NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
580142 |
4ch1   |
19653 | cing | 1-original | 3 | XPLOR/CNS | dihedral angle |
!Dihedral restraints
!
!!TALOS-N phi/psi
assign (resid 30 and name C ) (resid 31 and name N )
(resid 31 and name CA ) (resid 31 and name C ) 1.0 -73.044 12.769 2
assign (resid 31 and name N ) (resid 31 and name CA )
(resid 31 and name C ) (resid 32 and name N ) 1.0 -18.265 7.946 2
assign (resid 31 and name C ) (resid 32 and name N )
(resid 32 and name CA ) (resid 32 and name C ) 1.0 -111.665 12.606 2
assign (resid 32 and name N ) (resid 32 and name CA )
(resid 32 and name C ) (resid 33 and name N ) 1.0 12.526 13.631 2
assign (resid 32 and name C ) (resid 33 and name N )
(resid 33 and name CA ) (resid 33 and name C ) 1.0 -60.367 6.167 2
assign (resid 33 and name N ) (resid 33 and name CA )
(resid 33 and name C ) (resid 34 and name N ) 1.0 -37.359 13.090 2
assign (resid 33 and name C ) (resid 34 and name N )
(resid 34 and name CA ) (resid 34 and name C ) 1.0 -89.419 15.008 2
assign (resid 34 and name N ) (resid 34 and name CA )
(resid 34 and name C ) (resid 35 and name N ) 1.0 -4.283 11.544 2
assign (resid 34 and name C ) (resid 35 and name N )
(resid 35 and name CA ) (resid 35 and name C ) 1.0 -115.057 32.089 2
!!assign (resid 35 and name N ) (resid 35 and name CA )
!! (resid 35 and name C ) (resid 36 and name N ) 1.0 155.662 10.930 2
assign (resid 35 and name C ) (resid 36 and name N )
(resid 36 and name CA ) (resid 36 and name C ) 1.0 -90.819 17.302 2
assign (resid 36 and name N ) (resid 36 and name CA )
(resid 36 and name C ) (resid 37 and name N ) 1.0 123.749 9.672 2
assign (resid 36 and name C ) (resid 37 and name N )
(resid 37 and name CA ) (resid 37 and name C ) 1.0 -101.226 10.885 2
assign (resid 37 and name N ) (resid 37 and name CA )
(resid 37 and name C ) (resid 38 and name N ) 1.0 127.410 6.603 2
assign (resid 37 and name C ) (resid 38 and name N )
(resid 38 and name CA ) (resid 38 and name C ) 1.0 -104.161 12.252 2
assign (resid 38 and name N ) (resid 38 and name CA )
(resid 38 and name C ) (resid 39 and name N ) 1.0 125.754 6.985 2
assign (resid 38 and name C ) (resid 39 and name N )
(resid 39 and name CA ) (resid 39 and name C ) 1.0 -111.187 7.784 2
assign (resid 39 and name N ) (resid 39 and name CA )
(resid 39 and name C ) (resid 40 and name N ) 1.0 119.576 10.659 2
assign (resid 39 and name C ) (resid 40 and name N )
(resid 40 and name CA ) (resid 40 and name C ) 1.0 -101.122 25.034 2
assign (resid 40 and name N ) (resid 40 and name CA )
(resid 40 and name C ) (resid 41 and name N ) 1.0 163.654 15.720 2
assign (resid 40 and name C ) (resid 41 and name N )
(resid 41 and name CA ) (resid 41 and name C ) 1.0 85.052 13.687 2
assign (resid 41 and name N ) (resid 41 and name CA )
(resid 41 and name C ) (resid 42 and name N ) 1.0 16.607 14.102 2
assign (resid 41 and name C ) (resid 42 and name N )
(resid 42 and name CA ) (resid 42 and name C ) 1.0 -79.192 12.566 2
assign (resid 42 and name N ) (resid 42 and name CA )
(resid 42 and name C ) (resid 43 and name N ) 1.0 137.146 11.521 2
assign (resid 42 and name C ) (resid 43 and name N )
(resid 43 and name CA ) (resid 43 and name C ) 1.0 -63.954 7.421 2
assign (resid 43 and name N ) (resid 43 and name CA )
(resid 43 and name C ) (resid 44 and name N ) 1.0 139.841 17.349 2
assign (resid 43 and name C ) (resid 44 and name N )
(resid 44 and name CA ) (resid 44 and name C ) 1.0 -67.230 7.827 2
assign (resid 44 and name N ) (resid 44 and name CA )
(resid 44 and name C ) (resid 45 and name N ) 1.0 -17.504 12.475 2
assign (resid 44 and name C ) (resid 45 and name N )
(resid 45 and name CA ) (resid 45 and name C ) 1.0 -92.810 14.516 2
assign (resid 45 and name N ) (resid 45 and name CA )
(resid 45 and name C ) (resid 46 and name N ) 1.0 2.363 21.998 2
assign (resid 45 and name C ) (resid 46 and name N )
(resid 46 and name CA ) (resid 46 and name C ) 1.0 -63.529 7.163 2
assign (resid 46 and name N ) (resid 46 and name CA )
(resid 46 and name C ) (resid 47 and name N ) 1.0 134.628 7.178 2
assign (resid 46 and name C ) (resid 47 and name N )
(resid 47 and name CA ) (resid 47 and name C ) 1.0 -128.236 16.397 2
assign (resid 47 and name N ) (resid 47 and name CA )
(resid 47 and name C ) (resid 48 and name N ) 1.0 165.963 6.011 2
assign (resid 47 and name C ) (resid 48 and name N )
(resid 48 and name CA ) (resid 48 and name C ) 1.0 -61.216 5.303 2
