NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
636404 |
6j2y   |
cing | 1-original | 3 | XPLOR/CNS | dihedral angle |
# Restraints file 3: talos.tbl
! 2 I -107.042 129.958 10.543 6.338 0.392 0.849 25 16 Strong
assign (resid 1 and name C ) (resid 2 and name N )
(resid 2 and name CA ) (resid 2 and name C ) 1.0 -107.0 21.1 2
assign (resid 2 and name N ) (resid 2 and name CA )
(resid 2 and name C ) (resid 3 and name N ) 1.0 130.0 20.0 2
! 3 V -125.285 135.179 10.191 10.198 0.377 0.855 25 18 Strong
assign (resid 2 and name C ) (resid 3 and name N )
(resid 3 and name CA ) (resid 3 and name C ) 1.0 -125.3 20.4 2
assign (resid 3 and name N ) (resid 3 and name CA )
(resid 3 and name C ) (resid 4 and name N ) 1.0 135.2 20.4 2
! 4 Y -99.625 122.951 9.422 10.603 0.445 0.877 25 18 Strong
assign (resid 3 and name C ) (resid 4 and name N )
(resid 4 and name CA ) (resid 4 and name C ) 1.0 -99.6 20.0 2
assign (resid 4 and name N ) (resid 4 and name CA )
(resid 4 and name C ) (resid 5 and name N ) 1.0 123.0 21.2 2
! 5 K -122.223 135.821 10.630 10.416 0.454 0.895 25 18 Strong
assign (resid 4 and name C ) (resid 5 and name N )
(resid 5 and name CA ) (resid 5 and name C ) 1.0 -122.2 21.3 2
assign (resid 5 and name N ) (resid 5 and name CA )
(resid 5 and name C ) (resid 6 and name N ) 1.0 135.8 20.8 2
! 6 D -68.042 127.969 7.467 8.187 0.545 0.905 25 18 Strong
assign (resid 5 and name C ) (resid 6 and name N )
(resid 6 and name CA ) (resid 6 and name C ) 1.0 -68.0 20.0 2
assign (resid 6 and name N ) (resid 6 and name CA )
(resid 6 and name C ) (resid 7 and name N ) 1.0 128.0 20.0 2
! 7 V -67.191 -28.112 5.523 10.361 0.532 0.864 25 18 Strong
assign (resid 6 and name C ) (resid 7 and name N )
(resid 7 and name CA ) (resid 7 and name C ) 1.0 -67.2 20.0 2
assign (resid 7 and name N ) (resid 7 and name CA )
(resid 7 and name C ) (resid 8 and name N ) 1.0 -28.1 20.7 2
! 8 I -88.680 -44.930 11.091 8.195 0.569 0.794 25 18 Strong
assign (resid 7 and name C ) (resid 8 and name N )
(resid 8 and name CA ) (resid 8 and name C ) 1.0 -88.7 22.2 2
assign (resid 8 and name N ) (resid 8 and name CA )
(resid 8 and name C ) (resid 9 and name N ) 1.0 -44.9 20.0 2
! 9 S -92.437 -22.028 12.501 6.841 0.596 0.747 25 17 Strong
assign (resid 8 and name C ) (resid 9 and name N )
(resid 9 and name CA ) (resid 9 and name C ) 1.0 -92.4 25.0 2
assign (resid 9 and name N ) (resid 9 and name CA )
(resid 9 and name C ) (resid 10 and name N ) 1.0 -22.0 20.0 2
! 10 G 83.189 11.954 11.327 11.662 0.615 0.733 25 17 Strong
assign (resid 9 and name C ) (resid 10 and name N )
(resid 10 and name CA ) (resid 10 and name C ) 1.0 83.2 22.7 2
assign (resid 10 and name N ) (resid 10 and name CA )
(resid 10 and name C ) (resid 11 and name N ) 1.0 12.0 23.3 2
! 13 V -100.128 -9.741 13.233 12.161 1.538 0.899 25 18 Strong
assign (resid 12 and name C ) (resid 13 and name N )
(resid 13 and name CA ) (resid 13 and name C ) 1.0 -100.1 26.5 2
assign (resid 13 and name N ) (resid 13 and name CA )
(resid 13 and name C ) (resid 14 and name N ) 1.0 -9.7 24.3 2
! 15 S -136.884 161.251 11.429 11.046 1.175 0.917 25 18 Strong
assign (resid 14 and name C ) (resid 15 and name N )
(resid 15 and name CA ) (resid 15 and name C ) 1.0 -136.9 22.9 2
assign (resid 15 and name N ) (resid 15 and name CA )
(resid 15 and name C ) (resid 16 and name N ) 1.0 161.3 22.1 2
! 17 A -71.082 -23.702 7.524 8.939 0.813 0.846 25 18 Strong
assign (resid 16 and name C ) (resid 17 and name N )
(resid 17 and name CA ) (resid 17 and name C ) 1.0 -71.1 20.0 2
assign (resid 17 and name N ) (resid 17 and name CA )
(resid 17 and name C ) (resid 18 and name N ) 1.0 -23.7 20.0 2
! 19 K -73.412 127.141 10.970 9.959 0.442 0.810 25 18 Strong
assign (resid 18 and name C ) (resid 19 and name N )
(resid 19 and name CA ) (resid 19 and name C ) 1.0 -73.4 21.9 2
assign (resid 19 and name N ) (resid 19 and name CA )
