ) 4.277 0.607 0.707 assign (resid 57 and name HD2# )(resid 103 and name HN ) 4.401 0.624 0.727 assign (resid 57 and name HD1# )(resid 103 and name HB# ) 2.684 0.484 0.591 assign ((resid 103 and name HB#) or (resid 57 and name HB1) or (resid 58 and name HN))(resid 57 and name HD1#) 2.251 0.406 0.495 assign (resid 57 and name HD2# )(resid 103 and name HB# ) 3.408 0.615 0.750 assign ((resid 103 and name HB#) or (resid 57 and name HB1) or (resid 58 and name HN))(resid 57 and name HD2#) 2.529 0.456 0.557 ! Y102 assign ((resid 102 or resid 99) and name HA )(resid 102 and name HN ) 2.819 0.400 0.466 assign (resid 102 and name HN )(resid 102 and name HA ) 2.931 0.529 0.645 assign (resid 102 and name HB1 )(resid 102 and name HN ) 2.845 0.403 0.470 assign (resid 102 and name HB2 )(resid 102 and name HN ) 2.856 0.405 0.472 assign (resid 102 and name HD# )(resid 102 and name HN ) 3.413 0.484 0.564 assign (resid 102 and name HN )(resid 102 and name HD# ) 3.555 0.588 0.718 assign (resid 102 and name HD# )(resid 102 and name HA ) 3.020 0.545 0.665 assign ((resid 102 or resid 99) and name HA )(resid 102 and name HD# ) 3.020 0.499 0.610 assign (resid 102 and name HB1 )(resid 102 and name HD# ) 2.878 0.476 0.582 assign ((resid 102 and name HB2 ) or (resid 99 and name HB1 ))(resid 102 and name HD# ) 2.941 0.486 0.594 assign (resid 101 and name HN )(resid 102 and name HN ) 3.077 0.436 0.509 assign (resid 102 and name HN )(resid 101 and name HN ) 2.717 0.385 0.449 assign (resid 102 and name HN )(resid 101 and name HA ) 3.485 0.629 0.767 assign (resid 101 and name HB1 )(resid 102 and name HN ) 3.539 0.502 0.585 assign (resid 101 and name HB2 )(resid 102 and name HN ) 3.716 0.527 0.614 assign (resid 101 and name HG2 )(resid 102 and name HN ) 3.902 0.553 0.645 assign (resid 100 and name HA )(resid 102 and name HN ) 4.238 0.601 0.701 assign (resid 102 and (name HD# or name HE# ))(resid 79 and name HD* ) 4.096 0.641 0.812 assign (resid 57 and name HD2# )(resid 102 and name HD# ) 4.913 0.812 0.993 assign ((resid 51 and name HG1 ) or (resid 46 and name HG ))(resid 102 and name HD# ) 4.596 0.760 0.929 assign ((resid 51 and name HG1 ) or (resid 46 and name HG ))(resid 102 and name HE# ) 4.062 0.671 0.821 assign ((resid 51 and name HG2 ) or (resid 49 and name HB2 ))(resid 102 and name HD# ) 4.335 0.717 0.876 assign ((resid 51 and name HG2 ) or (resid 49 and name HB2 ))(resid 102 and name HE# ) 3.651 0.604 0.738 assign (resid 49 and name HD1# )(resid 102 and name HD# ) 2.970 0.491 0.600 assign (resid 49 and name HD1# )(resid 102 and name HE# ) 2.840 0.470 0.574 assign ((resid 46 and name HD1# ) or (resid 49 and name HD2# ))(resid 102 and name HD#) 3.656 0.604 0.739 assign ((resid 46 and name HD1# ) or (resid 49 and name HD2# ))(resid 102 and name HE#) 3.804 0.629 0.769 assign (resid 46 and name HD2# )(resid 102 and name HE# ) 3.565 0.589 0.720 assign ((resid 102 and name HA ) or (resid 45 and name HD2 ))(resid 44 and name HG1# ) 3.775 0.681 0.831 assign ((resid 102 and name HA ) or (resid 45 and name HD2 ))(resid 44 and name HG2# ) 3.697 0.667 0.814 ! R101 assign (resid 101 and name HN )(resid 101 and name HA ) 3.068 0.554 0.675 assign (resid 101 and name HB1 )(resid 101 and name HA ) 2.461 0.444 0.542 assign (resid 101 and name HB2 )(resid 101 and name HA ) 2.953 0.533 0.650 assign (resid 101 and name HG1 )(resid 101 and name HA ) 2.584 0.466 0.569 assign (resid 101 and name HG2 )(resid 101 and name HA ) 2.953 0.533 0.650 assign (resid 101 and name HD2 )(resid 101 and name HA ) 3.500 0.500 999.0 assign (resid 101 and name HD1 )(resid 101 and name HA ) 3.500 0.500 999.0 assign (resid 100 and name HN )(resid 101 and name HN ) 3.188 0.452 0.527 assign (resid 100 and name HA )(resid 101 and name HN ) 3.201 0.454 0.529 assign (resid 101 and name HB1 )(resid 98 and name HA1 ) 3.500 0.500 999.0 assign (resid 101 and name HB2 )(resid 98 and name HA1 ) 3.500 0.500 999.0 assign (resid 101 and name HB1 )(resid 98 and name HA2 ) 3.500 0.500 999.0 assign (resid 101 and name HB2 )(resid 98 and name HA2 ) 3.500 0.500 999.0 assign (resid 101 and name HG1 )(resid 98 and name HA1 ) 3.500 0.500 999.0 assign (resid 101 and name HG2 )(resid 98 and name HA1 ) 3.500 0.500 999.0 assign (resid 101 and name HG1 )(resid 98 and name HA2 ) 3.500 0.500 999.0 assign (resid 101 and name HG2 )(resid 98 and name HA2 ) 3.500 0.500 999.0 assign (resid 101 and name HD1 )(resid 98 and name HA1 ) 3.500 0.500 999.0 assign (resid 101 and name HD2 )(resid 98 and name HA1 ) 3.500 0.500 999.0 assign (resid 101 and name HD1 )(resid 98 and name HA2 ) 3.500 0.500 999.0 assign (resid 101 and name HD2 )(resid 98 and name HA2 ) 3.500 0.500 999.0 assign (resid 101 and name HB1 )(resid 79 and name HG2# ) 2.823 0.509 0.621 assign (resid 101 and name HB2 )(resid 79 and name HG2# ) 3.040 0.548 0.669 assign (resid 101 and name HG1 )(resid 79 and name HG2# ) 3.500 0.500 999.0 assign (resid 101 and name HG2 )(resid 79 and name HG2# ) 3.500 0.500 999.0 assign (resid 101 and name HD1 )(resid 79 and name HG2# ) 3.500 0.500 999.0 assign (resid 101 and name HD2 )(resid 79 and name HG2# ) 3.213 0.580 0.707 assign (resid 79 and name HG2# )(resid 101 and name HD1 ) 3.542 0.639 0.779 assign (resid 79 and name HG2# )(resid 101 and name HD2 ) 3.374 0.609 0.742 assign ((resid 101 and name HD1 ) or (resid 69 and name HA ))(resid 76 and name HG1# ) 3.409 0.615 0.750 assign (resid 65 and name HD2# )(resid 101 and name HA ) 2.734 0.493 0.602 assign (resid 101 and name HA )(resid 65 and name HD2# ) 2.994 0.540 0.659 assign (resid 101 and (name HG2 or name HB2 ))(resid 65 and name HD2# ) 3.293 0.594 0.725 ! H100 assign (resid 100 and name HA )(resid 100 and name HN ) 2.772 0.393 0.458 assign ((resid 100 and name HB1 ) or (resid 62 and name HA ))(resid 100 and name HN ) 2.624 0.372 0.434 assign (resid 100 and name HA )(resid 100 and name HD2 ) 3.576 0.591 0.723 assign (resid 100 and name HB1 )(resid 100 and name HA ) 3.246 0.586 0.714 assign (((resid 100 or resid 58) and name HB2) or (resid 99 and name HB1))(resid 100 and name HD2) 3.307 0.547 0.668 assign (((resid 100 or resid 58) and name HB2) or (resid 99 and name HB1))(resid 100 and name HE1) 4.195 0.693 0.848 assign (((resid 100 or resid 58) and name HB2) or (resid 99 and name HB1))(resid 100 and name HN ) 2.572 0.365 0.435 assign (resid 99 and name HN )(resid 100 and name HN ) 2.935 0.416 0.485 assign (resid 100 and name HN )(resid 99 and name HN ) 3.440 0.488 0.569 assign (resid 99 and name HA )(resid 100 and name HN ) 3.364 0.477 0.556 assign (resid 100 and name HN )(resid 99 and name HA ) 3.409 0.615 0.750 assign (resid 99 and name HB2 )(resid 100 and name HN ) 3.121 0.443 0.516 assign (resid 99 and name HB2 )(resid 100 and name HE1 ) 4.751 0.785 0.960 assign ((resid 56 and name HG2# ) or (resid 57 and name HB2) or (resid 62 and name HG2#))(resid 100 and name HE1) 4.160 0.688 0.840 assign ((resid 100 and name HB1 ) or (resid 62 and name HA ))(resid 65 and name HD2# ) 2.743 0.389 0.453 assign (resid 65 and name HD2# )(resid 100 and name HB2 ) 3.246 0.586 0.714 assign ((resid 100 or resid 58) and name HB2 )(resid 65 and name HD2# ) 3.018 0.544 0.664 assign (resid 100 and name HD2 )(resid 62 and name HN ) 3.099 0.439 0.512 assign ((resid 62 and name HN ) or (resid 100 and name HE1 ))(resid 100 and name HD2 ) 3.026 0.500 0.611 assign (resid 62 and name HB )(resid 100 and name HD2 ) 4.497 0.743 0.909 assign (resid 62 and name HG1# )(resid 100 and name HA ) 2.887 0.521 0.635 assign (resid 62 and name HG2# )(resid 100 and name HA ) 4.028 0.729 0.889 assign (resid 100 and name HA )(resid 62 and name HG1# ) 2.881 0.519 0.634 assign (resid 100 and name HB2 )(resid 62 and name HG1# ) 3.440 0.621 0.757 assign (resid 62 and name HA )(resid 100 and name HD2 ) 3.576 0.591 0.723 assign (resid 100 and name HD2 )(resid 62 and name HG1# ) 2.853 0.515 0.628 assign (resid 62 and name HG1# )(resid 100 and name HD2 ) 2.596 0.429 0.525 assign ((resid 56 and name HG1# ) or (resid 61 and (name HG2 or name HD1 )))(resid 100 and name HD2 ) 3.987 0.659 0.806 assign (resid 100 and name HD2 )(resid 61 and name HN ) 3.847 0.546 0.636 assign (resid 61 and name HN )(resid 100 and name HD2 ) 3.768 0.623 0.762 assign (resid 61 and name HA )(resid 100 and name HD2 ) 4.327 0.716 0.874 assign (resid 61 and name HB1 )(resid 100 and name HD2 ) 3.082 0.509 0.623 assign (resid 61 and name HB2 )(resid 100 and name HD2 ) 3.097 0.512 0.626 assign ((resid 58 and name HN ) or (resid 57 and name HB1))(resid 100 and name HD2 ) 3.354 0.554 0.678 assign ((resid 58 and name HN ) or (resid 57 and name HB1))(resid 100 and name HE1 ) 3.471 0.574 0.701 assign (resid 58 and name HB1 )(resid 100 and name HD2 ) 3.986 0.659 0.806 assign (resid 58 and name HB1 )(resid 100 and name HE1 ) 4.684 0.774 0.947 assign (resid 57 and name HA )(resid 100 and name HD2 ) 3.858 0.683 0.780 assign (resid 100 and name HE1 )(resid 57 and name HN ) 4.403 0.624 0.728 assign (resid 57 and name HA )(resid 100 and name HE1 ) 3.427 0.566 0.693 assign (resid 100 and name HE1 )(resid 57 and name HA ) 3.208 0.579 0.706 assign (resid 57 and name HD2# )(resid 100 and name HN ) 3.530 0.501 0.583 assign (resid 100 and name HA )(resid 57 and name HD1# ) 3.430 0.619 0.755 assign (resid 57 and name HD2# )(resid 100 and name HA ) 3.041 0.549 0.669 assign (resid 100 and name HA )(resid 57 and name HD2# ) 2.847 0.514 0.627 assign (resid 57 and name HD1# )(resid 100 and name HD2 ) 4.434 0.733 0.896 assign (resid 57 and name HD2# )(resid 100 and name HD2 ) 3.410 0.564 0.689 assign (resid 57 and name HD2# )(resid 100 and name HE1 ) 3.522 0.582 0.712 assign (resid 55 and name HB# )(resid 100 and name HE1 ) 4.737 0.783 0.958 ! C99 assign (resid 99 and name HA )(resid 99 and name HN ) 2.790 0.396 0.461 assign (resid 99 and name HN )(resid 99 and name HA ) 2.871 0.518 0.632 assign (resid 99 and name HB1 )(resid 99 and name HN ) 2.771 0.393 0.458 assign (resid 99 and name HB2 )(resid 99 and name HN ) 3.070 0.426 0.496 assign (resid 98 and name HN )(resid 99 and name HN ) 3.444 0.488 0.569 assign (resid 99 and name HN )(resid 98 and name HN ) 2.982 0.423 0.493 assign (resid 98 and name HA1 )(resid 99 and name HN ) 3.770 0.535 0.624 assign (resid 98 and name HA2 )(resid 99 and name HN ) 3.614 0.512 0.597 assign (resid 97 and name HA1 )(resid 99 and name HN ) 3.483 0.494 0.576 assign (resid 97 and name HA2 )(resid 99 and name HN ) 3.868 0.548 0.639 assign ((resid 99 and name HA ) or (resid 55 and name HB# ))(resid 57 and name HD2# ) 3.465 0.625 0.763 assign (resid 99 and name HB1 )(resid 57 and name HD2# ) 2.962 0.534 0.652 assign (resid 99 and name HB2 )(resid 57 and name HD2# ) 3.542 0.639 0.780 ! G98 assign (resid 98 and name HA1 )(resid 98 and name HN ) 2.752 0.390 0.455 assign (resid 98 and name HA2 )(resid 98 and name HN ) 2.674 0.379 0.442 assign (resid 98 and name HN )(resid 98 and name HA2 ) 2.677 0.483 0.589 assign (resid 97 and name HN )(resid 98 and name HN ) 4.230 0.600 0.699 assign ((resid 98 or resid 42) and name HN )(resid 97 and name HN ) 4.089 0.580 0.676 assign (resid 97 and name HA1 )(resid 98 and name HN ) 2.576 0.365 0.426 assign (resid 98 and name HN )(resid 97 and name HA1 ) 2.728 0.492 0.600 assign (resid 97 and name HA2 )(resid 98 and name HN ) 2.423 0.344 0.401 assign (resid 98 and name HN )(resid 97 and name HA2 ) 2.518 0.454 0.554 assign (resid 79 and name HG2# )(resid 98 and name HN ) 3.736 0.530 0.618 assign (resid 79 and name HG2# )(resid 98 and name HA1 ) 2.473 0.446 0.544 assign (resid 98 and name HA1 )(resid 79 and name HG2# ) 3.059 0.552 0.673 assign (resid 79 and name HG2# )(resid 98 and name HA2 ) 2.229 0.402 0.491 assign (resid 98 and name HA2 )(resid 79 and name HG2# ) 2.855 0.515 0.628 ! G97 assign (resid 97 and name HA1 )(resid 97 and name HN ) 2.538 0.360 0.420 assign (resid 97 and name HN )(resid 97 and name HA1 ) 2.608 0.470 0.574 assign (resid 97 and name HA2 )(resid 97 and name HN ) 2.605 0.369 0.431 assign (resid 97 and name HN )(resid 97 and name HA2 ) 2.763 0.498 0.608 assign (resid 96 and name HN )(resid 97 and name HN ) 2.918 0.414 0.483 assign (resid 