assign (resid 48 and name N ) (resid 48 and name CA )
(resid 48 and name C ) (resid 49 and name N ) 1.0 -36.304 5.322 2
assign (resid 48 and name C ) (resid 49 and name N )
(resid 49 and name CA ) (resid 49 and name C ) 1.0 -64.955 4.494 2
assign (resid 49 and name N ) (resid 49 and name CA )
(resid 49 and name C ) (resid 50 and name N ) 1.0 -41.580 5.612 2
assign (resid 49 and name C ) (resid 50 and name N )
(resid 50 and name CA ) (resid 50 and name C ) 1.0 -67.520 4.158 2
assign (resid 50 and name N ) (resid 50 and name CA )
(resid 50 and name C ) (resid 51 and name N ) 1.0 -38.012 3.574 2
assign (resid 50 and name C ) (resid 51 and name N )
(resid 51 and name CA ) (resid 51 and name C ) 1.0 -66.060 3.836 2
assign (resid 51 and name N ) (resid 51 and name CA )
(resid 51 and name C ) (resid 52 and name N ) 1.0 -43.732 3.425 2
assign (resid 51 and name C ) (resid 52 and name N )
(resid 52 and name CA ) (resid 52 and name C ) 1.0 -61.537 3.790 2
assign (resid 52 and name N ) (resid 52 and name CA )
(resid 52 and name C ) (resid 53 and name N ) 1.0 -42.955 10.516 2
assign (resid 52 and name C ) (resid 53 and name N )
(resid 53 and name CA ) (resid 53 and name C ) 1.0 -65.192 3.432 2
assign (resid 53 and name N ) (resid 53 and name CA )
(resid 53 and name C ) (resid 54 and name N ) 1.0 -39.085 4.733 2
assign (resid 53 and name C ) (resid 54 and name N )
(resid 54 and name CA ) (resid 54 and name C ) 1.0 -63.216 5.798 2
assign (resid 54 and name N ) (resid 54 and name CA )
(resid 54 and name C ) (resid 55 and name N ) 1.0 -44.744 4.909 2
assign (resid 54 and name C ) (resid 55 and name N )
(resid 55 and name CA ) (resid 55 and name C ) 1.0 -67.181 3.992 2
assign (resid 55 and name N ) (resid 55 and name CA )
(resid 55 and name C ) (resid 56 and name N ) 1.0 -35.777 6.857 2
assign (resid 55 and name C ) (resid 56 and name N )
(resid 56 and name CA ) (resid 56 and name C ) 1.0 -68.771 4.497 2
assign (resid 56 and name N ) (resid 56 and name CA )
(resid 56 and name C ) (resid 57 and name N ) 1.0 -23.039 10.167 2
assign (resid 56 and name C ) (resid 57 and name N )
(resid 57 and name CA ) (resid 57 and name C ) 1.0 -78.519 10.018 2
assign (resid 57 and name N ) (resid 57 and name CA )
(resid 57 and name C ) (resid 58 and name N ) 1.0 -17.845 9.907 2
assign (resid 57 and name C ) (resid 58 and name N )
(resid 58 and name CA ) (resid 58 and name C ) 1.0 -107.705 15.405 2
assign (resid 58 and name N ) (resid 58 and name CA )
(resid 58 and name C ) (resid 59 and name N ) 1.0 -14.770 15.838 2
!!assign (resid 58 and name C ) (resid 59 and name N )
!! (resid 59 and name CA ) (resid 59 and name C ) 1.0 79.403 6.686 2
!!assign (resid 59 and name N ) (resid 59 and name CA )
!! (resid 59 and name C ) (resid 60 and name N ) 1.0 -163.046 12.301 2
!!assign (resid 59 and name C ) (resid 60 and name N )
!! (resid 60 and name CA ) (resid 60 and name C ) 1.0 -79.060 35.574 2
assign (resid 60 and name N ) (resid 60 and name CA )
(resid 60 and name C ) (resid 61 and name N ) 1.0 134.522 16.604 2
assign (resid 60 and name C ) (resid 61 and name N )
(resid 61 and name CA ) (resid 61 and name C ) 1.0 -104.910 19.019 2
assign (resid 61 and name N ) (resid 61 and name CA )
(resid 61 and name C ) (resid 62 and name N ) 1.0 132.077 9.179 2
!!assign (resid 61 and name C ) (resid 62 and name N )
!! (resid 62 and name CA ) (resid 62 and name C ) 1.0 -92.861 13.715 2
!!assign (resid 62 and name N ) (resid 62 and name CA )
!! (resid 62 and name C ) (resid 63 and name N ) 1.0 -36.319 14.490 2
assign (resid 62 and name C ) (resid 63 and name N )
(resid 63 and name CA ) (resid 63 and name C ) 1.0 -152.936 6.178 2
assign (resid 63 and name N ) (resid 63 and name CA )
(resid 63 and name C ) (resid 64 and name N ) 1.0 143.913 7.675 2
assign (resid 63 and name C ) (resid 64 and name N )
(resid 64 and name CA ) (resid 64 and name C ) 1.0 -123.865 11.025 2
assign (resid 64 and name N ) (resid 64 and name CA )
(resid 64 and name C ) (resid 65 and name N ) 1.0 130.659 13.608 2
assign (resid 64 and name C ) (resid 65 and name N )
(resid 65 and name CA ) (resid 65 and name C ) 1.0 -127.973 8.297 2
assign (resid 65 and name N ) (resid 65 and name CA )
(resid 65 and name C ) (resid 66 and name N ) 1.0 138.790 12.184 2
assign (resid 65 and name C ) (resid 66 and name N )
(resid 66 and name CA ) (resid 66 and name C ) 1.0 -96.168 14.774 2
