NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
525715 | 2l80 | 17388 | cing | 3-converted-DOCR | XPLOR/CNS | distance | general distance | ambi |
assi (( segid " A" and resid 59 and name HA )) (( segid " A" and resid 59 and name HB2 )) 2.570 0.825 0.825 assi ( segid " A" and resid 17 and name HD1#) (( segid " A" and resid 17 and name HG12)) 2.114 0.559 0.559 assi ( segid " A" and resid 17 and name HD1#) (( segid " A" and resid 17 and name HA )) 2.252 0.634 0.634 assi ( segid " A" and resid 17 and name HD1#) (( segid " A" and resid 18 and name HD2 )) 2.705 0.915 0.915 assi ( segid " A" and resid 73 and name HD2#) (( segid " A" and resid 35 and name HB2 )) 2.536 0.804 0.804 assi (( segid " A" and resid 33 and name HB1 )) ( segid " A" and resid 73 and name HD1#) 2.721 0.926 0.926 assi ( segid " A" and resid 73 and name HD1#) (( segid " A" and resid 71 and name HB )) 3.464 1.500 1.500 assi (( segid " A" and resid 10 and name HG1 )) ( segid " A" and resid 8 and name HD1#) 2.972 1.104 1.104 assi (( segid " A" and resid 10 and name HG2 )) ( segid " A" and resid 8 and name HD1#) 2.889 1.043 1.043 assi (( segid " A" and resid 65 and name HB1 )) (( segid " A" and resid 65 and name HB2 )) 2.177 0.592 0.592 assi (( segid " A" and resid 95 and name HB1 )) (( segid " A" and resid 95 and name HB2 )) 1.863 0.434 0.434 assi (( segid " A" and resid 73 and name HB1 )) (( segid " A" and resid 73 and name HB2 )) 1.927 0.464 0.464 assi (( segid " A" and resid 109 and name HB1 )) (( segid " A" and resid 109 and name HA )) 2.309 0.666 0.666 assi ( segid " A" and resid 73 and name HD1#) (( segid " A" and resid 33 and name HB2 )) 2.468 0.761 0.761 assi (( segid " A" and resid 35 and name HB1 )) ( segid " A" and resid 73 and name HD2#) 2.733 0.934 0.934 assi (( segid " A" and resid 35 and name HB1 )) ( segid " A" and resid 73 and name HD1#) 2.938 1.079 1.079 assi (( segid " A" and resid 72 and name HD2 )) (( segid " A" and resid 72 and name HB1 )) 2.414 0.729 0.729 assi (( segid " A" and resid 39 and name HB1 )) (( segid " A" and resid 39 and name HA )) 2.318 0.671 0.671 assi (( segid " A" and resid 39 and name HB2 )) (( segid " A" and resid 39 and name HA )) 1.972 0.486 0.486 assi (( segid " A" and resid 39 and name HB1 )) (( segid " A" and resid 39 and name HB2 )) 1.945 0.473 0.473 assi (( segid " A" and resid 39 and name HB2 )) (( segid " A" and resid 11 and name HG )) 2.296 0.659 0.659 assi (( segid " A" and resid 39 and name HB1 )) (( segid " A" and resid 11 and name HG )) 2.552 0.814 0.814 assi ( segid " A" and resid 70 and name HB# ) (( segid " A" and resid 34 and name HB2 )) 2.110 0.557 0.557 assi (( segid " A" and resid 34 and name HB2 )) (( segid " A" and resid 34 and name HA )) 2.368 0.701 0.701 assi (( segid " A" and resid 77 and name HB )) (( segid " A" and resid 77 and name HA )) 2.673 0.893 0.893 assi (( segid " A" and resid 77 and name HB )) (( segid " A" and resid 78 and name HD1 )) 2.828 1.000 1.000 assi (( segid " A" and resid 75 and name HB )) (( segid " A" and resid 75 and name HA )) 2.112 0.557 0.557 assi (( segid " A" and resid 75 and name HB )) ( segid " A" and resid 75 and name HG2#) 2.343 0.686 0.686 assi (( segid " A" and resid 39 and name HN )) (( segid " A" and resid 38 and name HB )) 2.489 0.775 0.775 assi (( segid " A" and resid 38 and name HN )) (( segid " A" and resid 38 and name HB )) 2.500 