97 and name HN )(resid 96 and name HN ) 2.895 0.411 0.480 assign (resid 96 and name HA )(resid 97 and name HN ) 2.838 0.402 0.469 assign (resid 97 and name HN )(resid 96 and name HA ) 3.060 0.552 0.674 assign ((resid 96 and name HB1 ) or (resid 95 and name HB2 ))(resid 97 and name HN ) 3.140 0.446 0.519 assign (resid 96 and name HB2 )(resid 97 and name HN ) 3.888 0.551 0.642 assign ((resid 97 or resid 95 or resid 53) and name HN )(resid 96 and name HD# ) 4.165 0.689 0.842 assign (resid 95 and name HG )(resid 97 and name HN ) 4.148 0.588 0.686 ! F96 assign (resid 96 and name HA )(resid 96 and name HN ) 2.632 0.373 0.435 assign (resid 96 and name HN )(resid 96 and name HA ) 2.657 0.479 0.585 assign ((resid 96 and name HB1) or (resid 95 and name HB2) or (resid 52 and name HD1))(resid 96 and name HN) 3.076 0.436 0.508 assign (resid 96 and name HB2 )(resid 96 and name HN ) 2.610 0.370 0.431 assign (resid 96 and name HD# )(resid 96 and name HN ) 2.877 0.408 0.475 assign (resid 96 and name HN )(resid 96 and name HD# ) 3.237 0.535 0.654 assign (resid 96 and name HD# )(resid 96 and name HA ) 2.493 0.450 0.549 assign (resid 96 and name HA )(resid 96 and name HD# ) 2.862 0.473 0.579 assign (resid 96 and name HN )(resid 95 and name HN ) 4.805 0.681 0.794 assign (resid 95 and name HA )(resid 96 and name HN ) 2.300 0.326 0.380 assign (resid 96 and name HN )(resid 95 and name HA ) 2.312 0.417 0.509 assign ((resid 95 or resid 94 or resid 82 or resid 53 or resid 51) and name HA )(resid 96 and name HD# ) 3.580 0.592 0.724 assign ((resid 95 or resid 94 or resid 82 or resid 53 or resid 51) and name HA )(resid 96 and name HD# ) 3.848 0.636 0.778 assign (resid 96 and name HN )(resid 94 and name HD# ) 4.500 0.500 999.0 assign (resid 96 and name HN )(resid 94 and name HE# ) 4.500 0.500 999.0 assign (resid 94 and name HB2 )(resid 96 and name HD# ) 3.424 0.566 0.692 assign (resid 94 and name HB2 )(resid 96 and name HE# ) 3.230 0.534 0.653 assign (resid 96 and name HN )(resid 82 and name HN ) 5.000 0.500 999.0 assign ((resid 96 and name HD# ) or (resid 49 and name HN ))(resid 94 and name HD# ) 3.401 0.562 0.687 assign (resid 82 and name HD* )(resid 96 and name HN ) 3.608 0.512 0.596 assign (resid 96 and name HD# )(resid 82 and name HD1# ) 2.960 0.534 0.652 assign (resid 96 and name HD# )(resid 82 and name HN ) 4.275 0.606 0.707 assign (resid 81 and name HG2# )(resid 96 and name HN ) 3.364 0.477 0.556 assign (resid 96 and name HD# )(resid 53 and name HN ) 5.076 0.718 0.839 assign (resid 96 and name HE# )(resid 53 and name HN ) 4.666 0.662 0.771 assign (resid 53 and name HD1# )(resid 96 and name HA ) 3.490 0.629 0.768 assign (resid 96 and name HA )(resid 53 and name HD1# ) 3.854 0.695 0.848 assign (resid 53 and name HB1 )(resid 96 and name HD# ) 3.678 0.608 0.743 assign (resid 96 and name HD# )(resid 53 and name HD1# ) 3.454 0.623 0.760 assign (resid 53 and name HD1# )(resid 96 and name HD# ) 3.061 0.506 0.619 assign (resid 53 and name HD1# )(resid 96 and name HE# ) 3.368 0.557 0.681 assign (resid 96 and name HD# )(resid 53 and name HD2# ) 3.999 0.721 0.880 assign (resid 52 and name HG# )(resid 96 and name HE# ) 3.100 0.513 0.627 assign (resid 52 and name HG# )(resid 96 and name HZ ) 3.339 0.552 0.675 assign (resid 52 and name HD2 )(resid 96 and name HD# ) 4.653 0.769 0.940 assign (resid 52 and name HD2 )(resid 96 and name HE# ) 4.337 0.717 0.876 assign (resid 52 and name HD2 )(resid 96 and name HZ ) 4.661 0.770 0.942 assign ((resid 52 and name HD1 ) or (resid 96 and name HB1 ))(resid 96 and name HE# ) 3.549 0.587 0.717 assign ((resid 52 and name HD1 ) or (resid 96 and name HB1 ))(resid 96 and name HZ ) 4.434 0.733 0.896 ! S95 assign (resid 95 and name HN )(resid 95 and name HA ) 2.925 0.528 0.644 assign (resid 95 and name HB1 )(resid 95 and name HN ) 2.953 0.419 0.488 assign (resid 95 and name HB2 )(resid 95 and name HN ) 2.709 0.384 0.448 assign (resid 95 and name HG )(resid 95 and name HN ) 4.007 0.569 0.662 assign (resid 94 and name HN )(resid 95 and name HN ) 4.195 0.595 0.694 assign (resid 95 and name HN )(resid 94 and name HN ) 3.784 0.536 0.626 assign (resid 94 and name HA )(resid 95 and name HN ) 2.146 0.304 0.355 assign (resid 95 and name HN )(resid 94 and name HA ) 2.126 0.384 0.468 assign (resid 94 and name HB1 )(resid 95 and name HN ) 3.956 0.561 0.654 assign (resid 94 and name HB2 )(resid 95 and name HN ) 3.334 0.473 0.551 assign (resid 94 and name HD# )(resid 95 and name HN ) 3.416 0.484 0.565 assign (resid 95 and name HN )(resid 94 and name HD# ) 3.547 0.586 0.717 assign (resid 81 and name HA )(resid 95 and name HA ) 2.381 0.430 0.524 assign (resid 95 and name HA )(resid 81 and name HA ) 2.533 0.457 0.558 assign (resid 81 and name HG2# )(resid 95 and name HA ) 2.901 0.523 0.638 assign (resid 95 and name HA )(resid 81 and name HG2# ) 2.901 0.523 0.638 assign (resid 95 and name HB1 )(resid 81 and name HG2# ) 3.162 0.570 0.696 assign ((resid 81 and name HG2# ) or (resid 50 and (name HB or name HG1)))(resid 95 and name HN ) 3.406 0.482 0.563 assign ((resid 81 and name HG2# ) or (resid 79 and name HD* ))(resid 95 and name HB1 ) 2.846 0.513 0.626 assign ((resid 81 and name HG2# ) or (resid 79 and name HD* ))(resid 95 and name HB2 ) 3.415 0.616 0.751 assign (resid 95 and name HG )(resid 79 and name HG2# ) 3.980 0.718 0.876 assign (resid 51 and name HB# )(resid 95 and name HN ) 4.615 0.654 0.763 assign (resid 51 and name HG1 )(resid 95 and name HN ) 4.195 0.595 0.694 assign (resid 51 and name HG2 )(resid 95 and name HN ) 3.776 0.536 0.625 assign (resid 51 and name HG1 )(resid 95 and name HB1 ) 4.020 0.725 0.885 assign (resid 51 and name HG2 )(resid 95 and name HB1 ) 3.481 0.627 0.766 assign (resid 51 and name HG1 )(resid 95 and name HB2 ) 3.655 0.658 0.804 assign (resid 51 and name HG2 )(resid 95 and name HB2 ) 3.481 0.627 0.766 assign (resid 95 and name HG )(resid 51 and name HE ) 3.834 0.544 0.634 assign (resid 50 and name HN )(resid 95 and name HN ) 3.643 0.517 0.602 assign ((resid 51 or resid 95) and name HN )(resid 50 and name HN ) 3.278 0.465 0.542 assign ((resid 49 and name HD2#) or (resid 50 and (name HG2# or name HD*)))(resid 95 and name HN) 3.747 0.530 0.619 assign ((resid 49 and name HD2#) or (resid 50 and (name HG2# or name HD*)))(resid 95 and name HB1) 3.481 0.627 0.766 assign ((resid 49 and name HD2#) or (resid 50 and (name HG2# or name HD*)))(resid 95 and name HB2) 3.829 0.690 0.843 ! Y94 assign (resid 94 and name HA )(resid 94 and name HN ) 3.208 0.455 0.530 assign (resid 94 and name HN )(resid 94 and name HA ) 2.825 0.510 0.622 assign ((resid 94 or resid 93) and name HB1 )(resid 94 and name HN ) 2.530 0.359 0.418 assign ((resid 94 or resid 93) and name HB2 )(resid 94 and name HN ) 2.679 0.380 0.443 assign (resid 94 and name HD# )(resid 94 and name HN ) 2.861 0.406 0.473 assign (resid 94 and name HN )(resid 94 and name HD# ) 3.116 0.515 0.630 assign (resid 94 and name HD# )(resid 94 and name HA ) 2.675 0.483 0.589 assign ((resid 94 or resid 51) and name HA )(resid 94 and name HD# ) 3.073 0.508 0.621 assign ((resid 94 or resid 51) and name HA )(resid 94 and name HE# ) 3.398 0.562 0.687 assign ((resid 94 and name HB2 ) or (resid 52 and name HB1 ))(resid 94 and name HE# ) 3.310 0.547 0.669 assign (resid 93 and name HN )(resid 94 and name HN ) 4.486 0.636 0.742 assign (resid 94 and name HN )(resid 93 and name HN ) 4.109 0.583 0.679 assign (resid 93 and name HA )(resid 94 and name HN ) 2.088 0.296 0.345 assign (resid 94 and name HN )(resid 93 and name HA ) 2.159 0.389 0.475 assign (resid 93 and name HD# )(resid 94 and name HN ) 3.614 0.512 0.597 assign (resid 94 and name HN )(resid 93 and name HD# ) 4.250 0.703 0.859 assign (resid 93 and name HA )(resid 94 and name HD# ) 3.936 0.651 0.795 assign (resid 92 and name HB# )(resid 94 and name HD# ) 3.003 0.496 0.607 assign ((resid 84 and (name HG2# or name HD*)) or (resid 50 and (name HB or name HG12)))(resid 94 and name HD#) 3.038 0.502 0.614 assign ((resid 84 and (name HG2# or name HD*)) or (resid 50 and (name HB or name HG12)))(resid 94 and name HE#) 2.932 0.485 0.593 assign ((resid 94 and (name HD# or name HE#)) or (resid 83 and name HD1 ))(resid 84 and name HG2# ) 3.692 0.666 0.813 assign ((resid 94 and (name HD# or name HE#)) or (resid 83 and name HD1 ))(resid 84 and name HD* ) 3.407 0.615 0.750 assign (resid 83 and name HA )(resid 94 and name HN ) 3.660 0.519 0.605 assign (resid 94 and name HN )(resid 83 and name HA ) 3.483 0.628 0.767 assign (resid 94 and name HB1 )(resid 82 and name HN ) 3.609 0.512 0.597 assign (resid 94 and name HB2 )(resid 82 and name HN ) 4.113 0.583 0.680 assign (resid 81 and name HG1# )(resid 94 and name HN ) 2.881 0.409 0.476 assign (resid 94 and name HN )(resid 81 and name HG1# ) 3.210 0.579 0.707 assign (resid 94 and (name HE# or name HD# ))(resid 52 and name HG# ) 2.503 0.452 0.551 assign (resid 52 and name HG# )(resid 94 and name HD# ) 2.969 0.491 0.600 assign (resid 52 and name HG# )(resid 94 and name HE# ) 2.642 0.437 0.534 assign (resid 52 and name HD2 )(resid 94 and name HD# ) 3.254 0.538 0.658 assign (resid 52 and name HD1 )(resid 94 and name HD# ) 3.715 0.614 0.751 assign (resid 52 and name HD2 )(resid 94 and name HE# ) 3.250 0.537 0.657 assign (resid 52 and name HD1 )(resid 94 and name HE# ) 4.165 0.689 0.842 assign (resid 50 and name HN )(resid 94 and name HA ) 2.750 0.496 0.605 assign (resid 94 and name HA )(resid 50 and name HN ) 2.884 0.409 0.477 assign (resid 50 and name HG2# )(resid 94 and name HA ) 2.969 0.536 0.653 assign (resid 94 and name HA )(resid 50 and name HG2# ) 3.154 0.569 0.694 assign (resid 50 and name HG2# )(resid 94 and name HD# ) 3.282 0.543 0.663 assign (resid 50 and (name HG2# or name HD*))(resid 94 and name HE# ) 2.678 0.443 0.541 assign (resid 50 and (name HB or name HG12 ))(resid 94 and name HN ) 3.771 0.535 0.623 assign (resid 50 and (name HB or name HG12 ))(resid 94 and name HA ) 2.544 0.459 0.560 assign ((resid 94 and (name HD# or name HE#)) or ((resid 92 or resid 102) and name HE#))(resid 49 and name HD1#) 2.912 0.525 0.641 ! F93 assign (resid 93 and name HA )(resid 93 and name HN ) 2.982 0.423 0.493 assign (resid 93 and name HN )(resid 93 and name HA ) 3.113 0.562 0.685 assign ((resid 93 and name HB1 ) or (resid 92 and name HB#))(resid 93 and name HN ) 2.328 0.330 0.385 assign (resid 93 and name HB2 )(resid 93 and name HN ) 2.970 0.421 0.491 assign (resid 93 and name HD# )(resid 93 and name HN ) 3.069 0.435 0.507 assign (resid 93 and name HN )(resid 93 and name HD# ) 3.399 0.562 0.687 assign (resid 93 and name HD# )(resid 93 and name HA ) 3.327 0.600 0.732 assign (resid 93 and name HA )(resid 93 and name HD# ) 3.317 0.548 0.670 assign ((resid 93 and name HB1 ) or (resid 83 and name HB2 ))(resid 93 and name HE# ) 4.093 0.677 0.827 assign (resid 92 and name HN )(resid 93 and name HN ) 4.057 0.575 0.671 assign (resid 93 and name HN )(resid 92 and name HN ) 4.075 0.578 0.674 assign (resid 92 and name HA )(resid 93 and name HN ) 2.053 0.291 0.339 assign (resid 93 and name HN )(resid 92 and name HA ) 2.006 0.362 0.442 assign (resid 93 and name HN )(resid 92 and name HD# ) 3.783 0.625 0.765 assign ((resid 93 and name HZ ) or (resid 93 and name HE# ))(resid 91 and name HB1 ) 2.871 0.518 0.632 assign ((resid 93 and name HZ ) or (resid 93 and name HE# ))(resid 91 and name HB2 ) 2.849 0.514 0.627 assign ((resid 48 or resid 92) and name HA )(resid 93 and name HD# ) 3.703 0.612 0.748 assign (resid 91 and name HB1 )(resid 93 and name HE# ) 3.837 0.634 0.775 assign (resid 91 and name HB1 )(resid 93 and name HZ ) 4.103 0.678 0.829 assign (resid 91 and name HB2 )(resid 93 and name HE# ) 3.738 0.618 0.755 assign (resid 91 and name HB2 )(resid 93 and name HZ ) 3.708 0.613 0.749 assign (resid 83 and name HA )(resid 93 and name HA ) 2.693 0.486 0.593 assign (resid 93 and name HA )(resid 83 and name HA ) 2.622 0.473 0.577 assign (resid 83 and name HA )(resid 93 and name HD# ) 3.723 0.615 0.752 assign (resid 83 and name HB1 )(resid 93 and name HD# ) 4.166 0.689 0.842 assign (resid 83 and name HB1 )(resid 93 and name HE# ) 4.375 0.723 0.884 assign (resid 83 and name