assign (resid 66 and name N ) (resid 66 and name CA )
(resid 66 and name C ) (resid 67 and name N ) 1.0 125.380 7.992 2
assign (resid 66 and name C ) (resid 67 and name N )
(resid 67 and name CA ) (resid 67 and name C ) 1.0 -86.442 9.623 2
assign (resid 67 and name N ) (resid 67 and name CA )
(resid 67 and name C ) (resid 68 and name N ) 1.0 104.345 23.512 2
assign (resid 67 and name C ) (resid 68 and name N )
(resid 68 and name CA ) (resid 68 and name C ) 1.0 -129.826 13.435 2
assign (resid 68 and name N ) (resid 68 and name CA )
(resid 68 and name C ) (resid 69 and name N ) 1.0 157.297 10.497 2
assign (resid 68 and name C ) (resid 69 and name N )
(resid 69 and name CA ) (resid 69 and name C ) 1.0 -71.160 13.095 2
assign (resid 69 and name N ) (resid 69 and name CA )
(resid 69 and name C ) (resid 70 and name N ) 1.0 132.808 11.710 2
assign (resid 69 and name C ) (resid 70 and name N )
(resid 70 and name CA ) (resid 70 and name C ) 1.0 -66.835 6.930 2
assign (resid 70 and name N ) (resid 70 and name CA )
(resid 70 and name C ) (resid 71 and name N ) 1.0 -29.193 12.400 2
assign (resid 70 and name C ) (resid 71 and name N )
(resid 71 and name CA ) (resid 71 and name C ) 1.0 -84.689 11.743 2
assign (resid 71 and name N ) (resid 71 and name CA )
(resid 71 and name C ) (resid 72 and name N ) 1.0 -38.028 19.582 2
assign (resid 71 and name C ) (resid 72 and name N )
(resid 72 and name CA ) (resid 72 and name C ) 1.0 -107.116 13.271 2
assign (resid 72 and name N ) (resid 72 and name CA )
(resid 72 and name C ) (resid 73 and name N ) 1.0 -17.323 5.594 2
assign (resid 72 and name C ) (resid 73 and name N )
(resid 73 and name CA ) (resid 73 and name C ) 1.0 63.744 4.357 2
assign (resid 73 and name N ) (resid 73 and name CA )
(resid 73 and name C ) (resid 74 and name N ) 1.0 21.264 9.056 2
assign (resid 73 and name C ) (resid 74 and name N )
(resid 74 and name CA ) (resid 74 and name C ) 1.0 -89.838 14.317 2
assign (resid 74 and name N ) (resid 74 and name CA )
(resid 74 and name C ) (resid 75 and name N ) 1.0 139.733 9.329 2
assign (resid 74 and name C ) (resid 75 and name N )
(resid 75 and name CA ) (resid 75 and name C ) 1.0 -75.484 14.871 2
assign (resid 75 and name N ) (resid 75 and name CA )
(resid 75 and name C ) (resid 76 and name N ) 1.0 135.458 12.733 2
!!assign (resid 75 and name C ) (resid 76 and name N )
!! (resid 76 and name CA ) (resid 76 and name C ) 1.0 -90.925 42.649 2
!!assign (resid 76 and name N ) (resid 76 and name CA )
!! (resid 76 and name C ) (resid 77 and name N ) 1.0 135.876 15.073 2
assign (resid 76 and name C ) (resid 77 and name N )
(resid 77 and name CA ) (resid 77 and name C ) 1.0 86.216 9.139 2
assign (resid 77 and name N ) (resid 77 and name CA )
(resid 77 and name C ) (resid 78 and name N ) 1.0 12.251 11.548 2
assign (resid 77 and name C ) (resid 78 and name N )
(resid 78 and name CA ) (resid 78 and name C ) 1.0 -147.206 12.666 2
assign (resid 78 and name N ) (resid 78 and name CA )
(resid 78 and name C ) (resid 79 and name N ) 1.0 159.898 8.020 2
assign (resid 78 and name C ) (resid 79 and name N )
(resid 79 and name CA ) (resid 79 and name C ) 1.0 -158.327 21.428 2
assign (resid 79 and name N ) (resid 79 and name CA )
(resid 79 and name C ) (resid 80 and name N ) 1.0 175.921 12.306 2
assign (resid 79 and name C ) (resid 80 and name N )
(resid 80 and name CA ) (resid 80 and name C ) 1.0 -134.654 11.356 2
assign (resid 80 and name N ) (resid 80 and name CA )
(resid 80 and name C ) (resid 81 and name N ) 1.0 147.127 7.591 2
assign (resid 80 and name C ) (resid 81 and name N )
(resid 81 and name CA ) (resid 81 and name C ) 1.0 -123.334 10.186 2
assign (resid 81 and name N ) (resid 81 and name CA )
(resid 81 and name C ) (resid 82 and name N ) 1.0 126.286 8.281 2
assign (resid 81 and name C ) (resid 82 and name N )
(resid 82 and name CA ) (resid 82 and name C ) 1.0 -105.071 14.540 2
assign (resid 82 and name N ) (resid 82 and name CA )
(resid 82 and name C ) (resid 83 and name N ) 1.0 123.125 12.426 2
assign (resid 82 and name C ) (resid 83 and name N )
(resid 83 and name CA ) (resid 83 and name C ) 1.0 -114.500 28.582 2
assign (resid 83 and name N ) (resid 83 and name CA )
(resid 83 and name C ) (resid 84 and name N ) 1.0 152.555 16.488 2
assign (resid 83 and name C ) (resid 84 and name N )
(resid 84 and name CA ) (resid 84 and name C ) 1.0 -68.727 7.498 2