(resid 19 and name C ) (resid 20 and name N ) 1.0 127.1 20.0 2
! 20 I -99.311 128.238 16.217 9.155 0.438 0.814 25 18 Strong
assign (resid 19 and name C ) (resid 20 and name N )
(resid 20 and name CA ) (resid 20 and name C ) 1.0 -99.3 32.4 2
assign (resid 20 and name N ) (resid 20 and name CA )
(resid 20 and name C ) (resid 21 and name N ) 1.0 128.2 20.0 2
! 21 T -124.052 130.116 17.761 19.297 0.454 0.817 25 16 Strong
assign (resid 20 and name C ) (resid 21 and name N )
(resid 21 and name CA ) (resid 21 and name C ) 1.0 -124.1 35.5 2
assign (resid 21 and name N ) (resid 21 and name CA )
(resid 21 and name C ) (resid 22 and name N ) 1.0 130.1 38.6 2
! 22 P -62.457 147.251 9.850 10.698 0.342 0.821 25 16 Strong
assign (resid 21 and name C ) (resid 22 and name N )
(resid 22 and name CA ) (resid 22 and name C ) 1.0 -62.5 20.0 2
assign (resid 22 and name N ) (resid 22 and name CA )
(resid 22 and name C ) (resid 23 and name N ) 1.0 147.3 21.4 2
! 23 V -68.670 132.666 9.069 11.823 0.343 0.821 25 16 Strong
assign (resid 22 and name C ) (resid 23 and name N )
(resid 23 and name CA ) (resid 23 and name C ) 1.0 -68.7 20.0 2
assign (resid 23 and name N ) (resid 23 and name CA )
(resid 23 and name C ) (resid 24 and name N ) 1.0 132.7 23.6 2
! 24 M -101.134 132.834 10.491 11.576 0.404 0.790 25 18 Strong
assign (resid 23 and name C ) (resid 24 and name N )
(resid 24 and name CA ) (resid 24 and name C ) 1.0 -101.1 21.0 2
assign (resid 24 and name N ) (resid 24 and name CA )
(resid 24 and name C ) (resid 25 and name N ) 1.0 132.8 23.2 2
! 25 E -102.047 145.228 24.038 20.085 0.427 0.776 25 12 Strong
assign (resid 24 and name C ) (resid 25 and name N )
(resid 25 and name CA ) (resid 25 and name C ) 1.0 -102.0 48.1 2
assign (resid 25 and name N ) (resid 25 and name CA )
(resid 25 and name C ) (resid 26 and name N ) 1.0 145.2 40.2 2
! 27 G 85.483 -0.255 11.197 17.837 0.441 0.722 10 9 Generous
assign (resid 26 and name C ) (resid 27 and name N )
(resid 27 and name CA ) (resid 27 and name C ) 1.0 85.5 33.6 2
assign (resid 27 and name N ) (resid 27 and name CA )
(resid 27 and name C ) (resid 28 and name N ) 1.0 -0.3 53.5 2
! 28 E -128.193 153.467 14.157 12.346 0.502 0.747 25 15 Strong
assign (resid 27 and name C ) (resid 28 and name N )
(resid 28 and name CA ) (resid 28 and name C ) 1.0 -128.2 28.3 2
assign (resid 28 and name N ) (resid 28 and name CA )
(resid 28 and name C ) (resid 29 and name N ) 1.0 153.5 24.7 2
! 29 E -78.259 130.962 10.992 11.499 0.559 0.778 25 18 Strong
assign (resid 28 and name C ) (resid 29 and name N )
(resid 29 and name CA ) (resid 29 and name C ) 1.0 -78.3 22.0 2
assign (resid 29 and name N ) (resid 29 and name CA )
(resid 29 and name C ) (resid 30 and name N ) 1.0 131.0 23.0 2
! 30 V -90.657 128.641 17.910 16.432 0.795 0.759 25 16 Strong
assign (resid 29 and name C ) (resid 30 and name N )
(resid 30 and name CA ) (resid 30 and name C ) 1.0 -90.7 35.8 2
assign (resid 30 and name N ) (resid 30 and name CA )
(resid 30 and name C ) (resid 31 and name N ) 1.0 128.6 32.9 2
! 31 P -55.848 135.044 5.711 8.332 0.794 0.775 25 15 Strong
assign (resid 30 and name C ) (resid 31 and name N )
(resid 31 and name CA ) (resid 31 and name C ) 1.0 -55.8 20.0 2
assign (resid 31 and name N ) (resid 31 and name CA )
(resid 31 and name C ) (resid 32 and name N ) 1.0 135.0 20.0 2
! 32 G 82.314 7.932 10.290 11.871 0.557 0.818 25 15 Strong
assign (resid 31 and name C ) (resid 32 and name N )
(resid 32 and name CA ) (resid 32 and name C ) 1.0 82.3 20.6 2
assign (resid 32 and name N ) (resid 32 and name CA )
(resid 32 and name C ) (resid 33 and name N ) 1.0 7.9 23.7 2
! 33 L -123.174 143.113 10.711 13.810 0.569 0.892 25 17 Strong
assign (resid 32 and name C ) (resid 33 and name N )
(resid 33 and name CA ) (resid 33 and name C ) 1.0 -123.2 21.4 2
assign (resid 33 and name N ) (resid 33 and name CA )