HD1 )(resid 93 and name HD# ) 3.722 0.615 0.752 assign (resid 93 and name HA )(resid 83 and name HD1 ) 4.100 0.678 0.829 assign (resid 93 and name HD# )(resid 83 and name HD1 ) 4.044 0.668 0.817 assign ((resid 83 and name HE1) or (resid 81 and name HG1#) or (resid 48 and name HG*))(resid 93 and name HD#) 2.756 0.456 0.557 assign ((resid 83 and name HE1) or (resid 81 and name HG1#) or (resid 48 and name HG*))(resid 93 and name HE#) 3.405 0.563 0.688 assign ((resid 83 and name HE1) or (resid 81 and name HG1#) or (resid 48 and name HG*))(resid 93 and name HZ ) 3.906 0.646 0.789 assign (resid 93 and (name HZ or name HE# ))(resid 83 and name HD1 ) 3.815 0.631 0.771 assign (resid 93 and (name HZ or name HE# ))(resid 83 and name HE1 ) 4.187 0.594 0.692 assign (resid 83 and name HD1 )(resid 93 and name HZ ) 3.955 0.654 0.799 assign (resid 93 and (name HZ or name HE# ))(resid 83 and name HE3 ) 4.620 0.764 0.934 assign (resid 93 and (name HZ or name HE# ))(resid 83 and name HZ2 ) 4.553 0.753 0.920 assign (resid 83 and name HZ2 )(resid 93 and name HZ ) 4.557 0.753 0.921 assign (resid 81 and name HG1# )(resid 93 and name HA ) 2.693 0.498 0.607 assign (resid 93 and name HA )(resid 81 and name HG1# ) 3.115 0.562 0.686 assign (resid 93 and name HB1 )(resid 81 and name HG1# ) 3.406 0.614 0.750 assign (resid 93 and name HB2 )(resid 81 and name HG1# ) 3.078 0.555 0.678 assign (resid 50 and name HD* )(resid 93 and name HN ) 3.015 0.427 0.498 assign (resid 93 and name HN )(resid 50 and name HD* ) 3.217 0.580 0.708 assign ((resid 50 and (name HG2# or name HD*)) or (resid 44 and name HG1#))(resid 93 and name HD# ) 3.708 0.613 0.749 assign (resid 49 and name HA )(resid 93 and name HN ) 4.032 0.572 0.666 assign (resid 93 and name HN )(resid 49 and name HA ) 4.518 0.815 0.994 assign (resid 48 and name HB )(resid 93 and name HD# ) 3.962 0.655 0.801 ! Y92 assign (resid 92 and name HA )(resid 92 and name HN ) 2.920 0.414 0.483 assign (resid 92 and name HN )(resid 92 and name HA ) 2.799 0.505 0.616 assign (resid 92 and name HB# )(resid 92 and name HN ) 2.596 0.368 0.429 assign (resid 92 and name HD# )(resid 92 and name HN ) 2.547 0.361 0.421 assign (resid 92 and name HN )(resid 92 and name HD# ) 3.019 0.499 0.610 assign ((resid 92 and name HE# ) or (resid 83 and name HD1 ))(resid 92 and name HN ) 2.759 0.391 0.456 assign (resid 92 and name HD# )(resid 92 and name HA ) 2.916 0.526 0.642 assign (resid 92 and name HA )(resid 92 and name HD# ) 3.133 0.518 0.633 assign (resid 91 and name HN )(resid 92 and name HN ) 4.480 0.635 0.741 assign (resid 91 and name HA )(resid 92 and name HN ) 2.106 0.299 0.348 assign (resid 92 and name HN )(resid 91 and name HA ) 2.172 0.392 0.478 assign (resid 91 and name HB1 )(resid 92 and name HN ) 3.679 0.522 0.608 assign (resid 91 and name HB2 )(resid 92 and name HN ) 3.445 0.488 0.569 assign ((resid 92 and name HE# ) or (resid 83 and name HD1 ))(resid 91 and name HN ) 3.913 0.555 0.647 assign (resid 91 and name HN )(resid 92 and name HD# ) 4.539 0.750 0.917 assign (resid 91 and name HN )(resid 92 and name HE# ) 3.989 0.659 0.806 assign (resid 91 and name HA )(resid 92 and name HD# ) 3.614 0.597 0.730 assign (resid 91 and name HA )(resid 92 and name HE# ) 4.421 0.731 0.894 assign (resid 90 and name HA# )(resid 92 and name HN ) 4.481 0.635 0.741 assign (resid 92 and name HD# )(resid 90 and name HN ) 4.697 0.666 0.776 assign (resid 90 and name HN )(resid 92 and name HD# ) 4.644 0.768 0.937 assign ((resid 92 and name HE# ) or (resid 83 and name HD1 ))(resid 90 and name HN ) 3.815 0.541 0.631 assign (resid 90 and name HN )(resid 92 and name HE# ) 4.136 0.684 0.836 assign ((resid 86 and name HA1 ) or (resid 90 and name HA# ))(resid 92 and name HD# ) 3.887 0.642 0.786 assign ((resid 92 and name HE# ) or (resid 83 and name HD1 ))(resid 90 and name HA1 ) 3.370 0.607 0.742 assign ((resid 92 and name HE# ) or (resid 83 and name HD1 ))(resid 90 and name HA2 ) 3.373 0.609 0.743 assign ((resid 86 and name HA1 ) or (resid 90 and name HA# ))(resid 92 and name HE# ) 2.995 0.495 0.605 assign ((resid 92 and name HE#) or (resid 83 and name HD1) or (resid 137 and name HE22))(resid 87 and name HN) 3.757 0.533 0.621 assign (resid 86 and name HN )(resid 92 and name HN ) 4.665 0.662 0.771 assign (resid 92 and name HD# )(resid 86 and name HN ) 3.136 0.445 0.518 assign (resid 86 and name HN )(resid 92 and name HD# ) 3.419 0.565 0.691 assign ((resid 92 and name HE# ) or (resid 83 and name HD1 ))(resid 86 and name HN ) 2.952 0.419 0.488 assign (resid 86 and name HN )(resid 92 and name HE# ) 3.262 0.539 0.659 assign (resid 86 and name HA2 )(resid 92 and name HD# ) 3.863 0.639 0.781 assign (resid 86 and name HA2 )(resid 92 and name HE# ) 3.033 0.501 0.613 assign (resid 85 and name HA )(resid 92 and name HN ) 3.307 0.469 0.547 assign (resid 85 and name HA )(resid 92 and name HD# ) 3.606 0.596 0.729 assign (resid 85 and name HA )(resid 92 and name HE# ) 4.071 0.673 0.823 assign (resid 84 and name HN )(resid 92 and name HN ) 3.596 0.510 0.594 assign (resid 84 and name HN )(resid 92 and name HD# ) 4.893 0.809 0.989 assign ((resid 85 and (name HD1 or name HB#)) or (resid 84 and name HB ))(resid 92 and name HN ) 3.559 0.505 0.588 assign ((resid 85 and (name HD1 or name HB#)) or (resid 84 and name HB ))(resid 92 and name HD#) 3.780 0.625 0.764 assign (resid 92 and name HB# )(resid 84 and name HG2# ) 3.543 0.639 0.780 assign (resid 83 and name HA )(resid 92 and name HN ) 4.240 0.601 0.701 assign (resid 92 and name HN )(resid 83 and name HD1 ) 3.346 0.553 0.676 assign (resid 83 and name HE1 )(resid 92 and name HN ) 3.793 0.538 0.627 assign (resid 92 and name HN )(resid 83 and name HE1 ) 4.225 0.599 0.698 assign ((resid 83 and name HB2 ) or (resid 92 and name HB# ))(resid 84 and name HN ) 3.088 0.438 0.510 assign (resid 92 and name HA )(resid 50 and name HD* ) 3.304 0.596 0.727 assign (resid 92 and name HD# )(resid 50 and name HD* ) 3.108 0.561 0.684 assign (resid 50 and (name HD* or name HG12 or name HB))(resid 92 and name HD# ) 2.836 0.469 0.573 assign ((resid 92 or resid 94) and name HE# )(resid 50 and name HD* ) 3.310 0.597 0.728 assign ((resid 92 or resid 94) and name HE# )(resid 50 and name HG2# ) 3.102 0.560 0.682 ! D91 assign (resid 91 and name HA )(resid 91 and name HN ) 3.091 0.438 0.511 assign (resid 91 and name HN )(resid 91 and name HA ) 3.039 0.431 0.502 assign (resid 91 and name HB1 )(resid 91 and name HN ) 2.553 0.362 0.422 assign (resid 91 and name HB2 )(resid 91 and name HN ) 2.922 0.414 0.483 assign (resid 90 and name HN )(resid 91 and name HN ) 3.596 0.510 0.594 assign (resid 91 and name HN )(resid 90 and name HN ) 3.788 0.466 0.544 assign (resid 90 and name HA# )(resid 91 and name HN ) 2.197 0.312 0.363 assign (resid 91 and name HN )(resid 90 and name HA1 ) 2.718 0.490 0.598 assign (resid 91 and name HN )(resid 90 and name HA2 ) 2.672 0.482 0.588 assign (resid 91 and name HA )(resid 86 and name HN ) 3.637 0.516 0.601 assign (resid 85 and name HA )(resid 91 and name HA ) 2.533 0.457 0.558 assign (resid 91 and name HA )(resid 85 and name HA ) 2.622 0.473 0.577 assign (resid 91 and name HA )(resid 83 and name HD1 ) 3.775 0.624 0.763 assign (resid 91 and name HB1 )(resid 83 and name HD1 ) 4.431 0.732 0.895 assign (resid 91 and name HB2 )(resid 83 and name HD1 ) 3.893 0.643 0.787 assign (resid 91 and name HA )(resid 83 and name HE1 ) 3.151 0.447 0.521 assign (resid 91 and name HA )(resid 83 and name HZ2 ) 5.395 0.892 1.090 assign (resid 83 and name HE1 )(resid 91 and name HA ) 2.914 0.526 0.641 assign (resid 91 and name HB1 )(resid 83 and name HE1 ) 3.257 0.462 0.538 assign (resid 91 and name HB2 )(resid 83 and name HE1 ) 3.024 0.429 0.500 ! G90 assign (resid 90 and name HA# )(resid 90 and name HN ) 2.351 0.333 0.389 assign (resid 90 and name HN )(resid 90 and name HA1 ) 2.859 0.516 0.629 assign (resid 90 and name HN )(resid 90 and name HA2 ) 2.813 0.507 0.619 assign (resid 89 and name HN )(resid 90 and name HN ) 2.845 0.403 0.470 assign (resid 90 and name HN )(resid 89 and name HN ) 2.841 0.403 0.470 assign (resid 89 and name HA1 )(resid 90 and name HN ) 3.564 0.505 0.589 assign (resid 90 and name HN )(resid 89 and name HA1 ) 3.361 0.606 0.740 assign (resid 89 and name HA2 )(resid 90 and name HN ) 3.255 0.462 0.538 assign ((resid 88 or resid 86) and name HN )(resid 90 and name HN ) 3.352 0.475 0.554 assign (resid 90 and name HN )(resid 88 and name HN ) 3.588 0.509 0.593 assign (resid 88 and name HA )(resid 90 and name HN ) 4.885 0.693 0.807 assign (resid 88 and (name HB1 or name HG1 ))(resid 90 and name HN ) 4.616 0.655 0.763 assign ((resid 87 or resid 85) and (name HB# or name HD1))(resid 90 and name HN ) 4.522 0.641 0.747 assign ((resid 90 or resid 86) and name HA2 )(resid 87 and name HB# ) 3.709 0.669 0.816 assign (resid 86 and name HN )(resid 90 and name HN ) 4.038 0.572 0.667 assign ((resid 86 and name HA1 ) or (resid 90 and name HA# ))(resid 86 and name HN ) 2.609 0.370 0.431 ! G89 assign (resid 89 and name HA1 )(resid 89 and name HN ) 2.517 0.357 0.416 assign (resid 89 and name HN )(resid 89 and name HA1 ) 2.606 0.470 0.574 assign (resid 89 and name HA2 )(resid 89 and name HN ) 2.341 0.332 0.387 assign (resid 89 and name HN )(resid 89 and name HA2 ) 2.532 0.457 0.557 assign (resid 88 and name HN )(resid 89 and name HN ) 2.846 0.404 0.470 assign (resid 89 and name HN )(resid 88 and name HN ) 2.839 0.403 0.469 assign (resid 88 and name HA )(resid 89 and name HN ) 3.157 0.448 0.522 assign (resid 89 and name HN )(resid 88 and name HA ) 3.201 0.577 0.704 assign (resid 88 and (name HB1 or name HG1 ))(resid 89 and name HN ) 3.976 0.564 0.657 assign (resid 88 and name HB2 )(resid 89 and name HN ) 4.061 0.576 0.671 assign (resid 88 and name HG2 )(resid 89 and name HN ) 4.774 0.677 0.789 assign (resid 87 and name HN )(resid 89 and name HN ) 4.683 0.664 0.774 assign (resid 89 and name HN )(resid 87 and name HN ) 4.143 0.588 0.685 assign (resid 87 and name HA )(resid 89 and name HN ) 3.739 0.530 0.618 assign ((resid 87 or resid 85) and (name HB# or name HD1))(resid 89 and name HN ) 3.719 0.527 0.615 assign ((resid 87 or resid 85) and (name HB# or name HD1))(resid 89 and name HA1 ) 3.140 0.566 0.691 assign ((resid 87 or resid 85) and (name HB# or name HD1))(resid 89 and name HA2 ) 3.303 0.596 0.727 assign (resid 85 and name HE1 )(resid 89 and name HA2 ) 3.827 0.690 0.842 assign (resid 85 and name HE2 )(resid 89 and name HA2 ) 3.856 0.696 0.849 ! Q88 assign (resid 88 and name HA )(resid 88 and name HN ) 3.084 0.437 0.510 assign (resid 88 and name HN )(resid 88 and name HA ) 3.160 0.570 0.696 assign (resid 88 and (name HB1 or name HG1 ))(resid 88 and name HN ) 2.757 0.391 0.456 assign (resid 88 and name HB2 )(resid 88 and name HN ) 2.843 0.403 0.470 assign (resid 88 and name HG2 )(resid 88 and name HN ) 3.226 0.457 0.533 assign (resid 88 and (name HB1 or name HG1 ))(resid 88 and name HE21 ) 2.962 0.420 0.489 assign (resid 88 and name HB2 )(resid 88 and name HE21 ) 4.131 0.586 0.683 assign (resid 88 and name HG2 )(resid 88 and name HE21 ) 3.296 0.467 0.545 assign (resid 88 and (name HB1 or name HG1 ))(resid 88 and name HE22 ) 3.316 0.470 0.548 assign (resid 88 and name HB2 )(resid 88 and name HE22 ) 4.566 0.647 0.755 assign (resid 88 and name HG2 )(resid 88 and name HE22 ) 3.706 0.526 0.613 assign (resid 87 and name HN )(resid 88 and name HN ) 3.294 0.467 0.544 assign ((resid 88 or resid 86) and name HN )(resid 87 and name HN ) 3.075 0.436 0.508 assign (resid 87 and name HA )(resid 88 and name HN ) 3.419 0.485 0.565 assign (resid 88 and name HN )(resid 87 and name HA ) 3.315 0.598 0.730 assign (resid 87 and name HB# )(resid 88 and name HN ) 2.947 0.418 0.487 assign (resid 88 and name HN )(resid 87 and name HB# ) 3.869 0.698 0.851 assign (resid 88 and name HA )(resid 87 and name HB# ) 3.705 0.668 0.815 assign (resid 88 and name HG1 )(resid 87 and name HB# ) 3.579 0.646 0.788 assign (resid 88 and name HG2 )(resid 87 and name HB# ) 3.576 0.645 0.787 assign (resid 87 and name HB# )(resid 88 and name HE21 ) 4.135 0.586 0.683 assign (resid 88 and name HE21 )(resid 87 and name HB# ) 3.888 