assign (resid 84 and name N ) (resid 84 and name CA )
(resid 84 and name C ) (resid 85 and name N ) 1.0 -28.344 7.599 2
assign (resid 84 and name C ) (resid 85 and name N )
(resid 85 and name CA ) (resid 85 and name C ) 1.0 -150.537 8.908 2
assign (resid 85 and name N ) (resid 85 and name CA )
(resid 85 and name C ) (resid 86 and name N ) 1.0 164.301 13.342 2
assign (resid 85 and name C ) (resid 86 and name N )
(resid 86 and name CA ) (resid 86 and name C ) 1.0 -64.872 4.461 2
assign (resid 86 and name N ) (resid 86 and name CA )
(resid 86 and name C ) (resid 87 and name N ) 1.0 -36.244 5.998 2
assign (resid 86 and name C ) (resid 87 and name N )
(resid 87 and name CA ) (resid 87 and name C ) 1.0 -60.024 5.896 2
assign (resid 87 and name N ) (resid 87 and name CA )
(resid 87 and name C ) (resid 88 and name N ) 1.0 -42.203 5.059 2
assign (resid 87 and name C ) (resid 88 and name N )
(resid 88 and name CA ) (resid 88 and name C ) 1.0 -66.261 3.252 2
assign (resid 88 and name N ) (resid 88 and name CA )
(resid 88 and name C ) (resid 89 and name N ) 1.0 -38.726 4.824 2
assign (resid 88 and name C ) (resid 89 and name N )
(resid 89 and name CA ) (resid 89 and name C ) 1.0 -65.905 2.801 2
assign (resid 89 and name N ) (resid 89 and name CA )
(resid 89 and name C ) (resid 90 and name N ) 1.0 -40.861 3.865 2
assign (resid 89 and name C ) (resid 90 and name N )
(resid 90 and name CA ) (resid 90 and name C ) 1.0 -64.527 4.091 2
assign (resid 90 and name N ) (resid 90 and name CA )
(resid 90 and name C ) (resid 91 and name N ) 1.0 -40.507 4.691 2
assign (resid 90 and name C ) (resid 91 and name N )
(resid 91 and name CA ) (resid 91 and name C ) 1.0 -65.781 4.138 2
assign (resid 91 and name N ) (resid 91 and name CA )
(resid 91 and name C ) (resid 92 and name N ) 1.0 -41.727 4.379 2
assign (resid 91 and name C ) (resid 92 and name N )
(resid 92 and name CA ) (resid 92 and name C ) 1.0 -65.104 4.581 2
assign (resid 92 and name N ) (resid 92 and name CA )
(resid 92 and name C ) (resid 93 and name N ) 1.0 -35.270 5.927 2
assign (resid 92 and name C ) (resid 93 and name N )
(resid 93 and name CA ) (resid 93 and name C ) 1.0 -71.163 8.749 2
assign (resid 93 and name N ) (resid 93 and name CA )
(resid 93 and name C ) (resid 94 and name N ) 1.0 -22.537 11.806 2
assign (resid 93 and name C ) (resid 94 and name N )
(resid 94 and name CA ) (resid 94 and name C ) 1.0 -73.736 8.081 2
assign (resid 94 and name N ) (resid 94 and name CA )
(resid 94 and name C ) (resid 95 and name N ) 1.0 -26.985 11.739 2
assign (resid 94 and name C ) (resid 95 and name N )
(resid 95 and name CA ) (resid 95 and name C ) 1.0 -121.372 20.443 2
assign (resid 95 and name N ) (resid 95 and name CA )
(resid 95 and name C ) (resid 96 and name N ) 1.0 105.559 31.014 2
assign (resid 95 and name C ) (resid 96 and name N )
(resid 96 and name CA ) (resid 96 and name C ) 1.0 -61.220 6.569 2
assign (resid 96 and name N ) (resid 96 and name CA )
(resid 96 and name C ) (resid 97 and name N ) 1.0 0 30 2
assign (resid 96 and name C ) (resid 97 and name N )
(resid 97 and name CA ) (resid 97 and name C ) 1.0 -127.106 20.190 2
!!!assign (resid 97 and name N ) (resid 97 and name CA )
!!! (resid 97 and name C ) (resid 98 and name N ) 1.0 141.340 20.891 2
assign (resid 97 and name C ) (resid 98 and name N )
(resid 98 and name CA ) (resid 98 and name C ) 1.0 -66.485 6.208 2
assign (resid 98 and name N ) (resid 98 and name CA )
(resid 98 and name C ) (resid 99 and name N ) 1.0 148.770 9.921 2
assign (resid 98 and name C ) (resid 99 and name N )
(resid 99 and name CA ) (resid 99 and name C ) 1.0 -96.876 17.210 2
assign (resid 99 and name N ) (resid 99 and name CA )
(resid 99 and name C ) (resid 100 and name N ) 1.0 121.773 9.864 2
assign (resid 99 and name C ) (resid 100 and name N )
(resid 100 and name CA ) (resid 100 and name C ) 1.0 -128.740 13.623 2
assign (resid 100 and name N ) (resid 100 and name CA )
(resid 100 and name C ) (resid 101 and name N ) 1.0 124.098 8.494 2
assign (resid 100 and name C ) (resid 101 and name N )
(resid 101 and name CA ) (resid 101 and name C ) 1.0 54.363 4.058 2
assign (resid 101 and name N ) (resid 101 and name CA )
(resid 101 and name C ) (resid 102 and name N ) 1.0 38.603 5.499 2
assign (resid 101 and name C ) (resid 102 and name N )
(resid 102 and name CA ) (resid 102 and name C ) 1.0 78.339 4.560 2
assign (resid 102 and name N ) (resid 102 and name CA )