(resid 33 and name C ) (resid 34 and name N ) 1.0 143.1 27.6 2
! 34 F -147.219 155.233 10.708 8.987 0.457 0.914 25 18 Strong
assign (resid 33 and name C ) (resid 34 and name N )
(resid 34 and name CA ) (resid 34 and name C ) 1.0 -147.2 21.4 2
assign (resid 34 and name N ) (resid 34 and name CA )
(resid 34 and name C ) (resid 35 and name N ) 1.0 155.2 20.0 2
! 35 E -123.239 144.752 10.708 12.714 0.547 0.915 25 18 Strong
assign (resid 34 and name C ) (resid 35 and name N )
(resid 35 and name CA ) (resid 35 and name C ) 1.0 -123.2 21.4 2
assign (resid 35 and name N ) (resid 35 and name CA )
(resid 35 and name C ) (resid 36 and name N ) 1.0 144.8 25.4 2
! 36 V -131.917 139.834 6.666 12.008 0.412 0.894 25 18 Strong
assign (resid 35 and name C ) (resid 36 and name N )
(resid 36 and name CA ) (resid 36 and name C ) 1.0 -131.9 20.0 2
assign (resid 36 and name N ) (resid 36 and name CA )
(resid 36 and name C ) (resid 37 and name N ) 1.0 139.8 24.0 2
! 37 D -80.447 130.592 10.422 14.144 0.454 0.882 25 18 Strong
assign (resid 36 and name C ) (resid 37 and name N )
(resid 37 and name CA ) (resid 37 and name C ) 1.0 -80.4 20.8 2
assign (resid 37 and name N ) (resid 37 and name CA )
(resid 37 and name C ) (resid 38 and name N ) 1.0 130.6 28.3 2
! 38 S -140.981 159.202 20.413 11.518 0.447 0.883 25 18 Strong
assign (resid 37 and name C ) (resid 38 and name N )
(resid 38 and name CA ) (resid 38 and name C ) 1.0 -141.0 40.8 2
assign (resid 38 and name N ) (resid 38 and name CA )
(resid 38 and name C ) (resid 39 and name N ) 1.0 159.2 23.0 2
! 39 A -144.677 147.894 12.768 11.376 0.363 0.897 25 18 Strong
assign (resid 38 and name C ) (resid 39 and name N )
(resid 39 and name CA ) (resid 39 and name C ) 1.0 -144.7 25.5 2
assign (resid 39 and name N ) (resid 39 and name CA )
(resid 39 and name C ) (resid 40 and name N ) 1.0 147.9 22.8 2
! 40 M -93.280 129.598 9.185 6.161 0.316 0.893 25 18 Strong
assign (resid 39 and name C ) (resid 40 and name N )
(resid 40 and name CA ) (resid 40 and name C ) 1.0 -93.3 20.0 2
assign (resid 40 and name N ) (resid 40 and name CA )
(resid 40 and name C ) (resid 41 and name N ) 1.0 129.6 20.0 2
! 41 V -130.915 149.820 7.364 11.430 0.285 0.855 25 18 Strong
assign (resid 40 and name C ) (resid 41 and name N )
(resid 41 and name CA ) (resid 41 and name C ) 1.0 -130.9 20.0 2
assign (resid 41 and name N ) (resid 41 and name CA )
(resid 41 and name C ) (resid 42 and name N ) 1.0 149.8 22.9 2
! 42 A -72.986 137.406 9.358 11.295 0.269 0.685 25 18 Strong
assign (resid 41 and name C ) (resid 42 and name N )
(resid 42 and name CA ) (resid 42 and name C ) 1.0 -73.0 20.0 2
assign (resid 42 and name N ) (resid 42 and name CA )
(resid 42 and name C ) (resid 43 and name N ) 1.0 137.4 22.6 2
! 62 D -84.621 4.446 11.927 39.863 0.590 0.698 25 16 Strong
assign (resid 61 and name C ) (resid 62 and name N )
(resid 62 and name CA ) (resid 62 and name C ) 1.0 -84.6 23.9 2
assign (resid 62 and name N ) (resid 62 and name CA )
(resid 62 and name C ) (resid 63 and name N ) 1.0 4.4 70.0 2
! 70 Q -69.884 135.311 8.766 14.405 0.366 0.605 10 18 Generous
assign (resid 69 and name C ) (resid 70 and name N )
(resid 70 and name CA ) (resid 70 and name C ) 1.0 -69.9 30.0 2
assign (resid 70 and name N ) (resid 70 and name CA )
(resid 70 and name C ) (resid 71 and name N ) 1.0 135.3 43.2 2
! 71 K -125.049 144.635 13.549 11.447 0.482 0.800 25 18 Strong
assign (resid 70 and name C ) (resid 71 and name N )
(resid 71 and name CA ) (resid 71 and name C ) 1.0 -125.0 27.1 2
assign (resid 71 and name N ) (resid 71 and name CA )
(resid 71 and name C ) (resid 72 and name N ) 1.0 144.6 22.9 2
! 72 E -137.647 151.137 8.798 6.404 0.617 0.860 25 18 Strong
assign (resid 71 and name C ) (resid 72 and name N )
(resid 72 and name CA ) (resid 72 and name C ) 1.0 -137.6 20.0 2
assign (resid 72 and name N ) (resid 72 and name CA )