0.701 0.856 assign (resid 87 and name HB# )(resid 88 and name HE22 ) 4.756 0.674 0.786 assign (resid 88 and name HE22 )(resid 87 and name HB# ) 4.157 0.750 0.915 assign (resid 86 and name HA1 )(resid 88 and name HN ) 3.744 0.531 0.619 assign (resid 86 and name HA2 )(resid 88 and name HN ) 3.494 0.495 0.578 ! A87 assign (resid 87 and name HA )(resid 87 and name HN ) 2.492 0.353 0.412 assign (resid 87 and name HN )(resid 87 and name HA ) 2.845 0.513 0.626 assign (resid 87 and name HB# )(resid 87 and name HN ) 2.092 0.297 0.346 assign (resid 87 and name HN )(resid 86 and name HN ) 3.825 0.542 0.632 assign (resid 86 and name HA1 )(resid 87 and name HN ) 2.384 0.338 0.394 assign (resid 87 and name HN )(resid 86 and name HA1 ) 2.509 0.453 0.552 assign (resid 86 and name HA2 )(resid 87 and name HN ) 2.547 0.361 0.421 assign (resid 87 and name HN )(resid 86 and name HA2 ) 2.731 0.493 0.601 ! G86 assign (resid 86 and name HN )(resid 86 and name HA1 ) 2.483 0.448 0.547 assign (resid 86 and name HA2 )(resid 86 and name HN ) 2.463 0.349 0.407 assign (resid 86 and name HN )(resid 86 and name HA2 ) 2.444 0.441 0.538 assign (resid 85 and name HN )(resid 86 and name HN ) 4.444 0.630 0.735 assign (resid 86 and name HN )(resid 85 and name HN ) 5.044 0.715 0.834 assign (resid 85 and name HA )(resid 86 and name HN ) 2.075 0.294 0.343 assign (resid 86 and name HN )(resid 85 and name HA ) 2.183 0.394 0.480 assign (resid 85 and (name HB# or name HD1 ))(resid 86 and name HN ) 2.691 0.382 0.445 assign (resid 85 and name HD1 )(resid 86 and name HN ) 4.122 0.585 0.681 assign (resid 84 and (name HG2# or name HD* ))(resid 86 and name HN ) 4.322 0.613 0.714 ! K85 assign (resid 85 and name HA )(resid 85 and name HN ) 3.151 0.447 0.521 assign (resid 85 and name HN )(resid 85 and name HA ) 3.097 0.559 0.682 assign (resid 85 and (name HB# or name HD1 ))(resid 85 and name HN ) 2.355 0.334 0.389 assign ((resid 85 and name HG1 ) or (resid 84 and name HG11 ))(resid 85 and name HN ) 3.198 0.454 0.529 assign (resid 85 and name HG2 )(resid 85 and name HN ) 3.887 0.551 0.643 assign (resid 85 and name HD2 )(resid 85 and name HN ) 3.835 0.544 0.634 assign (resid 84 and name HN )(resid 85 and name HN ) 4.320 0.613 0.714 assign (resid 84 and name HA )(resid 85 and name HN ) 2.110 0.299 0.349 assign (resid 85 and name HN )(resid 84 and name HA ) 2.198 0.397 0.484 assign (resid 84 and name HG12 )(resid 85 and name HN ) 4.755 0.674 0.786 assign (resid 84 and name HG2# )(resid 85 and name HN ) 2.591 0.367 0.428 assign (resid 84 and (name HG2# or name HD* ))(resid 85 and name HA ) 3.231 0.582 0.711 assign ((resid 85 and (name HB# or name HD1 )) or (resid 84 and name HB ))(resid 83 and name HD1 ) 4.501 0.744 0.910 assign (resid 85 and name HD2 )(resid 83 and name HD1 ) 5.199 0.859 1.051 assign ((resid 85 and (name HB# or name HD1 )) or (resid 84 and name HB ))(resid 83 and name HE1 ) 3.592 0.509 0.594 assign ((resid 85 and name HG1 ) or (resid 84 and name HG11 ))(resid 83 and name HE1 ) 4.075 0.578 0.674 assign (resid 85 and name HG2 )(resid 83 and name HE1 ) 4.646 0.659 0.768 assign (resid 85 and name HD2 )(resid 83 and name HE1 ) 4.386 0.622 0.725 assign ((resid 85 and name HE1 ) or (resid 83 and name HB2 ))(resid 83 and name HE1 ) 4.320 0.613 0.714 assign (resid 85 and name HE2 )(resid 83 and name HE1 ) 4.158 0.590 0.687 assign (resid 85 and name HG1 )(resid 83 and name HZ2 ) 5.527 0.914 1.117 assign ((resid 85 and (name HB# or name HD1 )) or (resid 37 and name HG# ))(resid 83 and name HZ2 ) 4.791 0.792 0.968 assign (resid 85 and name HD2 )(resid 83 and name HZ2 ) 5.155 0.852 1.042 assign (resid 85 and name HE1 )(resid 83 and name HZ2 ) 4.831 0.799 0.976 assign (resid 85 and name HE2 )(resid 83 and name HZ2 ) 3.957 0.654 0.800 assign (resid 85 and name HZ# )(resid 83 and name HZ2 ) 2.458 0.406 0.497 assign ((resid 85 and (name HB# or name HD1 )) or (resid 37 and name HG# ))(resid 83 and name HH2 ) 4.979 0.823 1.006 assign (resid 85 and name HD2 )(resid 83 and name HH2 ) 5.007 0.828 1.012 assign (resid 85 and name HE2 )(resid 83 and name HH2 ) 4.936 0.816 0.998 ! I84 assign (resid 84 and name HA )(resid 84 and name HN ) 2.838 0.402 0.469 assign (resid 84 and name HN )(resid 84 and name HA ) 3.012 0.543 0.663 assign (resid 84 and name HB )(resid 84 and name HN ) 2.642 0.375 0.437 assign (resid 84 and name HG11 )(resid 84 and name HN ) 3.212 0.456 0.531 assign (resid 84 and name HG12 )(resid 84 and name HN ) 3.244 0.460 0.536 assign (resid 84 and (name HG2# or name HD* ))(resid 84 and name HN ) 3.093 0.439 0.511 assign (resid 84 and name HN )(resid 84 and name HG2# ) 3.503 0.632 0.771 assign (resid 84 and name HN )(resid 84 and name HD* ) 3.864 0.697 0.850 assign (resid 84 and name HB )(resid 84 and name HA ) 3.059 0.552 0.673 assign (resid 84 and name HG11 )(resid 84 and name HA ) 2.958 0.534 0.651 assign (resid 84 and name HG12 )(resid 84 and name HA ) 3.198 0.577 0.704 assign (resid 84 and (name HG2# or name HD* ))(resid 84 and name HA ) 2.412 0.435 0.531 assign (resid 84 and name HA )(resid 84 and name HG2# ) 2.709 0.489 0.596 assign (resid 84 and name HA )(resid 84 and name HD* ) 3.804 0.686 0.837 assign (resid 83 and name HA )(resid 84 and name HN ) 2.016 0.286 0.333 assign (resid 84 and name HN )(resid 83 and name HA ) 2.117 0.382 0.466 assign (resid 83 and name HD1 )(resid 84 and name HN ) 2.387 0.338 0.395 assign (resid 84 and name HN )(resid 83 and name HD1 ) 2.937 0.486 0.594 assign (resid 84 and name HA )(resid 83 and name HD1 ) 4.470 0.739 0.903 assign (resid 84 and (name HG2# or name HD* ))(resid 83 and name HD1 ) 4.768 0.788 0.964 assign (resid 84 and name HN )(resid 83 and name HE1 ) 4.640 0.658 0.767 ! W83 assign (resid 83 and name HA )(resid 83 and name HN ) 3.026 0.429 0.500 assign (resid 83 and name HN )(resid 83 and name HA ) 3.247 0.586 0.715 assign (resid 83 and name HB1 )(resid 83 and name HN ) 2.450 0.347 0.405 assign (resid 83 and name HB2 )(resid 83 and name HN ) 2.605 0.369 0.431 assign (resid 83 and name HE3 )(resid 83 and name HN ) 4.139 0.587 0.684 assign (resid 83 and name HN )(resid 83 and name HE3 ) 4.142 0.685 0.837 assign (resid 83 and name HA )(resid 83 and name HE3 ) 4.733 0.782 0.956 assign (resid 83 and name HD1 )(resid 83 and name HA ) 2.792 0.504 0.614 assign (resid 83 and name HA )(resid 83 and name HD1 ) 2.970 0.491 0.600 assign (resid 83 and name HA )(resid 83 and name HE1 ) 4.437 0.629 0.734 assign (resid 83 and name HE3 )(resid 83 and name HB1 ) 2.515 0.454 0.553 assign ((resid 83 and name HB1 ) or (resid 37 and name HD# ))(resid 83 and name HE3 ) 3.258 0.539 0.659 assign (resid 83 and name HB2 )(resid 83 and name HE3 ) 3.417 0.565 0.691 assign (resid 83 and name HB1 )(resid 83 and name HD1 ) 4.229 0.699 0.855 assign (resid 83 and name HB2 )(resid 83 and name HD1 ) 3.950 0.653 0.798 assign (resid 83 and name HB2 )(resid 83 and name HZ3 ) 5.106 0.844 1.032 assign (resid 83 and name HN )(resid 82 and name HN ) 4.159 0.590 0.688 assign (resid 82 and name HA )(resid 83 and name HN ) 2.094 0.297 0.346 assign (resid 83 and name HN )(resid 82 and name HA ) 2.162 0.390 0.476 assign (resid 82 and (name HB1 or name HG ))(resid 83 and name HN ) 3.871 0.549 0.640 assign (resid 82 and name HB2 )(resid 83 and name HN ) 3.340 0.474 0.552 assign (resid 83 and name HN )(resid 82 and name HD2# ) 3.484 0.628 0.767 assign (resid 83 and name HE3 )(resid 39 and name HB# ) 4.124 0.744 0.908 assign (resid 38 and name HG2# )(resid 83 and name HZ3 ) 4.788 0.791 0.968 assign ((resid 38 and name HB ) or (resid 37 and name HB1 ))(resid 83 and name HH2 ) 5.031 0.832 1.017 ! L82 assign (resid 82 and name HA )(resid 82 and name HN ) 2.985 0.423 0.493 assign (resid 82 and name HN )(resid 82 and name HA ) 3.024 0.546 0.666 assign (resid 82 and (name HB1 or name HG ))(resid 82 and name HN ) 2.443 0.346 0.404 assign (resid 82 and name HB2 )(resid 82 and name HN ) 3.332 0.472 0.551 assign (resid 82 and name HD1# )(resid 82 and name HN ) 3.126 0.443 0.517 assign (resid 82 and name HN )(resid 82 and name HD1# ) 3.450 0.622 0.759 assign (resid 82 and name HN )(resid 82 and name HD2# ) 4.299 0.776 0.927 assign (resid 82 and name HA )(resid 82 and name HD1# ) 3.425 0.618 0.754 assign (resid 82 and name HA )(resid 82 and name HD2# ) 2.807 0.506 0.617 assign (resid 81 and name HN )(resid 82 and name HN ) 3.972 0.563 0.657 assign (resid 81 and name HA )(resid 82 and name HN ) 2.287 0.413 0.503 assign (resid 81 and name HG1# )(resid 82 and name HN ) 2.627 0.372 0.434 assign (resid 82 and name HN )(resid 81 and name HG1# ) 3.053 0.551 0.672 assign (resid 81 and name HG2# )(resid 82 and name HN ) 3.142 0.446 0.519 assign (resid 82 and name HN )(resid 81 and name HG2# ) 3.260 0.588 0.717 ! V81 assign (resid 81 and name HN )(resid 81 and name HA ) 3.150 0.568 0.693 assign (resid 81 and name HB )(resid 81 and name HN ) 2.444 0.347 0.404 assign (resid 81 and name HG1# )(resid 81 and name HN ) 3.634 0.515 0.600 assign (resid 81 and name HG2# )(resid 81 and name HN ) 3.010 0.427 0.498 assign (resid 81 and name HN )(resid 81 and name HG2# ) 3.146 0.567 0.692 assign (resid 80 and name HN )(resid 81 and name HN ) 3.878 0.550 0.641 assign (resid 80 and name HA )(resid 81 and name HN ) 2.025 0.287 0.335 assign (resid 81 and name HN )(resid 80 and name HA ) 2.106 0.380 0.466 assign (resid 80 and name HB1 )(resid 81 and name HN ) 3.730 0.529 0.617 assign (resid 80 and name HB2 )(resid 81 and name HN ) 3.317 0.470 0.548 ! D80 assign (resid 80 and name HA )(resid 80 and name HN ) 2.866 0.406 0.474 assign (resid 80 and name HN )(resid 80 and name HA ) 2.962 0.534 0.652 assign (resid 80 and name HB1 )(resid 80 and name HN ) 2.501 0.353 0.413 assign (resid 80 and name HB2 )(resid 80 and name HN ) 2.836 0.402 0.469 assign (resid 79 and name HN )(resid 80 and name HN ) 4.188 0.594 0.692 assign (resid 79 and name HA )(resid 80 and name HN ) 2.225 0.315 0.368 assign (resid 80 and name HN )(resid 79 and name HA ) 2.270 0.410 0.500 assign (resid 79 and name HB )(resid 80 and name HN ) 2.535 0.359 0.419 assign (resid 79 and name HG11 )(resid 80 and name HN ) 4.705 0.667 0.778 assign (resid 79 and (name HG12 or name HG2# ))(resid 80 and name HN ) 3.025 0.429 0.500 assign (resid 79 and name HD* )(resid 80 and name HN ) 3.459 0.490 0.572 assign (resid 80 and name HN )(resid 79 and name HG2# ) 2.855 0.515 0.628 ! I79 assign (resid 79 and name HN )(resid 79 and name HA ) 3.135 0.565 0.690 assign (resid 79 and name HB )(resid 79 and name HN ) 3.463 0.491 0.572 assign (resid 79 and name HG11 )(resid 79 and name HN ) 2.690 0.381 0.445 assign (resid 79 and name HN )(resid 79 and name HG2# ) 2.743 0.494 0.604 assign (resid 79 and name HD* )(resid 79 and name HN ) 3.039 0.431 0.502 assign (resid 79 and name HN )(resid 79 and name HD* ) 3.335 0.602 0.734 assign (resid 79 and name HG2# )(resid 79 and name HA ) 2.383 0.430 0.524 assign (resid 79 and name HA )(resid 79 and name HG2# ) 2.478 0.447 0.546 assign ((resid 79 or resid 78) and name HA )(resid 79 and name HD* ) 3.397 0.613 0.748 assign (resid 78 and name HA )(resid 79 and name HN ) 2.068 0.293 0.342 assign (resid 78 and name HB1 )(resid 79 and name HN ) 2.889 0.410 0.477 assign (resid 78 and name HB2 )(resid 79 and name HN ) 2.955 0.419 0.488 assign (resid 79 and name HD* )(resid 79 and name HA ) 3.481 0.628 0.766 ! P78 assign (resid 78 and name HD1 )(resid 77 and name HA ) 2.435 0.439 0.536 assign (resid 78 and name HD2 )(resid 77 and name HA ) 2.340 0.422 0.515 assign (resid 78 and name HD1 )(resid 77 and name HB1 ) 2.595 0.468 0.571 assign (resid 77 and name HB1 )(resid 78 and name HD1 ) 2.995 0.540 0.659 assign (resid 78 and name HD2 )(resid 77 and name HB1 ) 2.961 0.534 0.652 assign (resid 77 and name HB1 )(resid 78 and name HD2 ) 3.255 0.587 0.716 assign (resid 78 and name HD1 )(resid 77 and name HB2 ) 2.942 0.531 0.648 assign (resid 78 and name HB2 )(resid 41 and name HG1# ) 2.881 0.507 0.619 assign (resid 78 and name HB2 )(resid 41 and name HG2# ) 2.939 0.530 0.647 assign (resid 41 and name HG* )(resid 78 and name HG1 ) 2.778 0.501 0.612 assign (resid 41 and name HG* )(resid 78 