(resid 102 and name C ) (resid 103 and name N ) 1.0 7.950 7.210 2
assign (resid 102 and name C ) (resid 103 and name N )
(resid 103 and name CA ) (resid 103 and name C ) 1.0 -124.521 8.483 2
assign (resid 103 and name N ) (resid 103 and name CA )
(resid 103 and name C ) (resid 104 and name N ) 1.0 141.904 8.840 2
assign (resid 103 and name C ) (resid 104 and name N )
(resid 104 and name CA ) (resid 104 and name C ) 1.0 -77.209 10.009 2
assign (resid 104 and name N ) (resid 104 and name CA )
(resid 104 and name C ) (resid 105 and name N ) 1.0 129.684 9.435 2
assign (resid 104 and name C ) (resid 105 and name N )
(resid 105 and name CA ) (resid 105 and name C ) 1.0 -118.871 10.704 2
assign (resid 105 and name N ) (resid 105 and name CA )
(resid 105 and name C ) (resid 106 and name N ) 1.0 137.439 19.846 2
assign (resid 105 and name C ) (resid 106 and name N )
(resid 106 and name CA ) (resid 106 and name C ) 1.0 -115.932 14.289 2
assign (resid 106 and name N ) (resid 106 and name CA )
(resid 106 and name C ) (resid 107 and name N ) 1.0 128.831 10.954 2
assign (resid 106 and name C ) (resid 107 and name N )
(resid 107 and name CA ) (resid 107 and name C ) 1.0 -121.552 8.901 2
assign (resid 107 and name N ) (resid 107 and name CA )
(resid 107 and name C ) (resid 108 and name N ) 1.0 135.010 8.557 2
assign (resid 107 and name C ) (resid 108 and name N )
(resid 108 and name CA ) (resid 108 and name C ) 1.0 -143.852 14.576 2
assign (resid 108 and name N ) (resid 108 and name CA )
(resid 108 and name C ) (resid 109 and name N ) 1.0 154.469 17.679 2
assign (resid 108 and name C ) (resid 109 and name N )
(resid 109 and name CA ) (resid 109 and name C ) 1.0 -64.300 7.095 2
assign (resid 109 and name N ) (resid 109 and name CA )
(resid 109 and name C ) (resid 110 and name N ) 1.0 134.069 6.424 2
assign (resid 109 and name C ) (resid 110 and name N )
(resid 110 and name CA ) (resid 110 and name C ) 1.0 -60.163 7.200 2
assign (resid 110 and name N ) (resid 110 and name CA )
(resid 110 and name C ) (resid 111 and name N ) 1.0 -35.479 6.342 2
assign (resid 110 and name C ) (resid 111 and name N )
(resid 111 and name CA ) (resid 111 and name C ) 1.0 -69.432 9.973 2
assign (resid 111 and name N ) (resid 111 and name CA )
(resid 111 and name C ) (resid 112 and name N ) 1.0 -23.015 12.091 2
assign (resid 111 and name C ) (resid 112 and name N )
(resid 112 and name CA ) (resid 112 and name C ) 1.0 -74.105 6.666 2
assign (resid 112 and name N ) (resid 112 and name CA )
(resid 112 and name C ) (resid 113 and name N ) 1.0 -19.448 10.493 2
!!!assign (resid 112 and name C ) (resid 113 and name N )
!!! (resid 113 and name CA ) (resid 113 and name C ) 1.0 99.975 12.525 2
assign (resid 113 and name N ) (resid 113 and name CA )
(resid 113 and name C ) (resid 114 and name N ) 1.0 5.813 7.251 2
assign (resid 113 and name C ) (resid 114 and name N )
(resid 114 and name CA ) (resid 114 and name C ) 1.0 -69.942 8.960 2
assign (resid 114 and name N ) (resid 114 and name CA )
(resid 114 and name C ) (resid 115 and name N ) 1.0 136.287 9.030 2
assign (resid 114 and name C ) (resid 115 and name N )
(resid 115 and name CA ) (resid 115 and name C ) 1.0 -72.420 8.986 2
assign (resid 115 and name N ) (resid 115 and name CA )
(resid 115 and name C ) (resid 116 and name N ) 1.0 136.338 11.701 2
!!TALOS-N chi1
!!F34 g-
assign (resid 34 and name N ) (resid 34 and name CA )
(resid 34 and name CB ) (resid 34 and name CG ) 1.0 -60.0 15.0 2
!!T35 g+
assign (resid 35 and name N ) (resid 35 and name CA )
(resid 35 and name CB ) (resid 35 and name OG1 ) 1.0 60.0 15.0 2
!!K36 t
assign (resid 36 and name N ) (resid 36 and name CA )
(resid 36 and name CB ) (resid 36 and name CG ) 1.0 180.0 15.0 2
!!I37 g-
assign (resid 37 and name N ) (resid 37 and name CA )
(resid 37 and name CB ) (resid 37 and name CG1 ) 1.0 -60.0 15.0 2
!!F38 t
assign (resid 38 and name N ) (resid 38 and name CA )
(resid 38 and name CB ) (resid 38 and name CG ) 1.0 180.0 15.0 2
!!V39 t
assign (resid 39 and name N ) (resid 39 and name CA )
(resid 39 and name CB ) (resid 39 and name CG1 ) 1.0 180.0 15.0 2
!!L42 g-
assign (resid 42 and name N ) (resid 42 and name CA )
(resid 42 and name CB ) (resid 42 and name CG ) 1.0 -60.0 15.0 2
!!Y44 g-
assign (resid 44 and name N ) (resid 44 and name CA )
(resid 44 and name CB ) (resid 44 and name CG ) 1.0 -60.0 15.0 2
!!T46 g-