(resid 72 and name C ) (resid 73 and name N ) 1.0 151.1 20.0 2
! 73 N -68.033 131.660 5.602 10.414 0.886 0.882 25 18 Strong
assign (resid 72 and name C ) (resid 73 and name N )
(resid 73 and name CA ) (resid 73 and name C ) 1.0 -68.0 20.0 2
assign (resid 73 and name N ) (resid 73 and name CA )
(resid 73 and name C ) (resid 74 and name N ) 1.0 131.7 20.8 2
! 75 V -66.629 -46.831 12.731 8.285 1.425 0.880 25 18 Strong
assign (resid 74 and name C ) (resid 75 and name N )
(resid 75 and name CA ) (resid 75 and name C ) 1.0 -66.6 25.5 2
assign (resid 75 and name N ) (resid 75 and name CA )
(resid 75 and name C ) (resid 76 and name N ) 1.0 -46.8 20.0 2
! 76 S -66.055 -39.574 4.891 6.651 1.370 0.882 25 17 Strong
assign (resid 75 and name C ) (resid 76 and name N )
(resid 76 and name CA ) (resid 76 and name C ) 1.0 -66.1 20.0 2
assign (resid 76 and name N ) (resid 76 and name CA )
(resid 76 and name C ) (resid 77 and name N ) 1.0 -39.6 20.0 2
! 78 P -63.397 -28.764 7.851 7.779 0.967 0.804 25 15 Strong
assign (resid 77 and name C ) (resid 78 and name N )
(resid 78 and name CA ) (resid 78 and name C ) 1.0 -63.4 20.0 2
assign (resid 78 and name N ) (resid 78 and name CA )
(resid 78 and name C ) (resid 79 and name N ) 1.0 -28.8 20.0 2
! 79 S -71.891 -14.911 6.136 6.868 0.731 0.774 25 16 Strong
assign (resid 78 and name C ) (resid 79 and name N )
(resid 79 and name CA ) (resid 79 and name C ) 1.0 -71.9 20.0 2
assign (resid 79 and name N ) (resid 79 and name CA )
(resid 79 and name C ) (resid 80 and name N ) 1.0 -14.9 20.0 2
! 81 F -68.589 -30.217 11.281 11.268 0.863 0.835 25 18 Strong
assign (resid 80 and name C ) (resid 81 and name N )
(resid 81 and name CA ) (resid 81 and name C ) 1.0 -68.6 22.6 2
assign (resid 81 and name N ) (resid 81 and name CA )
(resid 81 and name C ) (resid 82 and name N ) 1.0 -30.2 22.5 2
! 83 Y -108.449 137.466 10.786 12.948 1.283 0.883 25 18 Strong
assign (resid 82 and name C ) (resid 83 and name N )
(resid 83 and name CA ) (resid 83 and name C ) 1.0 -108.4 21.6 2
assign (resid 83 and name N ) (resid 83 and name CA )
(resid 83 and name C ) (resid 84 and name N ) 1.0 137.5 25.9 2
! 84 T -121.024 132.670 17.825 13.731 0.866 0.867 25 18 Strong
assign (resid 83 and name C ) (resid 84 and name N )
(resid 84 and name CA ) (resid 84 and name C ) 1.0 -121.0 35.6 2
assign (resid 84 and name N ) (resid 84 and name CA )
(resid 84 and name C ) (resid 85 and name N ) 1.0 132.7 27.5 2
! 85 A -73.269 131.936 12.343 11.155 0.690 0.839 25 18 Strong
assign (resid 84 and name C ) (resid 85 and name N )
(resid 85 and name CA ) (resid 85 and name C ) 1.0 -73.3 24.7 2
assign (resid 85 and name N ) (resid 85 and name CA )
(resid 85 and name C ) (resid 86 and name N ) 1.0 131.9 22.3 2
! 86 M -120.846 131.450 12.469 22.837 0.604 0.816 25 16 Strong
assign (resid 85 and name C ) (resid 86 and name N )
(resid 86 and name CA ) (resid 86 and name C ) 1.0 -120.8 24.9 2
assign (resid 86 and name N ) (resid 86 and name CA )
(resid 86 and name C ) (resid 87 and name N ) 1.0 131.4 45.7 2
! 87 P -67.676 145.084 6.975 8.395 0.542 0.764 25 16 Strong
assign (resid 86 and name C ) (resid 87 and name N )
(resid 87 and name CA ) (resid 87 and name C ) 1.0 -67.7 20.0 2
assign (resid 87 and name N ) (resid 87 and name CA )
(resid 87 and name C ) (resid 88 and name N ) 1.0 145.1 20.0 2
! 88 F -96.847 141.630 31.809 12.651 0.773 0.750 25 14 Strong
assign (resid 87 and name C ) (resid 88 and name N )
(resid 88 and name CA ) (resid 88 and name C ) 1.0 -96.8 63.6 2
assign (resid 88 and name N ) (resid 88 and name CA )
(resid 88 and name C ) (resid 89 and name N ) 1.0 141.6 25.3 2
! 89 S -74.804 -27.240 12.036 15.368 0.867 0.731 10 16 Generous
assign (resid 88 and name C ) (resid 89 and name N )
(resid 89 and name CA ) (resid 89 and name C ) 1.0 -74.8 36.1 2
assign (resid 89 and name N ) (resid 89 and name CA )