and name HG2 ) 2.732 0.493 0.601 ! P77 assign (resid 77 and name HD1 )(resid 76 and name HA ) 2.556 0.461 0.563 assign (resid 77 and name HD2 )(resid 76 and name HA ) 2.403 0.434 0.529 assign (resid 77 and name HD1 )(resid 76 and name HG1# ) 3.226 0.582 0.710 assign (resid 76 and name HG1# )(resid 77 and name HD1 ) 2.459 0.444 0.541 ! V76 assign (resid 76 and name HA )(resid 76 and name HN ) 3.403 0.483 0.563 assign (resid 76 and name HN )(resid 76 and name HA ) 3.106 0.560 0.684 assign (resid 76 and name HB )(resid 76 and name HN ) 2.553 0.362 0.422 assign (resid 76 and name HG1# )(resid 76 and name HN ) 3.525 0.500 0.583 assign (resid 76 and name HN )(resid 76 and name HG1# ) 3.656 0.660 0.805 assign (resid 76 and name HG2# )(resid 76 and name HN ) 2.659 0.377 0.440 assign (resid 76 and name HN )(resid 76 and name HG2# ) 2.791 0.504 0.614 assign (resid 76 and name HG1# )(resid 76 and name HA ) 2.788 0.503 0.614 assign (resid 76 and name HA )(resid 76 and name HG1# ) 3.030 0.547 0.667 assign (resid 76 and name HG2# )(resid 76 and name HA ) 2.672 0.482 0.588 assign (resid 76 and name HA )(resid 76 and name HG2# ) 2.743 0.495 0.604 assign (resid 75 and name HN )(resid 76 and name HN ) 2.814 0.399 0.465 assign (resid 76 and name HN )(resid 75 and name HN ) 2.750 0.390 0.455 assign (resid 75 and name HA )(resid 76 and name HN ) 3.810 0.540 0.630 assign (resid 76 and name HN )(resid 75 and name HA ) 3.471 0.626 0.764 assign (resid 75 and name HB1 )(resid 76 and name HN ) 3.646 0.517 0.603 assign (resid 75 and name HB2 )(resid 76 and name HN ) 4.456 0.631 0.737 assign (resid 74 and name HN )(resid 76 and name HN ) 4.787 0.679 0.791 assign (resid 76 and name HN )(resid 74 and name HN ) 4.856 0.689 0.803 assign (resid 76 and name HN )(resid 74 and name HA ) 3.723 0.672 0.819 assign (resid 73 and name HA )(resid 76 and name HN ) 5.246 0.744 0.867 assign (resid 76 and name HN )(resid 73 and name HA ) 3.718 0.671 0.818 assign (resid 69 and name HD* )(resid 76 and name HG1# ) 3.679 0.664 0.810 assign (resid 76 and name HG1# )(resid 69 and name HD* ) 3.001 0.541 0.660 assign (resid 69 and name HD* )(resid 76 and name HG2# ) 3.396 0.613 0.747 assign (resid 68 and name HG2# )(resid 76 and name HN ) 4.303 0.610 0.711 assign (resid 76 and name HN )(resid 68 and name HG2# ) 3.693 0.666 0.813 assign (resid 76 and name HG1# )(resid 68 and name HN ) 4.872 0.691 0.805 assign ((resid 76 and name HG2#) or (resid 65 and name HD#) or (resid 69 and name HG12))(resid 68 and name HN) 3.537 0.502 0.585 assign (resid 76 and name HG2# )(resid 68 and name HB ) 2.481 0.448 0.546 assign (resid 68 and name HG2# )(resid 76 and name HG2# ) 2.464 0.444 0.542 assign (resid 76 and name HG2# )(resid 68 and name HG2# ) 2.433 0.439 0.536 ! S75 assign (resid 75 and name HA )(resid 75 and name HN ) 2.974 0.422 0.492 assign (resid 75 and name HN )(resid 75 and name HA ) 3.121 0.563 0.687 assign (resid 75 and name HB# )(resid 75 and name HN ) 2.835 0.402 0.469 assign (resid 74 and name HN )(resid 75 and name HN ) 2.874 0.407 0.475 assign (resid 75 and name HN )(resid 74 and name HN ) 2.884 0.409 0.477 assign (resid 74 and name HA )(resid 75 and name HN ) 3.593 0.510 0.594 assign (resid 75 and name HN )(resid 74 and name HA ) 3.585 0.647 0.789 assign (resid 74 and name HB# )(resid 75 and name HN ) 3.461 0.491 0.572 assign (resid 73 and name HA )(resid 75 and name HN ) 4.205 0.596 0.695 assign (resid 75 and name HN )(resid 73 and name HA ) 3.684 0.665 0.811 assign (resid 72 and name HA )(resid 75 and name HN ) 4.815 0.683 0.796 assign (resid 68 and name HG2# )(resid 75 and name HN ) 4.750 0.638 0.744 assign (resid 75 and name HN )(resid 68 and name HG2# ) 4.306 0.777 0.948 assign (resid 68 and name HG2# )(resid 75 and name HB1 ) 2.597 0.468 0.572 assign ((resid 68 and name HA ) or (resid 75 and name HB1 ))(resid 72 and name HN ) 3.781 0.536 0.625 ! D74 assign (resid 74 and name HA )(resid 74 and name HN ) 2.887 0.409 0.477 assign (resid 74 and name HN )(resid 74 and name HA ) 2.951 0.532 0.650 assign ((resid 74 and name HB# ) or (resid 73 and name HB1 ))(resid 74 and name HN ) 2.553 0.362 0.422 assign (resid 73 and name HA )(resid 74 and name HN ) 3.875 0.549 0.641 assign (resid 74 and name HN )(resid 73 and name HA ) 3.543 0.639 0.780 assign (resid 73 and (name HB2 or name HG1 ))(resid 74 and name HN ) 3.422 0.485 0.566 assign (resid 73 and name HG2 )(resid 74 and name HN ) 3.196 0.453 0.528 assign (resid 73 and name HD1 )(resid 74 and name HN ) 3.849 0.546 0.636 assign (resid 73 and name HD2 )(resid 74 and name HN ) 3.489 0.495 0.577 assign (resid 72 and name HN )(resid 74 and name HN ) 5.628 0.798 0.930 assign ((resid 74 or resid 75) and name HN )(resid 72 and name HN ) 5.560 0.789 0.919 assign (resid 72 and name HA )(resid 74 and name HN ) 3.901 0.553 0.645 assign (resid 74 and name HN )(resid 72 and name HA ) 3.228 0.582 0.711 ! P73 assign (resid 73 and name HD1 )(resid 72 and name HN ) 3.455 0.490 0.571 assign (resid 73 and name HD2 )(resid 72 and name HN ) 3.836 0.544 0.634 assign (resid 73 and name HD1 )(resid 72 and name HA ) 2.582 0.466 0.568 assign (resid 73 and name HD2 )(resid 72 and name HA ) 2.297 0.414 0.506 assign (resid 73 and name HG1 )(resid 72 and name HA ) 3.743 0.675 0.824 assign (resid 69 and name HA )(resid 73 and name HA ) 2.514 0.454 0.553 assign (resid 73 and name HA )(resid 69 and name HA ) 2.322 0.419 0.511 assign (resid 73 and name HB1 )(resid 69 and name HA ) 3.093 0.558 0.681 assign (resid 69 and name HG2# )(resid 73 and name HA ) 3.142 0.567 0.692 assign (resid 73 and name HA )(resid 69 and name HG2# ) 3.308 0.597 0.728 assign (resid 73 and name HB1 )(resid 69 and name HG2# ) 3.430 0.619 0.755 assign (resid 73 and name HB2 )(resid 69 and name HG2# ) 3.717 0.671 0.818 ! D72 assign (resid 72 and name HA )(resid 72 and name HN ) 3.215 0.456 0.531 assign (resid 72 and name HN )(resid 72 and name HA ) 2.901 0.523 0.639 assign (resid 72 and name HB1 )(resid 72 and name HN ) 3.331 0.472 0.551 assign (resid 72 and name HB2 )(resid 72 and name HN ) 3.544 0.502 0.586 assign (resid 71 and name HN )(resid 72 and name HN ) 2.533 0.359 0.419 assign (resid 72 and name HN )(resid 71 and name HN ) 2.534 0.359 0.419 assign (resid 71 and name HA )(resid 72 and name HN ) 3.558 0.505 0.588 assign (resid 72 and name HN )(resid 71 and name HA ) 3.373 0.608 0.742 assign (resid 72 and name HA )(resid 71 and name HN ) 4.904 0.695 0.811 assign (resid 72 and name HB1 )(resid 71 and name HN ) 4.458 0.632 0.737 assign (resid 72 and name HB2 )(resid 71 and name HN ) 4.458 0.632 0.737 assign (resid 71 and name HB1 )(resid 72 and name HN ) 3.288 0.466 0.544 assign (resid 71 and name HB2 )(resid 72 and name HN ) 3.120 0.442 0.516 assign (resid 71 and name HG1 )(resid 72 and name HN ) 4.390 0.622 0.726 assign (resid 70 and name HN )(resid 72 and name HN ) 4.542 0.644 0.751 assign (resid 72 and name HN )(resid 70 and name HN ) 4.439 0.629 0.734 assign (resid 72 and name HN )(resid 69 and name HA ) 3.718 0.671 0.818 assign (resid 69 and name HA )(resid 72 and name HN ) 4.458 0.632 0.737 assign (resid 72 and name HN )(resid 68 and name HG2# ) 4.269 0.770 0.940 assign (resid 68 and name HG2# )(resid 72 and name HN ) 4.075 0.578 0.674 assign (resid 72 and name HN )(resid 68 and name HA ) 3.298 0.595 0.726 assign (resid 72 and name HB1 )(resid 68 and name HG2# ) 3.431 0.619 0.755 assign (resid 72 and name HB2 )(resid 68 and name HG2# ) 3.774 0.681 0.831 ! E71 assign (resid 71 and name HA )(resid 71 and name HN ) 2.820 0.400 0.466 assign (resid 71 and name HN )(resid 71 and name HA ) 2.844 0.513 0.626 assign (resid 71 and name HB1 )(resid 71 and name HN ) 3.107 0.441 0.514 assign ((resid 71 and name HB2 ) or (resid 70 and name HB1 ))(resid 71 and name HN ) 2.547 0.361 0.421 assign (resid 71 and name HN )(resid 71 and name HB2 ) 2.787 0.503 0.613 assign (resid 71 and name HG# )(resid 71 and name HN ) 3.401 0.482 0.562 assign (resid 70 and name HN )(resid 71 and name HN ) 3.032 0.430 0.501 assign (resid 71 and name HN )(resid 70 and name HN ) 2.897 0.411 0.479 assign (resid 70 and name HA )(resid 71 and name HN ) 3.749 0.532 0.620 assign (resid 71 and name HN )(resid 70 and name HA ) 3.549 0.640 0.781 assign (resid 71 and name HN )(resid 70 and name HB1 ) 3.314 0.598 0.729 assign (resid 70 and (name HB2 or name HG1 ))(resid 71 and name HN ) 3.200 0.454 0.529 assign (resid 70 and name HG2 )(resid 71 and name HN ) 4.945 0.701 0.817 assign ((resid 70 and name HD# ) or (resid 69 and name HA ))(resid 71 and name HN ) 4.184 0.594 0.692 assign (resid 69 and name HN )(resid 71 and name HN ) 4.791 0.679 0.792 assign (resid 71 and name HN )(resid 69 and name HN ) 4.164 0.591 0.688 assign (resid 68 and name HA )(resid 71 and name HN ) 3.724 0.528 0.616 assign (resid 71 and name HN )(resid 68 and name HA ) 3.132 0.565 0.689 assign (resid 71 and name HB2 )(resid 68 and name HA ) 3.199 0.577 0.704 assign (resid 68 and name HG2# )(resid 71 and name HN ) 4.953 0.702 0.819 ! R70 assign (resid 70 and name HA )(resid 70 and name HN ) 2.796 0.396 0.462 assign (resid 70 and name HN )(resid 70 and name HA ) 2.841 0.512 0.625 assign ((resid 70 and name HB1 ) or (resid 71 and name HB2 ))(resid 70 and name HN ) 2.642 0.375 0.437 assign (resid 70 and (name HB2 or name HG1 ))(resid 70 and name HN ) 2.592 0.367 0.428 assign (resid 70 and name HN )(resid 70 and name HB2 ) 2.818 0.508 0.620 assign (resid 70 and name HN )(resid 70 and name HG1 ) 2.813 0.507 0.619 assign ((resid 70 and name HG2 ) or (resid 69 and name HB ))(resid 70 and name HN ) 2.780 0.396 0.461 assign (resid 70 and name HN )(resid 70 and name HG2 ) 3.385 0.611 0.745 assign ((resid 70 and name HD# ) or (resid 69 and name HA ))(resid 70 and name HN ) 3.356 0.476 0.555 assign (resid 70 and name HD# )(resid 70 and name HA ) 3.455 0.623 0.761 assign (resid 69 and name HN )(resid 70 and name HN ) 3.037 0.431 0.502 assign (resid 70 and name HN )(resid 69 and name HN ) 2.664 0.378 0.440 assign (resid 70 and name HN )(resid 69 and name HA ) 3.178 0.573 0.700 assign (resid 69 and name HG11 )(resid 70 and name HN ) 4.640 0.658 0.767 assign (resid 70 and name HN )(resid 69 and name HG2# ) 3.396 0.613 0.748 assign (resid 68 and name HN )(resid 70 and name HN ) 4.711 0.668 0.779 assign (resid 68 and name HA )(resid 70 and name HN ) 5.164 0.732 0.854 assign (resid 68 and name HB )(resid 70 and name HN ) 5.121 0.726 0.847 assign (resid 67 and name HA )(resid 70 and name HB1 ) 3.373 0.608 0.742 assign (resid 67 and name HA )(resid 70 and name HB2 ) 3.093 0.558 0.681 assign (resid 67 and name HA )(resid 70 and name HN ) 3.582 0.508 0.592 assign ((resid 67 or resid 70) and name HN )(resid 67 and name HA ) 2.723 0.386 0.450 assign (resid 70 and name HD# )(resid 67 and name HA ) 3.440 0.621 0.757 ! I69 assign ((resid 69 or resid 66) and name HA )(resid 69 and name HN ) 2.637 0.374 0.436 assign (resid 69 and name HN )(resid 69 and name HA ) 2.809 0.507 0.618 assign (resid 69 and name HB )(resid 69 and name HN ) 2.338 0.332 0.386 assign (resid 69 and name HG11 )(resid 69 and name HN ) 2.465 0.350 0.407 assign (resid 69 and name HG12 )(resid 69 and name HN ) 2.497 0.354 0.413 assign (resid 69 and name HN )(resid 69 and name HG2# ) 3.231 0.583 0.711 assign (resid 69 and name HN )(resid 69 and name HD* ) 3.263 0.589 0.718 assign (resid 69 and name HB )(resid 69 and name HA ) 3.079 0.555 0.677 assign (resid 69 and name HG11 )(resid 69 and name HA ) 2.757 0.497 0.607 assign (resid 69 and name HG12 )(resid 69 and name HA ) 2.376 0.429 0.523 assign (resid 69 and name HG2# )(resid 69 and name HA ) 2.534 0.457 0.558 assign (resid 69 and name HA )(resid 69 and name HG2# ) 2.725 0.492 0.600 assign ((resid 69 or resid 66) and name HA )(resid 69 and name HD* ) 2.838 0.512 0.625 assign (resid 68 and name HN )(resid 69 and name HN ) 2.708 0.384 0.448 assign (resid 69 and name HN )(resid 68 and name HN ) 2.706 0.384 0.447 assign (resid 68 and name HA )(resid 69 and name HN ) 3.521 0.499 0.582 assign (resid 69 and name HN )(resid 68 and name HA ) 3.436 0.620 0.756 assign ((resid 69 or resid 66) and name HA )(resid 68 and name HN ) 4.107 0.582 0.679 assign (resid 68 and name HB )(resid 69 and name HN ) 2.645 0.375 0.437 assign (resid 69 and name HN )(resid 68 and name HB ) 2.355 0.425 0.518 assign (resid 69 and name HB )(resid 68 and name HN ) 4.145 0.588 0.685 assign (resid 69 and name HG11 )(resid 68 and name HN ) 4.560 0.647 0.754 assign (resid 68 and name HG2# )(resid 69 and name HN ) 3.330 0.472 0.550 assign (resid 69 and name HN )(resid 68 and name HG2# ) 3.928 0.708 0.864 assign (resid 69 and name HN )(resid 67 and name HN ) 4.787 0.679 0.791 assign (resid 67 and name HA )(resid 69 and name HN ) 4.136 0.587 0.684 assign (resid 69 and name HN )(resid 66 and name HA ) 3.399 0.613 0.748 assign (resid 69 and name HD* )(resid 66 and name HN ) 4.604 0.652 0.761 assign (resid 69 and name HD* )(resid 66 and name HA ) 2.966 0.535 0.653 assign (resid 65 and name HA )(resid 69 and name HN ) 4.136 0.587 0.684 assign (resid 69 and name HN )(resid 65 and name HA ) 3.407 0.615 0.750 ! T68 assign (resid 68 and name HA )(resid 68 and name HN ) 2.700 0.383 0.446 assign (resid 68 and name HN )(resid 68 and name HA ) 2.846 0.513 0.627 assign ((resid 68 and name HB ) or (resid 65 and name HA ))(resid 68 and name HN ) 2.278 0.323 0.377 assign ((resid 68 or resid 65) and name HN )(resid 65 and name HA ) 2.544 0.361 0.420 assign (resid 68 and name HN )(resid 68 and name HB ) 2.355 0.425 0.518 assign (resid 68 and name HG2# )(resid 68 and name HN ) 3.143 0.446 0.520 assign ((resid 67 or resid 70) and name HN )(resid 68 and name HN ) 2.638 0.374 0.436 assign ((resid 68 or resid 65) and name HN )(resid 67 and name HN ) 2.871 0.407 0.475 assign ((resid 67 or resid 64) and name HA )(resid 68 and name HN ) 2.998 0.425 0.496 assign ((resid 68 or resid 65) and name HN )(resid 66 and name HN ) 2.645 0.375 0.437 assign (resid 68 and name HN )(resid 67 and name HA ) 3.729 0.673 0.821 assign (resid 67 and name HB1 )(resid 68 and name HN ) 2.792 0.396 0.462 assign (resid 67 and name HB2 )(resid 68 and name HN ) 2.984 0.423 0.493 assign ((resid 68 and name HB ) or (resid 65 and name HA ))(resid 67 and name HN ) 4.369 0.620 0.722 assign (resid 66 and name HN )(resid 68 and name HN ) 3.994 0.566 0.660 assign (resid 68 and name HG2# )(resid 65 and name HA ) 3.500 0.500 999.0 ! D67 assign ((resid 67 or resid 64) and name HA )(resid 67 and name HN ) 2.634 0.374 0.435 assign (resid 67 and name HB1 )(resid 67 and name HN ) 2.630 0.373 0.435 assign (resid 67 and name HB2 )(resid 67 and name HN ) 2.916 0.413 0.482 assign (resid 66 and name HN )(resid 67 and name HN ) 2.987 0.424 0.494 assign (resid 67 and name HN )(resid 66 and name HN ) 2.719 0.386 0.449 assign (resid 66 and name HA )(resid 67 and name HN ) 3.752 0.532 0.620 assign ((resid 64 or resid 67) and name HA )(resid 66 and name HN ) 3.945 0.559 0.652 assign (resid 67 and name HN )(resid 66 and name HA ) 3.260 0.588 0.717 assign (resid 66 and name HB )(resid 67 and name HN ) 2.677 0.380 0.442 assign (resid 66 and name HG1# )(resid 67 and name HN ) 3.448 0.489 0.570 assign (resid 66 and name HG2# )(resid 67 and name HN ) 3.112 0.441 0.514 assign (resid 66 and name HG2# )(resid 67 and name HA ) 3.241 0.585 0.713 assign (resid 67 and name HA )(resid 66 and name HG2# ) 3.305 0.596 0.727 assign (resid 67 and name HN )(resid 65 and name HN ) 4.394 0.623 0.726 assign (resid 67 and name HN )(resid 64 and name HA ) 3.618 0.653 0.796 assign (resid 67 and name HB1 )(resid 64 and name HA ) 3.094 0.558 0.681 assign (resid 67 and name HB2 )(resid 64 and name HA ) 3.627 0.654 0.798 assign (resid 63 and name HA )(resid 67 and name HN ) 3.986 0.565 0.659 assign ((resid 67 and name HN ) or (resid 63 and name HE21))(resid 63 and name HA ) 3.673 0.663 0.809 ! V66 assign (resid 66 and name HA )(resid 66 and name HN ) 2.764 0.392 0.457 assign (resid 66 and name HN )(resid 66 and name HA ) 2.985 0.539 0.657 assign (resid 66 and name HB )(resid 66 and name HN ) 2.233 0.317 0.369 assign (resid 66 and name HG1# )(resid 66 and name HN ) 2.294 0.325 0.379 assign (resid 66 and name HN )(resid 66 and name HG1# ) 2.407 0.434 0.530 assign (((resid 66 or resid 62) and name HG2# ) or (resid 65 and name HD* ))(resid 66 and name HN ) 2.560 0.363 0.423 assign (resid 66 and name HN )(resid 66 and name HG2# ) 3.269 0.590 0.720 assign (resid 66 and name HN )(resid 65 and name HN ) 2.868 0.407 0.474 assign (resid 65 and name HA )(resid 66 and name HN ) 3.412 0.484 0.564 assign (resid 66 and name HN )(resid 65 and name HA ) 3.694 0.666 0.813 assign (resid 66 and name HB )(resid 65 and name HN ) 4.062 0.576 0.671 assign (resid 65 and name HB1 )(resid 66 and name HN ) 2.861 0.406 0.473 assign (resid 65 and name HB2 )(resid 66 and name HN ) 3.343 0.474 0.553 assign ((resid 63 or resid 64) and name HN )(resid 66 and name HN ) 3.673 0.521 0.607 assign (resid 66 and name HN )(resid 64 and name HN ) 4.460 0.632 0.737 assign (resid 66 and name HN )(resid 63 and name HN ) 5.157 0.731 0.852 assign (resid 63 and name HA )(resid 66 and name HN ) 2.906 0.412 0.480 assign (resid 66 and name HN )(resid 63 and name HA ) 2.981 0.537 0.656 assign (resid 66 and name HB )(resid 63 and name HA ) 2.484 0.448 0.547 assign (resid 66 and name HG1# )(resid 63 and name HA ) 2.842 0.513 0.626 assign (resid 66 and name HG2# )(resid 63 and name HA ) 2.902 0.523 0.639 assign ((resid 66 or resid 62) and name HG2# )(resid 63 and name HE22 ) 4.123 0.585 0.682 assign ((resid 66 or resid 62) and name HG2# )(resid 63 and name HE21 ) 4.202 0.596 0.695 assign (resid 62 and name HA )(resid 66 and name HN ) 4.242 0.601 0.701 ! L65 assign (resid 65 and name HA )(resid 65 and name HN ) 2.831 0.402 0.469 assign (resid 65 and name HB1 )(resid 65 and name HN ) 2.525 0.358 0.417 assign (resid 65 and name HB2 )(resid 65 and name HN ) 2.847 0.404 0.471 assign (resid 65 and name HG )(resid 65 and name HN ) 2.661 0.377 0.440 assign (resid 65 and name HD* )(resid 65 and name HN ) 2.938 0.417 0.486 assign (resid 65 and name HN )(resid 65 and name HD2# ) 3.120 0.563 0.687 assign (resid 65 and name HD* )(resid 65 and name HA ) 2.240 0.404 0.493 assign (resid 65 and name HA )(resid 65 and name HD1# ) 2.258 0.407 0.497 assign (resid 65 and name HA )(resid 65 and name HD2# ) 3.233 0.583 0.712 assign ((resid 64 or resid 63) and name HN )(resid 65 and name HN ) 2.758 0.391 0.456 assign (resid 65 and name HN )(resid 64 and name HN ) 3.002 0.426 0.496 assign (resid 64 and name HA )(resid 65 and name HN ) 3.449 0.489 0.570 assign (resid 65 and name HN )(resid 64 and name HA ) 3.659 0.660 0.805 assign (resid 64 and name HB# )(resid 65 and name HN ) 2.831 0.402 0.469 assign (resid 65 and name HG )(resid 64 and name HN ) 4.713 0.668 0.779 assign (resid 63 and name HA )(resid 65 and name HN ) 3.938 0.558 0.651 assign (resid 62 and name HA )(resid 65 and name HN ) 3.389 0.481 0.560 assign (resid 65 and name HN )(resid 62 and name HA ) 3.434 0.620 0.756 assign (resid 65 and name HB1 )(resid 62 and name HA ) 3.067 0.553 0.675 assign (resid 65 and name HB2 )(resid 62 and name HA ) 3.374 0.608 0.743 ! S64 assign (resid 64 and name HA )(resid 64 and name HN ) 2.833 0.402 0.468 assign (resid 64 and name HN )(resid 64 and name HA ) 2.920 0.527 0.643 assign (resid 64 and name HB# )(resid 64 and name HN ) 2.399 0.340 0.397 assign (resid 64 and name HN )(resid 63 and name HN ) 2.862 0.406 0.473 assign (resid 64 and name HB# )(resid 63 and name HN ) 4.347 0.616 0.719 assign (resid 63 and name HA )(resid 64 and name HN ) 3.498 0.496 0.578 assign (resid 63 and name HB2 )(resid 64 and name HN ) 2.934 0.416 0.485 assign (resid 63 and name HG2 )(resid 64 and name HN ) 4.533 0.643 0.749 assign (resid 62 and name HA )(resid 64 and name HN ) 4.935 0.700 0.816 assign (resid 61 and name HA )(resid 64 and name HN ) 3.373 0.478 0.558 assign ((resid 64 or resid 62) and name HN )(resid 61 and name HA ) 2.908 0.525 0.640 assign (resid 64 and name HB# )(resid 61 and name HA ) 2.368 0.427 0.521 assign (resid 60 and name HB# )(resid 64 and name HN ) 4.664 0.662 0.771 ! Q63 assign (resid 63 and name HA )(resid 63 and name HN ) 2.798 0.396 0.463 assign ((resid 63 or resid 62) and name HN )(resid 63 and name HA ) 2.742 0.495 0.604 assign (resid 63 and name HB# )(resid 63 and name HN ) 2.521 0.357 0.417 assign (resid 63 and name HG1 )(resid 63 and name HN ) 3.407 0.483 0.563 assign (resid 63 and name HA )(resid 63 and name HE22 ) 5.144 0.729 0.850 assign (resid 63 and name HA )(resid 63 and name HE21 ) 4.606 0.653 0.761 assign (resid 62 and name HA )(resid 63 and name HN ) 3.765 0.534 0.622 assign ((resid 63 or resid 62) and name HN )(resid 62 and name HA ) 2.713 0.489 0.597 assign (resid 63 and name HB# )(resid 62 and name HN ) 4.064 0.576 0.672 assign (resid 63 and name HG1 )(resid 62 and name HN ) 4.805 0.681 0.794 assign (resid 62 and name HB )(resid 63 and name HN ) 2.620 0.371 0.433 assign (resid 62 and name HG1# )(resid 63 and name HN ) 3.565 0.505 0.589 assign ((resid 62 or resid 63) and name HN )(resid 62 and name HG1# ) 2.350 0.424 0.517 assign (resid 62 and name HG2# )(resid 63 and name HN ) 3.313 0.470 0.548 assign ((resid 62 or resid 63) and name HN )(resid 62 and name HG2# ) 2.969 0.536 0.654 assign (resid 61 and name HN )(resid 63 and name HN ) 4.625 0.656 0.764 assign ((resid 63 or resid 62) and name HN )(resid 61 and name HN ) 2.586 0.367 0.427 assign (resid 61 and name HA )(resid 63 and name HN ) 4.565 0.647 0.755 assign ((resid 60 or resid 59) and name HA )(resid 63 and name HN ) 3.231 0.458 0.534 assign ((resid 62 or resid 63) and name HN )(resid 59 and name HA ) 2.990 0.539 0.658 assign ((resid 63 or resid 62) and name HN )(resid 60 and name HA ) 2.899 0.523 0.638 assign (resid 63 and name HB# )(resid 60 and name HA ) 2.958 0.534 0.651 ! V62 assign (resid 62 and name HA )(resid 62 and name HN ) 2.924 0.415 0.483 assign (resid 62 and name HB )(resid 62 and name HN ) 2.610 0.370 0.431 assign ((resid 62 and name HG1# ) or (resid 61 and name HG1 ))(resid 62 and name HN ) 2.349 0.333 0.388 assign (resid 62 and name HG2# )(resid 62 and name HN ) 3.297 0.468 0.545 assign (resid 61 and name HN )(resid 62 and name HN ) 2.675 0.379 0.442 assign (resid 61 and name HA )(resid 62 and name HN ) 3.533 0.501 0.584 assign (resid 61 and name HB1 )(resid 62 and name HN ) 3.371 0.478 0.557 assign (resid 61 and name HB2 )(resid 62 and name HN ) 3.616 0.513 0.598 assign (resid 61 and (name HG2 and name HD2 ))(resid 62 and name HN ) 4.604 0.653 0.761 assign (resid 62 and name HB )(resid 61 and name HN ) 4.382 0.621 0.724 assign (resid 61 and name HN )(resid 62 and name HG1# ) 4.135 0.746 0.911 assign (resid 60 and name HN )(resid 62 and name HN ) 3.733 0.529 0.435 assign (resid 62 and name HN )(resid 60 and name HN ) 3.884 0.529 0.435 assign ((resid 62 and name HG1# ) or (resid 61 and name HG1 ))(resid 60 and name HN ) 4.576 0.649 0.756 assign ((resid 60 or resid 59) and name HA )(resid 62 and name HN ) 3.118 0.442 0.515 assign ((resid 62 and name HB ) or (resid 59 and name HG1 ))(resid 59 and name HA ) 2.701 0.487 0.595 assign (resid 59 and name HA )(resid 62 and name HG1# ) 2.780 0.502 0.612 assign (resid 62 and name HG1# )(resid 59 and name HA ) 2.947 0.532 0.649 assign (resid 59 and name HA )(resid 62 and name HG2# ) 3.446 0.622 0.759 assign (resid 62 and name HG2# )(resid 59 and name HA ) 3.425 0.618 0.754 assign (resid 58 and name HB1 )(resid 62 and name HN ) 5.062 0.718 0.837 assign (resid 58 and name HB2 )(resid 62 and name HN ) 4.882 0.693 0.807 assign (resid 57 and name HD1# )(resid 62 and name HG1# ) 2.688 0.485 0.591 assign (resid 62 and name HG1# )(resid 57 and name HD1# ) 2.682 0.484 0.590 assign (resid 57 and name HD2# )(resid 62 and name HG1# ) 2.971 0.536 0.654 assign (resid 62 and name HG1# )(resid 57 and name HD2# ) 2.659 0.480 0.585 ! K61 assign (resid 61 and name HA )(resid 61 and name HN ) 2.825 0.401 0.467 assign (resid 61 and name HN )(resid 61 and name HA ) 2.886 0.521 0.635 assign (resid 61 and name HB1 )(resid 61 and name HN ) 2.660 0.377 0.440 assign (resid 61 and name HB2 )(resid 61 and name HN ) 2.549 0.361 0.421 assign (resid 61 and name HG1 )(resid 