assign (resid 46 and name N ) (resid 46 and name CA )
(resid 46 and name CB ) (resid 46 and name OG1 ) 1.0 -60.0 15.0 2
!!S47 g+
assign (resid 47 and name N ) (resid 47 and name CA )
(resid 47 and name CB ) (resid 47 and name OG ) 1.0 60.0 15.0 2
!!D48 g-
assign (resid 48 and name N ) (resid 48 and name CA )
(resid 48 and name CB ) (resid 48 and name CG ) 1.0 -60.0 15.0 2
!!T50 g-
assign (resid 50 and name N ) (resid 50 and name CA )
(resid 50 and name CB ) (resid 50 and name OG1 ) 1.0 -60.0 15.0 2
!!H52 t
assign (resid 52 and name N ) (resid 52 and name CA )
(resid 52 and name CB ) (resid 52 and name CG ) 1.0 180.0 15.0 2
!!F55 g-
assign (resid 55 and name N ) (resid 55 and name CA )
(resid 55 and name CB ) (resid 55 and name CG ) 1.0 -60.0 15.0 2
!!Q57 g-
assign (resid 57 and name N ) (resid 57 and name CA )
(resid 57 and name CB ) (resid 57 and name CG ) 1.0 -60.0 15.0 2
!!F58 g-
assign (resid 58 and name N ) (resid 58 and name CA )
(resid 58 and name CB ) (resid 58 and name CG ) 1.0 -60.0 15.0 2
!!D60 g-
assign (resid 60 and name N ) (resid 60 and name CA )
(resid 60 and name CB ) (resid 60 and name CG ) 1.0 -60.0 15.0 2
!!I61 g-
assign (resid 61 and name N ) (resid 61 and name CA )
(resid 61 and name CB ) (resid 61 and name CG1 ) 1.0 -60.0 15.0 2
!!V66 t
assign (resid 66 and name N ) (resid 66 and name CA )
(resid 66 and name CB ) (resid 66 and name CG1 ) 1.0 180.0 15.0 2
!!I67 g-
assign (resid 67 and name N ) (resid 67 and name CA )
(resid 67 and name CB ) (resid 67 and name CG1 ) 1.0 -60.0 15.0 2
!!T68 g+
assign (resid 68 and name N ) (resid 68 and name CA )
(resid 68 and name CB ) (resid 68 and name OG1 ) 1.0 60.0 15.0 2
!!D69 t
assign (resid 69 and name N ) (resid 69 and name CA )
(resid 69 and name CB ) (resid 69 and name CG ) 1.0 180.0 15.0 2
!!N71 g-
assign (resid 71 and name N ) (resid 71 and name CA )
(resid 71 and name CB ) (resid 71 and name CG ) 1.0 -60.0 15.0 2
!!T72 g+
assign (resid 72 and name N ) (resid 72 and name CA )
(resid 72 and name CB ) (resid 72 and name OG1 ) 1.0 60.0 15.0 2
!!Q73 g-
assign (resid 73 and name N ) (resid 73 and name CA )
(resid 73 and name CB ) (resid 73 and name CG ) 1.0 -60.0 15.0 2
!!K74 g-
assign (resid 74 and name N ) (resid 74 and name CA )
(resid 74 and name CB ) (resid 74 and name CG ) 1.0 -60.0 15.0 2
!!R76 g-
assign (resid 76 and name N ) (resid 76 and name CA )
(resid 76 and name CB ) (resid 76 and name CG ) 1.0 -60.0 15.0 2
!!Y78 g+
assign (resid 78 and name N ) (resid 78 and name CA )
(resid 78 and name CB ) (resid 78 and name CG ) 1.0 60.0 15.0 2
!!F80 g-
assign (resid 80 and name N ) (resid 80 and name CA )
(resid 80 and name CB ) (resid 80 and name CG ) 1.0 -60.0 15.0 2
!!V81 t
assign (resid 81 and name N ) (resid 81 and name CA )
(resid 81 and name CB ) (resid 81 and name CG1 ) 1.0 180.0 15.0 2
!!T82 g-
assign (resid 82 and name N ) (resid 82 and name CA )
(resid 82 and name CB ) (resid 82 and name OG1 ) 1.0 -60.0 15.0 2
!!M83 g-
assign (resid 83 and name N ) (resid 83 and name CA )
(resid 83 and name CB ) (resid 83 and name CG ) 1.0 -60.0 15.0 2
!!C93 g-
assign (resid 93 and name N ) (resid 93 and name CA )
(resid 93 and name CB ) (resid 93 and name SG ) 1.0 -60.0 15.0 2
!!D95 t
assign (resid 95 and name N ) (resid 95 and name CA )
(resid 95 and name CB ) (resid 95 and name CG ) 1.0 180.0 15.0 2
!!N97 g-
assign (resid 97 and name N ) (resid 97 and name CA )
(resid 97 and name CB ) (resid 97 and name CG ) 1.0 -60.0 15.0 2
!!I99 g-
assign (resid 99 and name N ) (resid 99 and name CA )
(resid 99 and name CB ) (resid 99 and name CG1 ) 1.0 -60.0 15.0 2
!!I100 g-
assign (resid 100 and name N ) (resid 100 and name CA )
(resid 100 and name CB ) (resid 100 and name CG1 ) 1.0 -60.0 15.0 2
!!K104 t
assign (resid 104 and name N ) (resid 104 and name CA )
(resid 104 and name CB ) (resid 104 and name CG ) 1.0 180.0 15.0 2
!!V107 t
assign (resid 107 and name N ) (resid 107 and name CA )
(resid 107 and name CB ) (resid 107 and name CG1 ) 1.0 180.0 15.0 2
!!Y111 g- not included
!!assign (resid 111 and name N ) (resid 111 and name CA )
!! (resid 111 and name CB ) (resid 111 and name CG ) 1.0 -60.0 15.0 2
!!L112 g-
assign (resid 112 and name N ) (resid 112 and name CA )
(resid 112 and name CB ) (resid 112 and name SG ) 1.0 -60.0 15.0 2
!!K115 g-
assign (resid 115 and name N ) (resid 115 and name CA )
(resid 115 and name CB ) (resid 115 and name CG ) 1.0 -60.0 15.0 2