(resid 89 and name C ) (resid 90 and name N ) 1.0 -27.2 46.1 2
! 91 K -63.855 145.325 15.108 12.812 0.449 0.787 25 9 Strong
assign (resid 90 and name C ) (resid 91 and name N )
(resid 91 and name CA ) (resid 91 and name C ) 1.0 -63.9 30.2 2
assign (resid 91 and name N ) (resid 91 and name CA )
(resid 91 and name C ) (resid 92 and name N ) 1.0 145.3 25.6 2
! 92 G -61.853 -35.489 7.185 6.907 0.243 0.864 25 9 Strong
assign (resid 91 and name C ) (resid 92 and name N )
(resid 92 and name CA ) (resid 92 and name C ) 1.0 -61.9 20.0 2
assign (resid 92 and name N ) (resid 92 and name CA )
(resid 92 and name C ) (resid 93 and name N ) 1.0 -35.5 20.0 2
! 93 E -64.044 -36.638 4.240 9.037 0.191 0.881 25 15 Strong
assign (resid 92 and name C ) (resid 93 and name N )
(resid 93 and name CA ) (resid 93 and name C ) 1.0 -64.0 20.0 2
assign (resid 93 and name N ) (resid 93 and name CA )
(resid 93 and name C ) (resid 94 and name N ) 1.0 -36.6 20.0 2
! 94 F -69.547 -41.382 5.206 5.163 0.165 0.909 25 18 Strong
assign (resid 93 and name C ) (resid 94 and name N )
(resid 94 and name CA ) (resid 94 and name C ) 1.0 -69.5 20.0 2
assign (resid 94 and name N ) (resid 94 and name CA )
(resid 94 and name C ) (resid 95 and name N ) 1.0 -41.4 20.0 2
! 95 K -62.282 -42.370 3.434 3.568 0.137 0.926 25 18 Strong
assign (resid 94 and name C ) (resid 95 and name N )
(resid 95 and name CA ) (resid 95 and name C ) 1.0 -62.3 20.0 2
assign (resid 95 and name N ) (resid 95 and name CA )
(resid 95 and name C ) (resid 96 and name N ) 1.0 -42.4 20.0 2
! 96 S -64.472 -41.380 3.205 4.095 0.142 0.924 25 18 Strong
assign (resid 95 and name C ) (resid 96 and name N )
(resid 96 and name CA ) (resid 96 and name C ) 1.0 -64.5 20.0 2
assign (resid 96 and name N ) (resid 96 and name CA )
(resid 96 and name C ) (resid 97 and name N ) 1.0 -41.4 20.0 2
! 97 W -64.403 -44.072 2.973 3.550 0.127 0.916 25 18 Strong
assign (resid 96 and name C ) (resid 97 and name N )
(resid 97 and name CA ) (resid 97 and name C ) 1.0 -64.4 20.0 2
assign (resid 97 and name N ) (resid 97 and name CA )
(resid 97 and name C ) (resid 98 and name N ) 1.0 -44.1 20.0 2
! 98 V -65.018 -39.639 1.968 3.165 0.115 0.904 25 18 Strong
assign (resid 97 and name C ) (resid 98 and name N )
(resid 98 and name CA ) (resid 98 and name C ) 1.0 -65.0 20.0 2
assign (resid 98 and name N ) (resid 98 and name CA )
(resid 98 and name C ) (resid 99 and name N ) 1.0 -39.6 20.0 2
! 99 K -65.262 -41.161 3.753 5.045 0.098 0.900 25 18 Strong
assign (resid 98 and name C ) (resid 99 and name N )
(resid 99 and name CA ) (resid 99 and name C ) 1.0 -65.3 20.0 2
assign (resid 99 and name N ) (resid 99 and name CA )
(resid 99 and name C ) (resid 100 and name N ) 1.0 -41.2 20.0 2
! 100 D -69.989 -38.484 4.411 4.093 0.091 0.903 25 18 Strong
assign (resid 99 and name C ) (resid 100 and name N )
(resid 100 and name CA ) (resid 100 and name C ) 1.0 -70.0 20.0 2
assign (resid 100 and name N ) (resid 100 and name CA )
(resid 100 and name C ) (resid 101 and name N ) 1.0 -38.5 20.0 2
! 101 Y -62.951 -45.461 4.815 3.939 0.082 0.909 25 18 Strong
assign (resid 100 and name C ) (resid 101 and name N )
(resid 101 and name CA ) (resid 101 and name C ) 1.0 -63.0 20.0 2
assign (resid 101 and name N ) (resid 101 and name CA )
(resid 101 and name C ) (resid 102 and name N ) 1.0 -45.5 20.0 2
! 102 V -62.548 -42.072 3.826 3.668 0.092 0.917 25 18 Strong
assign (resid 101 and name C ) (resid 102 and name N )
(resid 102 and name CA ) (resid 102 and name C ) 1.0 -62.5 20.0 2
assign (resid 102 and name N ) (resid 102 and name CA )
(resid 102 and name C ) (resid 103 and name N ) 1.0 -42.1 20.0 2
! 103 R -65.358 -42.529 3.498 3.754 0.107 0.923 25 18 Strong
assign (resid 102 and name C ) (resid 103 and name N )
(resid 103 and name CA ) (resid 103 and name C ) 1.0 -65.4 20.0 2
assign (resid 103 and name N ) (resid 103 and name CA )