0.782 0.782 assi ( segid " A" and resid 70 and name HB# ) (( segid " A" and resid 70 and name HA )) 2.177 0.592 0.592 assi (( segid " A" and resid 70 and name HA )) ( segid " A" and resid 37 and name HD2#) 2.635 0.868 0.868 assi (( segid " A" and resid 70 and name HA )) (( segid " A" and resid 36 and name HA )) 2.211 0.611 0.611 assi (( segid " A" and resid 69 and name HA )) (( segid " A" and resid 69 and name HG )) 2.784 0.969 0.969 assi (( segid " A" and resid 69 and name HA )) (( segid " A" and resid 69 and name HB1 )) 2.451 0.751 0.751 assi (( segid " A" and resid 69 and name HA )) ( segid " A" and resid 69 and name HD2#) 2.200 0.605 0.605 assi (( segid " A" and resid 69 and name HA )) (( segid " A" and resid 85 and name HA )) 2.570 0.826 0.826 assi (( segid " A" and resid 32 and name HA )) (( segid " A" and resid 72 and name HE2 )) 2.368 0.701 0.701 assi (( segid " A" and resid 72 and name HE1 )) (( segid " A" and resid 32 and name HA )) 2.545 0.810 0.810 assi (( segid " A" and resid 79 and name HB2 )) (( segid " A" and resid 79 and name HA )) 2.200 0.605 0.605 assi (( segid " A" and resid 32 and name HN )) (( segid " A" and resid 32 and name HA )) 2.271 0.644 0.644 assi (( segid " A" and resid 33 and name HN )) (( segid " A" and resid 32 and name HA )) 2.555 0.816 0.816 assi (( segid " A" and resid 109 and name HA )) (( segid " A" and resid 78 and name HB2 )) 3.282 1.347 1.347 assi (( segid " A" and resid 109 and name HA )) (( segid " A" and resid 108 and name HB2 )) 3.383 1.431 1.431 assi (( segid " A" and resid 109 and name HN )) (( segid " A" and resid 109 and name HA )) 2.744 0.941 0.941 assi (( segid " A" and resid 98 and name HA )) (( segid " A" and resid 98 and name HN )) 2.697 0.909 0.909 assi (( segid " A" and resid 98 and name HA )) (( segid " A" and resid 99 and name HN )) 2.835 1.005 1.005 assi (( segid " A" and resid 94 and name HN )) (( segid " A" and resid 94 and name HA )) 2.368 0.701 0.701 assi (( segid " A" and resid 94 and name HA )) ( segid " A" and resid 5 and name HB# ) 2.809 0.986 0.986 assi (( segid " A" and resid 107 and name HA )) (( segid " A" and resid 108 and name HN )) 2.520 0.794 0.794 assi (( segid " A" and resid 44 and name HB2 )) (( segid " A" and resid 44 and name HB1 )) 1.977 0.488 0.488 assi (( segid " A" and resid 44 and name HB2 )) (( segid " A" and resid 44 and name HA )) 2.426 0.736 0.736 assi (( segid " A" and resid 44 and name HB2 )) ( segid " A" and resid 29 and name HD1#) 2.780 0.966 0.966 assi (( segid " A" and resid 44 and name HB2 )) ( segid " A" and resid 33 and name HD2#) 2.695 0.908 0.908 assi ( segid " A" and resid 33 and name HD2#) (( segid " A" and resid 24 and name HB1 )) 2.353 0.692 0.692 assi ( segid " A" and resid 33 and name HD2#) (( segid " A" and resid 44 and name HB1 )) 2.318 0.671 0.671 assi ( segid " A" and resid 33 and name HD2#) (( segid " A" and resid 24 and name HA )) 2.913 1.061 1.061 assi ( segid " A" and resid 33 and name HD2#) (( segid " A" and resid 23 and name HA )) 3.290 1.353 1.353 assi ( segid " A" and resid 33 and name HD2#) (( segid " A" and resid 33 and name HA )) 2.233 0.623 0.623 assi ( segid " A" and resid 33 and name HD2#) (( segid " A" and resid 44 and name HA )) 2.284 0.652 0.652 assi (( segid " A" and resid 24 and name HB2 )) ( segid " A" and resid 33 and name HD2#) 3.177 1.261 1.261 assi (( segid " A" and