61 and name HN ) 3.226 0.457 0.533 assign (resid 61 and (name HG2 or name HD2 ))(resid 61 and name HN ) 4.207 0.597 0.695 assign (resid 61 and name HG1 )(resid 61 and name HA ) 2.725 0.492 0.600 assign (resid 61 and (name HG2 or name HD2 ))(resid 61 and name HA ) 3.057 0.552 0.673 assign (resid 61 and name HD1 )(resid 61 and name HA ) 3.500 0.500 999.0 assign (resid 60 and name HN )(resid 61 and name HN ) 2.532 0.359 0.419 assign (resid 61 and name HN )(resid 60 and name HN ) 2.606 0.370 0.431 assign ((resid 60 or resid 59) and name HA )(resid 61 and name HN ) 3.154 0.447 0.521 assign (resid 61 and name HN )(resid 60 and name HA ) 3.620 0.653 0.797 assign (resid 60 and name HB# )(resid 61 and name HN ) 2.697 0.382 0.446 assign (resid 61 and name HN )(resid 60 and name HB# ) 3.029 0.546 0.667 assign (resid 61 and name HB1 )(resid 60 and name HN ) 5.046 0.715 0.834 assign (resid 61 and name HB2 )(resid 60 and name HN ) 4.888 0.693 0.808 assign (resid 61 and name HN )(resid 59 and name HA ) 3.932 0.709 0.865 assign (resid 58 and name HA )(resid 61 and name HN ) 4.720 0.669 0.780 assign (resid 58 and name HB1 )(resid 61 and name HN ) 3.600 0.511 0.595 assign (resid 58 and name HB2 )(resid 61 and name HN ) 4.147 0.588 0.686 assign (resid 61 and name HB1 )(resid 58 and name HB1 ) 3.180 0.573 0.700 assign (resid 61 and name HB1 )(resid 58 and name HB2 ) 3.509 0.632 0.772 ! A60 assign (((resid 60 or resid 59) and name HA ) or (resid 59 and name HD2))(resid 60 and name HN ) 2.661 0.377 0.440 assign (resid 60 and name HN )(resid 60 and name HA ) 2.899 0.523 0.638 assign (resid 60 and name HB# )(resid 60 and name HN ) 2.275 0.323 0.376 assign (resid 60 and name HN )(resid 60 and name HB# ) 2.484 0.448 0.547 assign (resid 60 and name HN )(resid 59 and name HA ) 4.105 0.740 0.903 assign (resid 59 and name HB1 )(resid 60 and name HN ) 4.445 0.630 0.735 assign (resid 59 and (name HB2 or name HG2 ))(resid 60 and name HN ) 3.242 0.460 0.536 assign (resid 59 and name HG1 )(resid 60 and name HN ) 3.399 0.482 0.562 assign (resid 60 and name HN )(resid 59 and name HD2 ) 3.351 0.604 0.738 assign (resid 60 and name HN )(resid 59 and name HD1 ) 2.986 0.539 0.657 assign (resid 59 and name HD1 )(resid 60 and name HN ) 3.133 0.444 0.518 assign (resid 59 and name HD1 )(resid 60 and name HB# ) 3.216 0.580 0.708 assign (resid 59 and name HG1 )(resid 60 and name HB# ) 4.132 0.746 0.910 assign (resid 59 and name HG2 )(resid 60 and name HB# ) 3.979 0.716 0.873 assign (resid 58 and name HA )(resid 60 and name HN ) 4.028 0.571 0.666 assign (resid 60 and name HN )(resid 58 and name HA ) 3.394 0.612 0.747 assign (resid 58 and name HB1 )(resid 60 and name HN ) 4.789 0.679 0.792 ! P59 assign (resid 59 and name HD1 )(resid 58 and name HA ) 2.063 0.372 0.454 assign (resid 59 and name HD2 )(resid 58 and name HA ) 2.093 0.378 0.461 ! D58 assign (resid 58 and name HA )(resid 58 and name HN ) 2.914 0.413 0.482 assign (resid 58 and name HN )(resid 58 and name HA ) 2.740 0.494 0.603 assign (resid 58 and name HB1 )(resid 58 and name HN ) 2.400 0.340 0.397 assign (resid 58 and name HB2 )(resid 58 and name HN ) 2.462 0.349 0.426 assign (resid 58 and name HN )(resid 57 and name HN ) 4.231 0.600 0.699 assign (resid 57 and name HA )(resid 58 and name HN ) 2.020 0.286 0.334 assign (resid 57 and name HB1 )(resid 58 and name HN ) 3.082 0.437 0.509 assign (resid 57 and name HB2 )(resid 58 and name HN ) 2.785 0.394 0.460 assign (resid 57 and name HD2# )(resid 58 and name HN ) 2.868 0.407 0.474 ! L57 assign (resid 57 and name HA )(resid 57 and name HN ) 3.130 0.444 0.517 assign (resid 57 and name HN )(resid 57 and name HA ) 3.191 0.576 0.702 assign (resid 57 and name HB1 )(resid 57 and name HN ) 2.682 0.380 0.443 assign ((resid 57 and name HB2 ) or (resid 56 and name HG2#))(resid 57 and name HN ) 2.556 0.362 0.422 assign (resid 57 and name HG )(resid 57 and name HN ) 2.654 0.376 0.439 assign (resid 57 and name HD1# )(resid 57 and name HN ) 3.622 0.514 0.599 assign (resid 57 and name HN )(resid 57 and name HD1# ) 3.148 0.568 0.693 assign (resid 57 and name HD2# )(resid 57 and name HN ) 3.536 0.501 0.585 assign (resid 57 and name HA )(resid 57 and name HD1# ) 3.818 0.689 0.840 assign (resid 57 and name HD2# )(resid 57 and name HA ) 2.502 0.451 0.551 assign (resid 57 and name HA )(resid 57 and name HD2# ) 2.700 0.487 0.594 assign (resid 56 and name HA )(resid 57 and name HN ) 1.996 0.283 0.330 assign ((resid 57 or resid 56) and name HN )(resid 56 and name HA ) 2.120 0.382 0.467 assign (resid 56 and name HB )(resid 57 and name HN ) 3.995 0.566 0.660 assign ((resid 56 or resid 57) and name HN )(resid 56 and name HG2# ) 3.011 0.543 0.663 assign (resid 57 and name HG )(resid 55 and name HB1 ) 3.452 0.623 0.761 assign (resid 57 and name HG )(resid 55 and name HB2 ) 3.452 0.623 0.761 assign (resid 57 and name HD2# )(resid 55 and name HB1 ) 2.877 0.519 0.634 assign (resid 57 and name HD2# )(resid 55 and name HB2 ) 2.877 0.519 0.634 ! V56 assign (resid 56 and name HA )(resid 56 and name HN ) 3.075 0.436 0.508 assign (resid 56 and name HB )(resid 56 and name HN ) 2.334 0.331 0.386 assign (resid 56 and name HG* )(resid 56 and name HN ) 2.501 0.355 0.413 assign (resid 56 and name HN )(resid 56 and name HG1# ) 3.029 0.546 0.667 assign (resid 55 and name HN )(resid 56 and name HN ) 4.611 0.654 0.762 assign (resid 55 and name HA )(resid 56 and name HN ) 2.495 0.354 0.413 assign (resid 56 and name HN )(resid 56 and name HA ) 2.409 0.435 0.530 assign (resid 55 and name HB# )(resid 56 and name HN ) 2.784 0.395 0.460 assign (resid 56 and name HN )(resid 55 and name HB1 ) 3.029 0.546 0.667 assign (resid 56 and name HN )(resid 55 and name HB2 ) 3.029 0.546 0.667 ! S55 assign (resid 55 and name HA )(resid 55 and name HN ) 2.882 0.409 0.476 assign (resid 55 and name HN )(resid 55 and name HA ) 3.372 0.608 0.742 assign (resid 55 and name HB# )(resid 55 and name HN ) 3.041 0.431 0.503 assign (resid 55 and name HN )(resid 55 and name HB1 ) 3.345 0.611 0.747 assign (resid 55 and name HN )(resid 55 and name HB2 ) 3.178 0.580 0.710 assign (resid 54 and name HA )(resid 55 and name HN ) 2.151 0.305 0.355 assign (resid 55 and name HN )(resid 54 and name HA ) 2.274 0.410 0.500 assign (resid 54 and name HB1 )(resid 55 and name HN ) 3.259 0.462 0.539 assign (resid 54 and name HB2 )(resid 55 and name HN ) 3.182 0.451 0.526 assign ((resid 55 and name HB# ) or (resid 54 and name HD2))(resid 53 and name HN ) 4.828 0.685 0.798 ! P54 assign (resid 54 and name HD1 )(resid 53 and name HA ) 2.566 0.463 0.565 assign (resid 53 and name HA )(resid 54 and name HD1 ) 2.417 0.436 0.532 assign (resid 54 and name HD2 )(resid 53 and name HA ) 2.697 0.487 0.594 assign (resid 53 and name HA )(resid 54 and name HD2 ) 2.487 0.449 0.547 assign (resid 54 and name HD1 )(resid 53 and name HD2# ) 3.736 0.674 0.822 assign (resid 54 and name HD2 )(resid 53 and name HD2# ) 3.869 0.698 0.852 ! L53 assign (resid 53 and name HA )(resid 53 and name HN ) 3.122 0.443 0.516 assign (resid 53 and name HN )(resid 53 and name HA ) 2.849 0.514 0.627 assign (resid 53 and name HB1 )(resid 53 and name HN ) 3.052 0.433 0.504 assign (resid 53 and (name HB2 or name HG ))(resid 53 and name HN ) 3.257 0.462 0.538 assign (resid 53 and name HD1# )(resid 53 and name HN ) 4.355 0.618 0.720 assign (resid 53 and name HD2# )(resid 53 and name HN ) 4.034 0.572 0.667 assign (resid 53 and name HN )(resid 53 and name HD2# ) 3.957 0.714 0.871 assign (resid 53 and name HD1# )(resid 53 and name HA ) 3.302 0.596 0.727 assign (resid 53 and name HA )(resid 53 and name HD1# ) 3.878 0.700 0.854 assign (resid 53 and name HD2# )(resid 53 and name HA ) 2.374 0.428 0.523 assign (resid 53 and name HA )(resid 53 and name HD2# ) 2.629 0.474 0.579 assign (resid 52 and name HA )(resid 53 and name HN ) 3.599 0.510 0.595 assign (resid 52 and name HB1 )(resid 53 and name HN ) 5.402 0.766 0.893 assign (resid 52 and name HG# )(resid 53 and name HN ) 3.511 0.498 0.580 assign (resid 52 and name HD1 )(resid 53 and name HN ) 3.510 0.498 0.580 assign (resid 52 and name HD2 )(resid 53 and name HN ) 3.967 0.562 0.656 ! P52 assign (resid 52 and name HD1 )(resid 51 and name HA ) 2.368 0.427 0.521 assign (resid 52 and name HD2 )(resid 51 and name HA ) 2.210 0.399 0.486 assign (resid 52 and name HG# )(resid 50 and name HG2# ) 2.857 0.515 0.629 assign (resid 52 and name HD1 )(resid 50 and name HG2# ) 3.605 0.650 0.793 assign (resid 52 and name HD2 )(resid 50 and name HG2# ) 2.879 0.519 0.634 ! R51 assign (resid 51 and name HA )(resid 51 and name HN ) 3.101 0.440 0.513 assign (resid 51 and name HB# )(resid 51 and name HN ) 2.487 0.353 0.411 assign (resid 51 and name HG1 )(resid 51 and name HN ) 3.511 0.498 0.580 assign (resid 51 and name HG2 )(resid 51 and name HN ) 3.114 0.442 0.515 assign (resid 50 and name HN )(resid 51 and name HN ) 4.820 0.683 0.797 assign (resid 50 and name HA )(resid 51 and name HN ) 1.973 0.280 0.326 assign (resid 51 and name HN )(resid 50 and name HA ) 2.120 0.396 0.483 assign (resid 50 and (name HB or name HG12 ))(resid 51 and name HN ) 3.274 0.464 0.541 assign (resid 50 and name HG2# )(resid 51 and name HN ) 2.659 0.377 0.440 assign (resid 51 and name HN )(resid 50 and name HG2# ) 3.003 0.542 0.661 ! I50 assign (resid 50 and name HA )(resid 50 and name HN ) 2.987 0.424 0.494 assign (resid 50 and name HN )(resid 50 and name HA ) 3.075 0.555 0.677 assign (resid 50 and (name HB or name HG12 ))(resid 50 and name HN ) 2.435 0.345 0.402 assign (resid 50 and name HG11 )(resid 50 and name HN ) 2.670 0.379 0.441 assign ((resid 50 and (name HG2# or name HD* )) or (resid 49 and name HD2# ))(resid 50 and name HN ) 2.605 0.369 0.431 assign (resid 50 and name HN )(resid 50 and name HD* ) 3.074 0.555 0.677 assign (resid 50 and name HG11 )(resid 50 and name HA ) 2.779 0.501 0.612 assign (resid 50 and name HG2# )(resid 50 and name HA ) 2.328 0.420 0.512 assign (resid 50 and name HA )(resid 50 and name HG2# ) 2.497 0.451 0.550 assign (resid 50 and name HA )(resid 50 and name HD* ) 3.401 0.613 0.748 assign (resid 49 and name HN )(resid 50 and name HN ) 3.744 0.531 0.619 assign (resid 50 and name HN )(resid 49 and name HN ) 4.366 0.619 0.722 assign (resid 49 and name HA )(resid 50 and name HN ) 2.051 0.291 0.339 assign (resid 50 and name HN )(resid 49 and name HA ) 2.387 0.431 0.525 assign (resid 49 and (name HB1 or name HG ))(resid 50 and name HN ) 3.649 0.517 0.603 assign (resid 49 and name HB2 )(resid 50 and name HN ) 3.606 0.511 0.596 assign (resid 50 and name HN )(resid 49 and name HD2# ) 3.390 0.612 0.746 ! L49 assign (resid 49 and name HA )(resid 49 and name HN ) 3.121 0.443 0.516 assign (resid 49 and name HN )(resid 49 and name HA ) 2.919 0.526 0.642 assign (resid 49 and name HB1 )(resid 49 and name HN ) 2.780 0.394 0.460 assign (resid 49 and name HB2 )(resid 49 and name HN ) 3.078 0.437 0.509 assign (resid 49 and name HG )(resid 49 and name HN ) 2.560 0.363 0.423 assign ((resid 49 and name HD1# ) or (resid 48 and name HG* ))(resid 49 and name HN ) 2.743 0.389 0.453 assign (resid 49 and name HN )(resid 49 and name HD1# ) 3.074 0.554 0.677 assign (resid 49 and name HD2# )(resid 49 and name HN ) 3.471 0.492 0.574 assign (resid 49 and name HN )(resid 49 and name HD2# ) 3.549 0.640 0.781 assign (resid 49 and name HD1# )(resid 49 and name HA ) 3.238 0.584 0.713 assign (resid 49 and name HA )(resid 49 and name HD1# ) 3.392 0.612 0.747 assign (resid 49 and name HD2# )(resid 49 and name HA ) 2.571 0.464 0.566 assign (resid 49 and name HA )(resid 49 and name HD2# ) 2.665 0.481 0.587 assign (resid 48 and name HN )(resid 49 and name HN ) 2.493 0.354 0.412 assign (resid 49 and name HN )(resid 48 and name HN ) 2.500 0.355 0.413 assign (resid 48 and name HA )(resid 49 and name HN ) 3.229 0.458 0.534 assign (resid 49 and name HN )(resid 48 and name HA ) 3.247 0.586 0.715 assign (resid 48 and name HB )(resid 49 and name HN ) 4.189 0.594 0.692 assign (resid 49 and name HN )(resid 48 and name HG1# ) 3.497 0.631 0.770 assign (resid 49 and name HN )(resid 48 and name HG2# ) 3.128 0.564 0.688 assign (resid 47 and name HN )(resid 49 and name HN ) 4.881 0.692 0.807 assign (resid 49 and name HN )(resid 47 and name HN ) 4.736 0.672 0.783 assign (resid 47 and name HA )(resid 49 and name HN ) 4.293 0.609 0.710 assign (resid 49 and name HN )(resid 47 and name HA ) 3.575 0.645 0.787 assign (resid 49 and name HN )(resid 46 and name HA ) 3.512 0.634 0.773 assign (resid 46 and name HA )(resid 49 and name HD1# ) 2.916 0.526 0.642 assign (resid 46 and name HA )(resid 49 and name HD2# ) 3.976 0.717 0.875 ! V48 assign (resid 48 and name HA )(resid 48 and name HN ) 2.948 0.344 0.401 assign (resid 48 and name HN )(resid 48 and name HA ) 2.690 0.485 0.592 assign (resid 48 and name HB )(resid 48 and name HN ) 3.111 0.441 0.514 assign (resid 48 and name HG* )(resid 48 and name HN ) 2.332 0.331 0.385 assign (resid 48 and name HN )(resid 48 and name HG2# ) 2.693 0.486 0.593 assign (resid 48 and name HN )(resid 48 and name HG1# ) 2.968 0.535 0.653 assign (resid 48 and name HA )(resid 48 and name HG2# ) 3.102 0.560 0.683 assign (resid 48 and name HA )(resid 48 and name HG1# ) 2.702 0.487 0.595 assign (resid 48 and name HN )(resid 47 and name HN ) 2.898 0.411 0.479 assign (resid 47 and name HN )(resid 48 and name HN ) 3.373 0.478 0.558 assign (resid 47 and name HA )(resid 48 and name HN ) 3.689 0.523 0.610 assign (resid 48 and name HN )(resid 47 and name HA ) 3.741 0.675 0.823 assign (resid 47 and name HB1 )(resid 48 and name HN ) 4.579 0.649 0.757 assign ((resid 47 and name HB2 ) or (resid 46 and name HA ))(resid 48 and name HN ) 3.817 0.541 0.631 assign (resid 48 and name HN )(resid 46 and name HA ) 3.822 0.689 0.841 assign (resid 45 and name HG1 )(resid 48 and name HN ) 4.764 0.676 0.787 assign (resid 45 and (name HB2 or name HG2 ))(resid 48 and name HN ) 3.065 0.435 0.507 assign (resid 45 and name HG1 )(resid 48 and name HG2# ) 3.500 0.631 0.770 assign (resid 45 and name HG2 )(resid 48 and name HG2# ) 3.117 0.562 0.686 assign (resid 45 and name HD1 )(resid 48 and name HG2# ) 3.062 0.552 0.674 assign (resid 45 and name HD2 )(resid 48 and name HG2# ) 3.821 0.689 0.841 assign (resid 44 and name HG* )(resid 48 and name HG1# ) 3.522 0.635 0.775 assign (resid 44 and name HG* )(resid 48 and name HG2# ) 2.763 0.498 0.608 assign (resid 48 and name HG* )(resid 44 and name HG1# ) 2.808 0.507 0.618 assign (resid 48 and name HG* )(resid 44 and name HG2# ) 2.858 0.516 0.629 ! S47 assign (resid 47 and name HA )(resid 47 and name HN ) 2.666 0.378 0.441 assign (resid 47 and name HN )(resid 47 and name HA ) 2.787 0.503 0.613 assign (resid 47 and name HB1 )(resid 47 and name HN ) 2.776 0.394 0.459 assign ((resid 47 and name HB2 ) or (resid 46 and name HA ))(resid 47 and name HN ) 2.493 0.354 0.412 assign (resid 46 and name HN )(resid 47 and name HN ) 3.036 0.430 0.502 assign (resid 47 and name HN )(resid 46 and name HN ) 2.927 0.415 0.484 assign (resid 47 and name HN )(resid 46 and name HA ) 3.827 0.690 0.842 assign (resid 46 and name HB1 )(resid 47 and name HN ) 3.265 0.463 0.540 assign (resid 46 and name HB2 )(resid 47 and name HN ) 2.934 0.416 0.485 assign (resid 46 and name HD1# )(resid 47 and name HN ) 4.366 0.619 0.722 assign (resid 45 and name HB1 )(resid 47 and name HN ) 3.696 0.524 0.611 assign (resid 45 and name HB2 )(resid 47 and name HN ) 3.263 0.463 0.539 ! L46 assign (resid 46 and name HA )(resid 46 and name HN ) 2.644 0.375 0.437 assign (resid 46 and name HN )(resid 46 and name HA ) 2.897 0.523 0.638 assign (resid 46 and name HB1 )(resid 46 and name HN ) 2.929 0.415 0.484 assign (resid 46 and name HB2 )(resid 46 and name HN ) 2.435 0.345 0.403 assign (resid 46 and name HG )(resid 46 and name HN ) 2.763 0.392 0.457 assign (resid 46 and name HN )(resid 46 and name HD1# ) 3.208 0.578 0.706 assign (resid 46 and name HD2# )(resid 46 and name HN ) 4.039 0.573 0.668 assign (resid 46 and name HN )(resid 46 and name HD2# ) 4.124 0.744 0.908 assign (resid 46 and name HD1# )(resid 46 and name HA ) 3.051 0.550 0.672 assign (resid 46 and name HA )(resid 46 and name HD1# ) 3.326 0.600 0.732 assign (resid 46 and name HD2# )(resid 46 and name HA ) 3.147 0.568 0.693 assign (resid 46 and name HA )(resid 46 and name HD2# ) 3.122 0.563 0.687 assign (resid 46 and name HN )(resid 45 and name HA ) 2.123 0.383 0.467 assign (resid 45 and name HB1 )(resid 46 and name HN ) 3.178 0.451 0.525 assign (resid 45 and name HB2 )(resid 46 and name HN ) 3.392 0.481 0.561 ! P45 assign (resid 45 and name HD1 )(resid 44 and name HA ) 2.551 0.460 0.561 assign (resid 45 and name HD2 )(resid 44 and name HA ) 2.275 0.410 0.501 assign (resid 45 and name HD1 )(resid 44 and name HG2# ) 3.137 0.566 0.690 ! V44 assign (resid 44 and name HA )(resid 44 and name HN ) 2.964 0.420 0.490 assign (resid 44 and name HN )(resid 44 and name HA ) 3.002 0.542 0.661 assign (resid 44 and name HB )(resid 44 and name HN ) 2.664 0.378 0.440 assign (resid 44 and name HN )(resid 44 and name HG1# ) 2.852 0.515 0.628 assign (resid 44 and name HN )(resid 44 and name HG2# ) 3.471 0.626 0.746 assign (resid 44 and name HA )(resid 44 and name HG1# ) 2.938 0.530 0.647 assign (resid 44 and name HA )(resid 44 and name HG2# ) 2.829 0.510 0.623 assign (resid 44 and name HN )(resid 43 and name HN ) 4.158 0.590 0.687 assign (resid 43 and name HA )(resid 44 and name HN ) 2.247 0.319 0.371 assign (resid 44 and name HN )(resid 43 and name HA ) 2.164 0.390 0.476 assign ((resid 43 and name HB1 ) or (resid 42 and name HB2 ))(resid 44 and name HN ) 3.676 0.521 0.608 assign (resid 43 and name HB2 )(resid 44 and name HN ) 3.488 0.495 0.577 assign ((resid 42 or resid 93) and name HB1 )(resid 44 and name HG1# ) 3.399 0.613 0.748 assign (((resid 42 or resid 93) and name HB2 ) or (resid 43 and name HB1 ))(resid 44 and name HG1# ) 3.601 0.650 0.793 assign ((resid 42 or resid 93) and name HB1 )(resid 44 and name HG2# ) 3.563 0.642 0.783 assign (((resid 42 or resid 93) and name HB2 ) or (resid 43 and name HB1 ))(resid 44 and name HG2# ) 3.726 0.672 0.820 ! N43 assign (resid 43 and name HA )(resid 43 and name HN ) 3.374 0.478 0.558 assign (resid 43 and name HN )(resid 43 and name HA ) 3.241 0.585 0.713 assign ((resid 43 and name HB1 ) or (resid 42 and name HB2 ))(resid 43 and name HN ) 2.634 0.373 0.435 assign (resid 43 and name HB2 )(resid 43 and name HN ) 3.145 0.446 0.520 assign (resid 43 and name HD22 )(resid 43 and name HN ) 3.873 0.549 0.640 assign (resid 43 and name HN )(resid 43 and name HD21 ) 4.476 0.635 0.740 assign (resid 43 and name HA )(resid 43 and name HD22 ) 4.422 0.627 0.731 assign (resid 43 and name HA )(resid 43 and name HD21 ) 4.265 0.605 0.705 assign ((resid 43 and name HB1 ) or (resid 42 and name HB2 ))(resid 43 and name HD22 ) 3.412 0.484 0.564 assign (resid 43 and name HB2 )(resid 43 and name HD22 ) 3.680 0.522 0.608 assign ((resid 43 and name HB1 ) or (resid 42 and name HB2 ))(resid 43 and name HD21 ) 2.992 0.424 0.495 assign (resid 43 and name HB2 )(resid 43 and name HD21 ) 3.284 0.466 0.543 assign (resid 42 and name HN )(resid 43 and name HN ) 4.039 0.573 0.668 assign (resid 43 and name HN )(resid 42 and name HN ) 4.586 0.650 0.758 assign (resid 42 and name HA )(resid 43 and name HN ) 2.642 0.375 0.437 assign (resid 43 and name HN )(resid 42 and name HA ) 2.673 0.482 0.588 assign (resid 42 and name HB1 )(resid 43 and name HN ) 2.983 0.423 0.493 ! H42 assign (resid 42 and name HB1 )(resid 42 and name HN ) 3.284 0.466 0.543 assign ((resid 42 and name HB2 ) or (resid 43 and name HB1 ))(resid 42 and name HN ) 2.670 0.379 0.441 assign (resid 42 and name HD2 )(resid 42 and name HN ) 3.889 0.551 0.643 assign (resid 42 and name HN )(resid 42 and name HD2 ) 3.980 0.658 0.804 assign (resid 42 and name HA )(resid 42 and name HD2 ) 3.476 0.575 0.703 assign (resid 42 and name HB1 )(resid 42 and name HD2 ) 3.892 0.643 0.787 assign ((resid 42 and name HB2 ) or (resid 43 and name HB1 ))(resid 42 and name HD2 ) 3.616 0.598 0.731 assign (resid 41 and name HN )(resid 42 and name HN ) 3.959 0.561 0.655 assign (resid 42 and name HN )(resid 41 and name HN ) 4.364 0.619 0.721 assign (resid 42 and name HN )(resid 41 and name HA ) 2.269 0.409 0.499 assign (resid 41 and name HB )(resid 42 and name HN ) 3.280 0.465 0.542 assign (resid 41 and name HG2# )(resid 42 and name HN ) 2.496 0.354 0.413 assign (resid 42 and name HN )(resid 41 and name HG1# ) 3.640 0.657 0.801 assign (resid 42 and name HN )(resid 41 and name HG2# ) 3.082 0.556 0.678 ! V41 assign (resid 41 and name HA )(resid 41 and name HN ) 2.877 0.408 0.476 assign (resid 41 and name HN )(resid 41 and name HA ) 2.962 0.534 0.490 assign (resid 41 and name HB )(resid 41 and name HN ) 2.203 0.312 0.364 assign (resid 41 and name HG1# )(resid 41 and name HN ) 2.478 0.351 0.410 assign (resid 41 and name HN )(resid 41 and name HG1# ) 2.887 0.521 0.635 assign (resid 41 and name HN )(resid 41 and name HG2# ) 3.697 0.667 0.814 assign (resid 40 and name HN )(resid 41 and name HN ) 3.849 0.546 0.636 assign (resid 41 and name HN )(resid 40 and name HN ) 3.748 0.531 0.619 assign (resid 40 and name HA )(resid 41 and name HN ) 2.191 0.311 0.362 assign (resid 41 and name HN )(resid 40 and name HA ) 2.436 0.439 0.536 assign (resid 40 and name HB# )(resid 41 and name HN ) 2.477 0.351 0.410 assign (resid 41 and name HN )(resid 40 and name HB# ) 2.828 0.510 0.622 ! A40 assign (resid 40 and name HN )(resid 40 and name HA ) 3.547 0.640 0.781 assign ((resid 40 or resid 39) and name HB# )(resid 40 and name HN ) 2.372 0.336 0.392 assign (resid 40 and name HN )(resid 40 and name HB# ) 3.048 0.550 0.671 assign (resid 39 and name HN )(resid 40 and name HN ) 3.706 0.525 0.613 assign ((resid 40 or resid 38) and name HN )(resid 39 and name HN ) 3.859 0.547 0.638 assign (resid 39 and name HA )(resid 40 and name HN ) 2.329 0.330 0.385 assign (resid 40 and name HN )(resid 39 and name HA ) 2.225 0.401 0.490 assign ((resid 40 or resid 38) and name HN )(resid 39 and name HB# ) 3.028 0.546 0.666 assign (resid 39 and name HA )(resid 40 and name HB# ) 3.557 0.642 0.783 assign (resid 38 and name HG2# )(resid 40 and name HN ) 3.741 0.531 0.618 assign ((resid 40 or resid 38) and name HN )(resid 38 and name HG2# ) 3.824 0.690 0.842 assign ((resid 39 or resid 40) and name HB# )(resid 38 and name HD* ) 4.217 0.761 0.928 ! A39 assign (resid 39 and name HA )(resid 39 and name HN ) 2.814 0.399 0.465 assign (resid 39 and name HN )(resid 39 and name HA ) 3.618 0.653 0.796 assign (resid 39 and name HB# )(resid 39 and name HN ) 2.490 0.353 0.412 assign (resid 39 and name HN )(resid 38 and name HN ) 4.069 0.577 0.673 assign (resid 38 and name HA )(resid 39 and name HN ) 2.181 0.309 0.361 assign (resid 39 and name HN )(resid 38 and name HA ) 2.694 0.486 0.593 assign (resid 38 and name HB )(resid 39 and name HN ) 3.994 0.566 0.660 assign (resid 38 and name HG12 )(resid 39 and name HN ) 3.898 0.553 0.645 assign (resid 39 and name HN )(resid 38 and name HG2# ) 4.158 0.750 0.915 assign (resid 39 and name HB# )(resid 38 and name HN ) 3.936 0.560 0.652 assign (resid 39 and name HB# )(resid 38 and name HA ) 3.835 0.692 0.844 assign (resid 38 and name HA )(resid 39 and name HB# ) 4.357 0.786 0.959 ! I38 assign (resid 38 and name HA )(resid 38 and name HN ) 3.127 0.443 0.517 assign (resid 38 and name HN )(resid 38 and name HA ) 3.721 0.671 0.819 assign ((resid 38 and name HB ) or (resid 37 and name HB1 ))(resid 38 and name HN ) 2.513 0.356 0.415 assign (resid 38 and name HG11 )(resid 38 and name HN ) 3.404 0.483 0.563 assign (resid 38 and name HG12 )(resid 38 and name HN ) 3.344 0.474 0.553 assign (resid 38 and name HG2# )(resid 38 and name HN ) 3.482 0.494 0.576 assign (resid 38 and name HN )(resid 38 and name HD* ) 5.300 0.956 1.167 assign (resid 38 and name HG2# )(resid 38 and name HA ) 2.787 0.503 0.613 assign (resid 38 and name HA )(resid 38 and name HG2# ) 3.121 0.563 0.687 assign (resid 38 and name HA )(resid 38 and name HD* ) 3.573 0.644 0.787 assign (resid 37 and name HA )(resid 38 and name HN ) 2.273 0.332 0.376 assign (resid 38 and name HN )(resid 37 and name HA ) 2.752 0.496 0.606 assign (resid 37 and name HB2 )(resid 38 and name HN ) 4.312 0.611 0.713
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