(resid 103 and name C ) (resid 104 and name N ) 1.0 -42.5 20.0 2
! 104 N -66.206 -38.356 3.511 3.898 0.113 0.928 25 18 Strong
assign (resid 103 and name C ) (resid 104 and name N )
(resid 104 and name CA ) (resid 104 and name C ) 1.0 -66.2 20.0 2
assign (resid 104 and name N ) (resid 104 and name CA )
(resid 104 and name C ) (resid 105 and name N ) 1.0 -38.4 20.0 2
! 105 V -64.880 -43.211 3.252 2.490 0.114 0.930 25 18 Strong
assign (resid 104 and name C ) (resid 105 and name N )
(resid 105 and name CA ) (resid 105 and name C ) 1.0 -64.9 20.0 2
assign (resid 105 and name N ) (resid 105 and name CA )
(resid 105 and name C ) (resid 106 and name N ) 1.0 -43.2 20.0 2
! 106 R -60.886 -42.436 3.165 2.422 0.097 0.925 25 18 Strong
assign (resid 105 and name C ) (resid 106 and name N )
(resid 106 and name CA ) (resid 106 and name C ) 1.0 -60.9 20.0 2
assign (resid 106 and name N ) (resid 106 and name CA )
(resid 106 and name C ) (resid 107 and name N ) 1.0 -42.4 20.0 2
! 107 Q -64.593 -41.492 3.601 3.700 0.078 0.913 25 18 Strong
assign (resid 106 and name C ) (resid 107 and name N )
(resid 107 and name CA ) (resid 107 and name C ) 1.0 -64.6 20.0 2
assign (resid 107 and name N ) (resid 107 and name CA )
(resid 107 and name C ) (resid 108 and name N ) 1.0 -41.5 20.0 2
! 108 A -64.680 -39.370 2.493 3.609 0.076 0.899 25 18 Strong
assign (resid 107 and name C ) (resid 108 and name N )
(resid 108 and name CA ) (resid 108 and name C ) 1.0 -64.7 20.0 2
assign (resid 108 and name N ) (resid 108 and name CA )
(resid 108 and name C ) (resid 109 and name N ) 1.0 -39.4 20.0 2
! 109 L -65.955 -40.576 3.442 4.305 0.065 0.880 25 18 Strong
assign (resid 108 and name C ) (resid 109 and name N )
(resid 109 and name CA ) (resid 109 and name C ) 1.0 -66.0 20.0 2
assign (resid 109 and name N ) (resid 109 and name CA )
(resid 109 and name C ) (resid 110 and name N ) 1.0 -40.6 20.0 2
! 110 K -63.231 -39.828 4.092 4.498 0.061 0.843 25 17 Strong
assign (resid 109 and name C ) (resid 110 and name N )
(resid 110 and name CA ) (resid 110 and name C ) 1.0 -63.2 20.0 2
assign (resid 110 and name N ) (resid 110 and name CA )
(resid 110 and name C ) (resid 111 and name N ) 1.0 -39.8 20.0 2
! 111 G -66.405 -22.423 3.642 5.270 0.073 0.729 25 17 Strong
assign (resid 110 and name C ) (resid 111 and name N )
(resid 111 and name CA ) (resid 111 and name C ) 1.0 -66.4 20.0 2
assign (resid 111 and name N ) (resid 111 and name CA )
(resid 111 and name C ) (resid 112 and name N ) 1.0 -22.4 20.0 2
! 112 S -91.930 -1.503 8.110 7.550 0.099 0.676 25 14 Strong
assign (resid 111 and name C ) (resid 112 and name N )
(resid 112 and name CA ) (resid 112 and name C ) 1.0 -91.9 20.0 2
assign (resid 112 and name N ) (resid 112 and name CA )
(resid 112 and name C ) (resid 113 and name N ) 1.0 -1.5 20.0 2
! 113 G 81.715 18.030 9.943 7.379 0.111 0.652 25 15 Strong
assign (resid 112 and name C ) (resid 113 and name N )
(resid 113 and name CA ) (resid 113 and name C ) 1.0 81.7 20.0 2
assign (resid 113 and name N ) (resid 113 and name CA )
(resid 113 and name C ) (resid 114 and name N ) 1.0 18.0 20.0 2
! 114 V -71.931 133.389 8.225 7.254 0.124 0.731 25 15 Strong
assign (resid 113 and name C ) (resid 114 and name N )
(resid 114 and name CA ) (resid 114 and name C ) 1.0 -71.9 20.0 2
assign (resid 114 and name N ) (resid 114 and name CA )
(resid 114 and name C ) (resid 115 and name N ) 1.0 133.4 20.0 2
! 115 A -67.540 137.038 8.271 9.075 0.138 0.801 10 18 Generous
assign (resid 114 and name C ) (resid 115 and name N )
(resid 115 and name CA ) (resid 115 and name C ) 1.0 -67.5 30.0 2
assign (resid 115 and name N ) (resid 115 and name CA )
(resid 115 and name C ) (resid 116 and name N ) 1.0 137.0 30.0 2
! 116 V -56.398 -42.275 5.176 4.976 0.102 0.882 25 18 Strong
assign (resid 115 and name C ) (resid 116 and name N )
(resid 116 and name CA ) (resid 116 and name C ) 1.0 -56.4 20.0 2