resid 24 and name HB1 )) (( segid " A" and resid 24 and name HA )) 2.389 0.713 0.713 assi (( segid " A" and resid 24 and name HB1 )) (( segid " A" and resid 24 and name HB2 )) 1.866 0.435 0.435 assi (( segid " A" and resid 24 and name HB2 )) (( segid " A" and resid 24 and name HA )) 2.324 0.675 0.675 assi (( segid " A" and resid 71 and name HA )) (( segid " A" and resid 83 and name HA )) 2.343 0.686 0.686 assi (( segid " A" and resid 44 and name HA )) (( segid " A" and resid 33 and name HA )) 2.086 0.544 0.544 assi (( segid " A" and resid 44 and name HB1 )) (( segid " A" and resid 44 and name HA )) 2.439 0.743 0.743 assi (( segid " A" and resid 24 and name HA )) ( segid " A" and resid 25 and name HB# ) 3.593 1.614 1.614 assi (( segid " A" and resid 24 and name HA )) ( segid " A" and resid 42 and name HG1#) 2.983 1.112 1.112 assi (( segid " A" and resid 24 and name HA )) (( segid " A" and resid 43 and name HA )) 2.417 0.730 0.730 assi (( segid " A" and resid 44 and name HN )) (( segid " A" and resid 43 and name HA )) 2.205 0.608 0.608 assi (( segid " A" and resid 43 and name HA )) (( segid " A" and resid 25 and name HN )) 2.591 0.839 0.839 assi (( segid " A" and resid 43 and name HN )) (( segid " A" and resid 43 and name HA )) 2.819 0.993 0.993 assi (( segid " A" and resid 12 and name HA )) (( segid " A" and resid 12 and name HB2 )) 2.282 0.651 0.651 assi (( segid " A" and resid 12 and name HA )) (( segid " A" and resid 12 and name HB1 )) 2.493 0.777 0.777 assi ( segid " A" and resid 106 and name HD1#) (( segid " A" and resid 106 and name HA )) 3.267 1.334 1.334 assi ( segid " A" and resid 106 and name HD1#) (( segid " A" and resid 106 and name HB )) 2.156 0.581 0.581 assi ( segid " A" and resid 106 and name HD1#) (( segid " A" and resid 106 and name HG12)) 2.468 0.761 0.761 assi ( segid " A" and resid 106 and name HD1#) (( segid " A" and resid 104 and name HB2 )) 3.040 1.155 1.155 assi (( segid " A" and resid 17 and name HB )) ( segid " A" and resid 17 and name HD1#) 2.754 0.948 0.948 assi (( segid " A" and resid 76 and name HB )) ( segid " A" and resid 76 and name HD1#) 1.905 0.454 0.454 assi (( segid " A" and resid 88 and name HG1 )) (( segid " A" and resid 88 and name HG2 )) 1.974 0.487 0.487 assi (( segid " A" and resid 88 and name HG2 )) (( segid " A" and resid 88 and name HB1 )) 2.341 0.685 0.685 assi (( segid " A" and resid 88 and name HG1 )) (( segid " A" and resid 88 and name HB1 )) 2.451 0.751 0.751 assi (( segid " A" and resid 88 and name HG2 )) (( segid " A" and resid 88 and name HA )) 2.930 1.073 1.073 assi (( segid " A" and resid 88 and name HG1 )) (( segid " A" and resid 88 and name HA )) 2.839 1.008 1.008 assi (( segid " A" and resid 36 and name HB2 )) (( segid " A" and resid 36 and name HB1 )) 2.167 0.587 0.587 assi (( segid " A" and resid 36 and name HB2 )) (( segid " A" and resid 36 and name HA )) 2.583 0.834 0.834 assi (( segid " A" and resid 36 and name HB1 )) (( segid " A" and resid 36 and name HA )) 2.650 0.878 0.878 assi (( segid " A" and resid 69 and name HA )) (( segid " A" and resid 70 and name HN )) 2.073 0.537 0.537 assi (( segid " A" and resid 69 and name HN )) (( segid " A" and resid 69 and name HA )) 2.468 0.761 0.761 assi (( segid " A" and resid 85 and name HA )) (( segid " A" and resid 85 and name HB2 )) 2.465 0.759 0.759 assi (( segid " A" and resid 85 and name HA )) (( segid " A" and resid 85 and name HB1 )) 2.604 0.847 0.847 assi (( segid " A" and resid 92 and name HN )) (( segid " A" and resid 91 and name HA )) 2.129 0.567 0.567 assi (( segid " A" and resid 91 and name HA )) (( segid " A" and resid 84 and name HA )) 2.247 0.631 0.631 assi (( segid " A" and resid 91 and name HA )) (( segid " A" and resid 91 and name HB2 )) 2.560 0.819 0.819 assi (( segid " A" and resid 91 and name HA )) (( segid " A" and resid 91 and name HB1 )) 2.770 0.959 0.959 assi (( segid " A" and resid 60 and name HA )) (( segid " A" and resid 63 and name HB2 )) 2.276 0.648 0.648 assi (( segid " A" and resid 61 and name HA )) (( segid " A" and resid 64 and name HB2 )) 2.296 0.659 0.659 assi (( segid " A" and resid 61 and name HA )) (( segid " A" and resid 61 and name HB1 )) 2.567 0.823 0.823 assi (( segid " A" and resid 62 and name HA )) (( segid " A" and resid 62 and name HB2 )) 2.624 0.861 0.861 assi (( segid " A" and resid 62 and name HA )) (( segid " A" and resid 62 and name HB1 )) 2.516 0.791 0.791 assi (( segid " A" and resid 64 and name HB2 )) (( segid " A" and resid 65 and name HG2 )) 2.373 0.704 0.704 assi (( segid " A" and resid 60 and name HG1 )) (( segid " A" and resid 60 and name HA )) 2.959 1.095 1.095 assi (( segid " A" and resid 60 and name HG2 )) (( segid " A" and resid 60 and name HA )) 2.497 0.779 0.779 assi (( segid " A" and resid 60 and name HG1 )) (( segid " A" and resid 60 and name HG2 )) 1.655 0.342 0.342 assi (( segid " A" and resid 59 and name HA )) (( segid " A" and resid 62 and name HB2 )) 2.455 0.753 0.753 assi (( segid " A" and resid 32 and name HA )) (( segid " A" and resid 32 and name HB1 )) 2.360 0.696 0.696 assi (( segid " A" and resid 32 and name HA )) (( segid " A" and resid 32 and name HB2 )) 2.524 0.796 0.796 assi (( segid " A" and resid 32 and name HB1 )) (( segid " A" and resid 32 and name HB2 )) 1.923 0.462 0.462 assi (( segid " A" and resid 67 and name HB1 )) (( segid " A" and resid 67 and name HB2 )) 2.113 0.558 0.558 assi (( segid " A" and resid 67 and name HB2 )) (( segid " A" and resid 67 and name HA )) 2.568 0.824 0.824 assi (( segid " A" and resid 67 and name HB2 )) (( segid " A" and resid 38 and name HB )) 2.432 0.740 0.740 assi (( segid " A" and resid 38 and name HB )) (( segid " A" and resid 67 and name HB1 )) 2.773 0.961 0.961 assi (( segid " A" and resid 104 and name HB2 )) (( segid " A" and resid 104 and name HA )) 2.486 0.772 0.772 assi (( segid " A" and resid 104 and name HB2 )) (( segid " A" and resid 104 and name HB1 )) 1.997 0.498 0.498 assi (( segid " A" and resid 104 and name HB1 )) (( segid " A" and resid 104 and name HA )) 2.649 0.877 0.877 assi (( segid " A" and resid 104 and name HB2 )) (( segid " A" and resid 106 and name HB )) 2.646 0.875 0.875 assi (( segid " A" and resid 106 and name HB )) (( segid " A" and resid 106 and name HA )) 2.752 0.946 0.946 assi (( segid " A" and resid 106 and name HB )) (( segid " A" and resid 101 and name HB2 )) 2.532 0.801 0.801 assi (( segid " A" and resid 65 and name HG2 )) (( segid " A" and resid 65 and name HB2 )) 3.002 1.126 1.126 assi (( segid " A" and resid 65 and name HG2 )) (( segid " A" and resid 65 and name HB1 )) 2.579 0.831 0.831 assi (( segid " A" and resid 65 and name HG1 )) (( segid " A" and resid 65 and name HB1 )) 2.673 0.893 0.893 assi (( segid " A" and resid 65 and name HG1 )) (( segid " A" and resid 65 and name HB2 )) 2.677 0.896 0.896 assi (( segid " A" and resid 44 and name HB1 )) ( segid " A" and resid 29 and name HD1#) 2.866 1.027 1.027 assi (( segid " A" and resid 4 and name HB1 )) (( segid " A" and resid 4 and name HB2 )) 1.982 0.491 0.491 assi (( segid " A" and resid 4 and name HB1 )) (( segid " A" and resid 4 and name HA )) 2.629 0.864 0.864 assi (( segid " A" and resid 40 and name HA2 )) (( segid " A" and resid 40 and name HA1 )) 1.898 0.450 0.450 assi (( segid " A" and resid 40 and name HA1 )) ( segid " A" and resid 15 and name HG2#) 3.206 1.285 1.285 assi (( segid " A" and resid 40 and name HA1 )) ( segid " A" and resid 35 and name HD2#) 2.629 0.864 0.864 assi ( segid " A" and resid 35 and name HD2#) (( segid " A" and resid 40 and name HA2 )) 2.906 1.056 1.056 assi ( segid " A" and resid 15 and name HG2#) (( segid " A" and resid 15 and name HA )) 2.250 0.633 0.633 assi ( segid " A" and resid 15 and name HG2#) (( segid " A" and resid 40 and name HA2 )) 2.334 0.681 0.681 assi (( segid " A" and resid 66 and name HA2 )) (( segid " A" and resid 66 and name HA1 )) 1.877 0.440 0.440 assi (( segid " A" and resid 100 and name HA )) (( segid " A" and resid 100 and name HB1 )) 2.392 0.715 0.715 assi (( segid " A" and resid 100 and name HN )) (( segid " A" and resid 100 and name HA )) 2.211 0.611 0.611 assi (( segid " A" and resid 45 and name HN )) (( segid " A" and resid 44 and name HA )) 2.132 0.568 0.568 assi (( segid " A" and resid 44 and name HN )) (( segid " A" and resid 44 and name HA )) 2.536 0.804 0.804 assi (( segid " A" and resid 89 and name HA )) (( segid " A" and resid 89 and name HG2 )) 2.021 0.511 0.511 assi (( segid " A" and resid 89 and name HN )) (( segid " A" and resid 89 and name HA )) 2.248 0.632 0.632 assi (( segid " A" and resid 62 and name HN )) (( segid " A" and resid 59 and name HA )) 2.967 1.100 1.100 assi (( segid " A" and resid 74 and name HN )) (( segid " A" and resid 73 and name HA )) 2.207 0.609 0.609 assi (( segid " A" and resid 73 and name HN )) (( segid " A" and resid 73 and name HA )) 2.696 0.908 0.908 assi (( segid " A" and resid 75 and name HN )) (( segid " A" and resid 73 and name HA )) 2.958 1.094 1.094 assi (( segid " A" and resid 73 and name HA )) (( segid " A" and resid 76 and name HG12)) 2.794 0.976 0.976 assi (( segid " A" and resid 73 and name HA )) (( segid " A" and resid 73 and name HB2 )) 2.280 0.650 0.650 assi ( segid " A" and resid 73 and name HD2#) (( segid " A" and resid 73 and name HA )) 2.147 0.576 0.576 assi (( segid " A" and resid 73 and name HB1 )) (( segid " A" and resid 73 and name HA )) 2.292 0.657 0.657 assi (( segid " A" and resid 72 and name HA )) (( segid " A" and resid 34 and name HA )) 2.486 0.772 0.772 assi (( segid " A" and resid 73 and name HN )) (( segid " A" and resid 72 and name HA )) 2.257 0.637 0.637 assi (( segid " A" and resid 72 and name HN )) (( segid " A" and resid 72 and name HA )) 2.748 0.944 0.944 assi (( segid " A" and resid 72 and name HA )) (( segid " A" and resid 72 and name HB2 )) 2.634 0.867 0.867 assi (( segid " A" and resid 72 and name HA )) (( segid " A" and resid 72 and name HG1 )) 2.896 1.048 1.048 assi (( segid " A" and resid 72 and name HA )) (( segid " A" and resid 72 and name HB1 )) 2.645 0.875 0.875 assi (( segid " A" and resid 20 and name HA )) (( segid " A" and resid 20 and name