!!R117 g-
assign (resid 117 and name N ) (resid 117 and name CA )
(resid 117 and name CB ) (resid 117 and name SG ) 1.0 -60.0 15.0 2
!!V120 t
assign (resid 120 and name N ) (resid 120 and name CA )
(resid 120 and name CB ) (resid 120 and name CG1 ) 1.0 180.0 15.0 2
!13C D1-D2 = 2.6 = trans
assign (resid 42 and name CA ) (resid 42 and name CB )
(resid 42 and name CG ) (resid 42 and name CD1 ) 1.0 180.0 10.0 2
assign (resid 42 and name N ) (resid 42 and name CA )
(resid 42 and name CB ) (resid 42 and name CG ) 1.0 -60.0 10.0 2
!13C D1-D2 = 1.3 => Leu51 is mostly trans
assign (resid 51 and name CA ) (resid 51 and name CB )
(resid 51 and name CG ) (resid 51 and name CD1 ) 1.0 180.0 10.0 2
assign (resid 51 and name N ) (resid 51 and name CA )
(resid 51 and name CB ) (resid 51 and name CG ) 1.0 -60.0 10.0 2
!13C D1-D2 = 3.3 = trans
assign (resid 109 and name CA ) (resid 109 and name CB )
(resid 109 and name CG ) (resid 109 and name CD1 ) 1.0 180.0 10.0 2
assign (resid 109 and name N ) (resid 109 and name CA )
(resid 109 and name CB ) (resid 109 and name CG ) 1.0 -60.0 10.0 2
!13C D1-D2 = 3.2 = trans
assign (resid 112 and name CA ) (resid 112 and name CB )
(resid 112 and name CG ) (resid 112 and name CD1 ) 1.0 180.0 10.0 2
assign (resid 112 and name N ) (resid 112 and name CA )
(resid 112 and name CB ) (resid 112 and name CG ) 1.0 -60.0 10.0 2
!!DNA dihedrals
! Alpha (O3' - P - O5' - C5') 180 +/- 135
assign (resid 1 and name O3') (resid 2 and name P) (resid 2 and name O5') (resid 2 and name C5') 1 180 135 2
assign (resid 2 and name O3') (resid 3 and name P) (resid 3 and name O5') (resid 3 and name C5') 1 180 135 2
assign (resid 3 and name O3') (resid 4 and name P) (resid 4 and name O5') (resid 4 and name C5') 1 180 135 2
assign (resid 4 and name O3') (resid 5 and name P) (resid 5 and name O5') (resid 5 and name C5') 1 180 135 2
assign (resid 5 and name O3') (resid 6 and name P) (resid 6 and name O5') (resid 6 and name C5') 1 180 135 2
assign (resid 6 and name O3') (resid 7 and name P) (resid 7 and name O5') (resid 7 and name C5') 1 180 135 2
! Beta (P - O5' - C5' - C4') 165 +/- 90
assign (resid 2 and name P) (resid 2 and name O5') (resid 2 and name C5') (resid 2 and name C4') 1 165 90 2
assign (resid 3 and name P) (resid 3 and name O5') (resid 3 and name C5') (resid 3 and name C4') 1 165 90 2
assign (resid 4 and name P) (resid 4 and name O5') (resid 4 and name C5') (resid 4 and name C4') 1 165 90 2
assign (resid 5 and name P) (resid 5 and name O5') (resid 5 and name C5') (resid 5 and name C4') 1 165 90 2
assign (resid 6 and name P) (resid 6 and name O5') (resid 6 and name C5') (resid 6 and name C4') 1 165 90 2
assign (resid 7 and name P) (resid 7 and name O5') (resid 7 and name C5') (resid 7 and name C4') 1 165 90 2
! Gamma ( O5' - C5' - C4' - C3') 125 +/- 85
assign (resid 1 and name O5') (resid 1 and name C5') (resid 1 and name C4') (resid 1 and name C3') 1 125 85 2
assign (resid 2 and name O5') (resid 2 and name C5') (resid 2 and name C4') (resid 2 and name C3') 1 125 85 2
assign (resid 3 and name O5') (resid 3 and name C5') (resid 3 and name C4') (resid 3 and name C3') 1 125 85 2
assign (resid 4 and name O5') (resid 4 and name C5') (resid 4 and name C4') (resid 4 and name C3') 1 125 85 2
assign (resid 5 and name O5') (resid 5 and name C5') (resid 5 and name C4') (resid 5 and name C3') 1 125 85 2
assign (resid 6 and name O5') (resid 6 and name C5') (resid 6 and name C4') (resid 6 and name C3') 1 125 85 2
assign (resid 7 and name O5') (resid 7 and name C5') (resid 7 and name C4') (resid 7 and name C3') 1 125 85 2
! Delta (C5' - C4' - C3' - O3') 115 +/- 50
assign (resid 1 and name C5') (resid 1 and name C4') (resid 1 and name C3') (resid 1 and name O3') 1 115 50 2
assign (resid 2 and name C5') (resid 2 and name C4') (resid 2 and name C3') (resid 2 and name O3') 1 115 50 2
assign (resid 3 and name C5') (resid 3 and name C4') (resid 3 and name C3') (resid 3 and name O3') 1 115 50 2
assign (resid 4 and name C5') (resid 4 and name C4') (resid 4 and name C3') (resid 4 and name O3') 1 115 50 2
assign (resid 5 and name C5') (resid 5 and name C4') (resid 5 and name C3') (resid 5 and name O3') 1 115 50 2
assign (resid 6 and name C5') (resid 6 and name C4') (resid 6 and name C3') (resid 6 and name O3') 1 115 50 2
assign (resid 7 and name C5') (resid 7 and name C4') (resid 7 and name C3') (resid 7 and name O3') 1 115 50 2