assign (resid 116 and name N ) (resid 116 and name CA )
(resid 116 and name C ) (resid 117 and name N ) 1.0 -42.3 20.0 2
! 117 E -64.219 -37.654 3.376 5.159 0.086 0.913 25 18 Strong
assign (resid 116 and name C ) (resid 117 and name N )
(resid 117 and name CA ) (resid 117 and name C ) 1.0 -64.2 20.0 2
assign (resid 117 and name N ) (resid 117 and name CA )
(resid 117 and name C ) (resid 118 and name N ) 1.0 -37.7 20.0 2
! 118 D -68.169 -40.174 3.643 3.539 0.073 0.923 25 18 Strong
assign (resid 117 and name C ) (resid 118 and name N )
(resid 118 and name CA ) (resid 118 and name C ) 1.0 -68.2 20.0 2
assign (resid 118 and name N ) (resid 118 and name CA )
(resid 118 and name C ) (resid 119 and name N ) 1.0 -40.2 20.0 2
! 119 I -65.774 -42.181 2.646 4.410 0.065 0.917 25 18 Strong
assign (resid 118 and name C ) (resid 119 and name N )
(resid 119 and name CA ) (resid 119 and name C ) 1.0 -65.8 20.0 2
assign (resid 119 and name N ) (resid 119 and name CA )
(resid 119 and name C ) (resid 120 and name N ) 1.0 -42.2 20.0 2
! 120 K -63.641 -40.904 2.905 3.981 0.067 0.902 25 18 Strong
assign (resid 119 and name C ) (resid 120 and name N )
(resid 120 and name CA ) (resid 120 and name C ) 1.0 -63.6 20.0 2
assign (resid 120 and name N ) (resid 120 and name CA )
(resid 120 and name C ) (resid 121 and name N ) 1.0 -40.9 20.0 2
! 121 K -63.679 -41.020 3.827 4.775 0.075 0.889 25 18 Strong
assign (resid 120 and name C ) (resid 121 and name N )
(resid 121 and name CA ) (resid 121 and name C ) 1.0 -63.7 20.0 2
assign (resid 121 and name N ) (resid 121 and name CA )
(resid 121 and name C ) (resid 122 and name N ) 1.0 -41.0 20.0 2
! 122 F -65.230 -44.008 4.211 5.771 0.092 0.882 25 18 Strong
assign (resid 121 and name C ) (resid 122 and name N )
(resid 122 and name CA ) (resid 122 and name C ) 1.0 -65.2 20.0 2
assign (resid 122 and name N ) (resid 122 and name CA )
(resid 122 and name C ) (resid 123 and name N ) 1.0 -44.0 20.0 2
! 123 M -66.854 -33.122 2.880 5.106 0.150 0.885 25 18 Strong
assign (resid 122 and name C ) (resid 123 and name N )
(resid 123 and name CA ) (resid 123 and name C ) 1.0 -66.9 20.0 2
assign (resid 123 and name N ) (resid 123 and name CA )
(resid 123 and name C ) (resid 124 and name N ) 1.0 -33.1 20.0 2
! 124 E -67.526 -39.096 3.700 4.196 0.167 0.898 25 18 Strong
assign (resid 123 and name C ) (resid 124 and name N )
(resid 124 and name CA ) (resid 124 and name C ) 1.0 -67.5 20.0 2
assign (resid 124 and name N ) (resid 124 and name CA )
(resid 124 and name C ) (resid 125 and name N ) 1.0 -39.1 20.0 2
! 125 E -68.321 -37.027 5.141 7.363 0.211 0.909 25 18 Strong
assign (resid 124 and name C ) (resid 125 and name N )
(resid 125 and name CA ) (resid 125 and name C ) 1.0 -68.3 20.0 2
assign (resid 125 and name N ) (resid 125 and name CA )
(resid 125 and name C ) (resid 126 and name N ) 1.0 -37.0 20.0 2
! 126 A -58.738 -45.340 6.325 5.620 0.257 0.921 25 16 Strong
assign (resid 125 and name C ) (resid 126 and name N )
(resid 126 and name CA ) (resid 126 and name C ) 1.0 -58.7 20.0 2
assign (resid 126 and name N ) (resid 126 and name CA )
(resid 126 and name C ) (resid 127 and name N ) 1.0 -45.3 20.0 2
! 127 P -60.397 -36.583 4.948 7.161 0.220 0.912 25 16 Strong
assign (resid 126 and name C ) (resid 127 and name N )
(resid 127 and name CA ) (resid 127 and name C ) 1.0 -60.4 20.0 2
assign (resid 127 and name N ) (resid 127 and name CA )
(resid 127 and name C ) (resid 128 and name N ) 1.0 -36.6 20.0 2
! 128 T -65.482 -40.636 2.833 4.957 0.184 0.904 25 16 Strong
assign (resid 127 and name C ) (resid 128 and name N )
(resid 128 and name CA ) (resid 128 and name C ) 1.0 -65.5 20.0 2
assign (resid 128 and name N ) (resid 128 and name CA )
(resid 128 and name C ) (resid 129 and name N ) 1.0 -40.6 20.0 2
! 129 F -67.638 -37.613 4.194 5.048 0.190 0.894 25 18 Strong
assign (resid 128 and name C ) (resid 129 and name N )