HB2 )) 2.224 0.618 0.618 assi (( segid " A" and resid 20 and name HN )) (( segid " A" and resid 20 and name HA )) 2.622 0.860 0.860 assi (( segid " A" and resid 21 and name HN )) (( segid " A" and resid 20 and name HA )) 2.863 1.024 1.024 assi (( segid " A" and resid 79 and name HB1 )) (( segid " A" and resid 79 and name HA )) 2.472 0.764 0.764 assi (( segid " A" and resid 79 and name HB1 )) (( segid " A" and resid 79 and name HB2 )) 1.757 0.386 0.386 assi (( segid " A" and resid 80 and name HN )) (( segid " A" and resid 79 and name HB2 )) 2.784 0.969 0.969 assi (( segid " A" and resid 67 and name HA )) (( segid " A" and resid 68 and name HD2 )) 2.137 0.571 0.571 assi (( segid " A" and resid 68 and name HD2 )) (( segid " A" and resid 68 and name HD1 )) 1.954 0.477 0.477 assi (( segid " A" and resid 68 and name HD1 )) (( segid " A" and resid 67 and name HA )) 2.411 0.727 0.727 assi (( segid " A" and resid 68 and name HD2 )) (( segid " A" and resid 68 and name HG2 )) 2.813 0.989 0.989 assi (( segid " A" and resid 68 and name HD2 )) (( segid " A" and resid 68 and name HG1 )) 2.173 0.590 0.590 assi (( segid " A" and resid 68 and name HD1 )) (( segid " A" and resid 68 and name HG2 )) 2.202 0.606 0.606 assi (( segid " A" and resid 94 and name HA )) (( segid " A" and resid 95 and name HD1 )) 2.303 0.663 0.663 assi (( segid " A" and resid 94 and name HA )) (( segid " A" and resid 95 and name HD2 )) 2.202 0.606 0.606 assi (( segid " A" and resid 95 and name HD1 )) (( segid " A" and resid 95 and name HD2 )) 2.138 0.571 0.571 assi (( segid " A" and resid 78 and name HD2 )) (( segid " A" and resid 108 and name HB2 )) 3.491 1.523 1.523 assi (( segid " A" and resid 95 and name HB1 )) (( segid " A" and resid 95 and name HD1 )) 2.641 0.872 0.872 assi (( segid " A" and resid 95 and name HD1 )) ( segid " A" and resid 1 and name HG2#) 2.884 1.040 1.040 assi (( segid " A" and resid 101 and name HA )) (( segid " A" and resid 101 and name HB2 )) 2.645 0.874 0.874 assi (( segid " A" and resid 101 and name HA )) (( segid " A" and resid 101 and name HG )) 2.479 0.768 0.768 assi (( segid " A" and resid 101 and name HA )) (( segid " A" and resid 106 and name HB )) 2.577 0.830 0.830 assi (( segid " A" and resid 101 and name HA )) (( segid " A" and resid 101 and name HB1 )) 2.355 0.693 0.693 assi (( segid " A" and resid 101 and name HA )) ( segid " A" and resid 101 and name HD2#) 1.916 0.459 0.459 assi (( segid " A" and resid 101 and name HN )) (( segid " A" and resid 101 and name HA )) 2.528 0.799 0.799 assi (( segid " A" and resid 101 and name HB1 )) (( segid " A" and resid 106 and name HB )) 2.512 0.789 0.789 assi (( segid " A" and resid 101 and name HB1 )) ( segid " A" and resid 101 and name HD2#) 2.528 0.799 0.799 assi (( segid " A" and resid 101 and name HB1 )) ( segid " A" and resid 101 and name HD1#) 2.566 0.823 0.823 assi (( segid " A" and resid 101 and name HB1 )) (( segid " A" and resid 101 and name HB2 )) 1.979 0.489 0.489 assi (( segid " A" and resid 101 and name HB2 )) ( segid " A" and resid 101 and name HD2#) 5.281 3.487 3.487 assi (( segid " A" and resid 101 and name HB2 )) (( segid " A" and resid 101 and name HN )) 2.493 0.777 0.777 assi (( segid " A" and resid 101 and name HN )) (( segid " A" and resid 101 and name HB1 )) 2.635 0.868 0.868 assi (( segid " A" and 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