! Epsilon (C4' - C3' - O3' - P) -127 +/- 55
assign (resid 1 and name C4') (resid 1 and name C3') (resid 1 and name O3') (resid 2 and name P) 1 -127 55 2
assign (resid 2 and name C4') (resid 2 and name C3') (resid 2 and name O3') (resid 3 and name P) 1 -127 55 2
assign (resid 3 and name C4') (resid 3 and name C3') (resid 3 and name O3') (resid 4 and name P) 1 -127 55 2
assign (resid 4 and name C4') (resid 4 and name C3') (resid 4 and name O3') (resid 5 and name P) 1 -127 55 2
assign (resid 5 and name C4') (resid 5 and name C3') (resid 5 and name O3') (resid 6 and name P) 1 -127 55 2
assign (resid 6 and name C4') (resid 6 and name C3') (resid 6 and name O3') (resid 7 and name P) 1 -127 55 2
! Zeta (C3' - O3' - P - O5') 175 +/- 130
assign (resid 1 and name C3') (resid 1 and name O3') (resid 2 and name P) (resid 2 and name O5') 1 175 130 2
assign (resid 2 and name C3') (resid 2 and name O3') (resid 3 and name P) (resid 3 and name O5') 1 175 130 2
assign (resid 3 and name C3') (resid 3 and name O3') (resid 4 and name P) (resid 4 and name O5') 1 175 130 2
assign (resid 4 and name C3') (resid 4 and name O3') (resid 5 and name P) (resid 5 and name O5') 1 175 130 2
assign (resid 5 and name C3') (resid 5 and name O3') (resid 6 and name P) (resid 6 and name O5') 1 175 130 2
assign (resid 6 and name C3') (resid 6 and name O3') (resid 7 and name P) (resid 7 and name O5') 1 175 130 2
! Chi A,G (O4' - C1' - N9 -C4) -140 +/- 40 (anti)
assign (resid 1 and name O4') (resid 1 and name C1') (resid 1 and name N9) (resid 1 and name C4) 1 -120 60 2
assign (resid 2 and name O4') (resid 2 and name C1') (resid 2 and name N9) (resid 2 and name C4) 1 -120 60 2
assign (resid 3 and name O4') (resid 3 and name C1') (resid 3 and name N1) (resid 3 and name C2) 1 -145 35 2
assign (resid 4 and name O4') (resid 4 and name C1') (resid 4 and name N9) (resid 4 and name C4) 1 70 10 2
assign (resid 5 and name O4') (resid 5 and name C1') (resid 5 and name N1) (resid 5 and name C2) 1 -120 60 2
assign (resid 6 and name O4') (resid 6 and name C1') (resid 6 and name N9) (resid 6 and name C4) 1 -145 35 2
{ Restrain Specific Nucleotides to 2' endo }
assign (resid 1 and name C4') (resid 1 and name O4')
(resid 1 and name C1') (resid 1 and name C2') 2 -18 5 2
assign (resid 1 and name O4') (resid 1 and name C1')
(resid 1 and name C2') (resid 1 and name C3') 2 34 5 2
assign (resid 1 and name C1') (resid 1 and name C2')
(resid 1 and name C3') (resid 1 and name C4') 2 -37 5 2
assign (resid 1 and name C2') (resid 1 and name C3')
(resid 1 and name C4') (resid 1 and name O4') 2 26 5 2
assign (resid 2 and name C4') (resid 2 and name O4')
(resid 2 and name C1') (resid 2 and name C2') 2 -18 5 2
assign (resid 2 and name O4') (resid 2 and name C1')
(resid 2 and name C2') (resid 2 and name C3') 2 34 5 2
assign (resid 2 and name C1') (resid 2 and name C2')
(resid 2 and name C3') (resid 2 and name C4') 2 -37 5 2
assign (resid 2 and name C2') (resid 2 and name C3')
(resid 2 and name C4') (resid 2 and name O4') 2 26 5 2
assign (resid 3 and name C4') (resid 3 and name O4')
(resid 3 and name C1') (resid 3 and name C2') 2 -18 5 2
assign (resid 3 and name O4') (resid 3 and name C1')
(resid 3 and name C2') (resid 3 and name C3') 2 34 5 2
assign (resid 3 and name C1') (resid 3 and name C2')
(resid 3 and name C3') (resid 3 and name C4') 2 -37 5 2
assign (resid 3 and name C2') (resid 3 and name C3')
(resid 3 and name C4') (resid 3 and name O4') 2 26 5 2
assign (resid 5 and name C4') (resid 5 and name O4')
(resid 5 and name C1') (resid 5 and name C2') 2 -18 5 2
assign (resid 5 and name O4') (resid 5 and name C1')
(resid 5 and name C2') (resid 5 and name C3') 2 34 5 2
assign (resid 5 and name C1') (resid 5 and name C2')
(resid 5 and name C3') (resid 5 and name C4') 2 -37 5 2
assign (resid 5 and name C2') (resid 5 and name C3')
(resid 5 and name C4') (resid 5 and name O4') 2 26 5 2
assign (resid 6 and name C4') (resid 6 and name O4')
(resid 6 and name C1') (resid 6 and name C2') 2 -18 5 2
assign (resid 6 and name O4') (resid 6 and name C1')
(resid 6 and name C2') (resid 6 and name C3') 2 34 5 2
assign (resid 6 and name C1') (resid 6 and name C2')
(resid 6 and name C3') (resid 6 and name C4') 2 -37 5 2
assign (resid 6 and name C2') (resid 6 and name C3')
(resid 6 and name C4') (resid 6 and name O4') 2 26 5 2
!
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