(resid 129 and name CA ) (resid 129 and name C ) 1.0 -67.6 20.0 2
assign (resid 129 and name N ) (resid 129 and name CA )
(resid 129 and name C ) (resid 130 and name N ) 1.0 -37.6 20.0 2
! 130 V -63.672 -43.480 3.585 3.736 0.145 0.902 25 18 Strong
assign (resid 129 and name C ) (resid 130 and name N )
(resid 130 and name CA ) (resid 130 and name C ) 1.0 -63.7 20.0 2
assign (resid 130 and name N ) (resid 130 and name CA )
(resid 130 and name C ) (resid 131 and name N ) 1.0 -43.5 20.0 2
! 131 K -65.834 -40.179 2.519 3.452 0.145 0.910 25 18 Strong
assign (resid 130 and name C ) (resid 131 and name N )
(resid 131 and name CA ) (resid 131 and name C ) 1.0 -65.8 20.0 2
assign (resid 131 and name N ) (resid 131 and name CA )
(resid 131 and name C ) (resid 132 and name N ) 1.0 -40.2 20.0 2
! 132 W -63.135 -43.153 2.940 2.770 0.144 0.921 25 18 Strong
assign (resid 131 and name C ) (resid 132 and name N )
(resid 132 and name CA ) (resid 132 and name C ) 1.0 -63.1 20.0 2
assign (resid 132 and name N ) (resid 132 and name CA )
(resid 132 and name C ) (resid 133 and name N ) 1.0 -43.2 20.0 2
! 133 L -63.286 -44.716 3.171 4.748 0.136 0.926 25 18 Strong
assign (resid 132 and name C ) (resid 133 and name N )
(resid 133 and name CA ) (resid 133 and name C ) 1.0 -63.3 20.0 2
assign (resid 133 and name N ) (resid 133 and name CA )
(resid 133 and name C ) (resid 134 and name N ) 1.0 -44.7 20.0 2
! 134 V -62.126 -41.459 4.731 3.815 0.169 0.920 25 18 Strong
assign (resid 133 and name C ) (resid 134 and name N )
(resid 134 and name CA ) (resid 134 and name C ) 1.0 -62.1 20.0 2
assign (resid 134 and name N ) (resid 134 and name CA )
(resid 134 and name C ) (resid 135 and name N ) 1.0 -41.5 20.0 2
! 135 D -68.542 -29.984 4.764 5.542 0.195 0.911 25 18 Strong
assign (resid 134 and name C ) (resid 135 and name N )
(resid 135 and name CA ) (resid 135 and name C ) 1.0 -68.5 20.0 2
assign (resid 135 and name N ) (resid 135 and name CA )
(resid 135 and name C ) (resid 136 and name N ) 1.0 -30.0 20.0 2
! 136 K -96.211 -0.012 17.588 21.355 0.271 0.903 25 18 Strong
assign (resid 135 and name C ) (resid 136 and name N )
(resid 136 and name CA ) (resid 136 and name C ) 1.0 -96.2 35.2 2
assign (resid 136 and name N ) (resid 136 and name CA )
(resid 136 and name C ) (resid 137 and name N ) 1.0 -0.0 42.7 2
! 137 Y -54.607 -44.236 6.312 5.668 0.326 0.903 25 18 Strong
assign (resid 136 and name C ) (resid 137 and name N )
(resid 137 and name CA ) (resid 137 and name C ) 1.0 -54.6 20.0 2
assign (resid 137 and name N ) (resid 137 and name CA )
(resid 137 and name C ) (resid 138 and name N ) 1.0 -44.2 20.0 2
! 138 D -68.701 -17.479 4.571 8.349 0.328 0.900 25 18 Strong
assign (resid 137 and name C ) (resid 138 and name N )
(resid 138 and name CA ) (resid 138 and name C ) 1.0 -68.7 20.0 2
assign (resid 138 and name N ) (resid 138 and name CA )
(resid 138 and name C ) (resid 139 and name N ) 1.0 -17.5 20.0 2
! 139 D -95.599 -2.520 9.466 10.034 0.394 0.869 25 18 Strong
assign (resid 138 and name C ) (resid 139 and name N )
(resid 139 and name CA ) (resid 139 and name C ) 1.0 -95.6 20.0 2
assign (resid 139 and name N ) (resid 139 and name CA )
(resid 139 and name C ) (resid 140 and name N ) 1.0 -2.5 20.1 2
! 140 L -107.837 142.015 11.460 10.557 0.383 0.844 25 18 Strong
assign (resid 139 and name C ) (resid 140 and name N )
(resid 140 and name CA ) (resid 140 and name C ) 1.0 -107.8 22.9 2
assign (resid 140 and name N ) (resid 140 and name CA )
(resid 140 and name C ) (resid 141 and name N ) 1.0 142.0 21.1 2
! 141 E -131.705 149.303 13.065 10.401 0.390 0.810 25 18 Strong
assign (resid 140 and name C ) (resid 141 and name N )
(resid 141 and name CA ) (resid 141 and name C ) 1.0 -131.7 26.1 2
assign (resid 141 and name N ) (resid 141 and name CA )
(resid 141 and name C ) (resid 142 and name N ) 1.0 149.3 20.8 2
! 142 F -118.068 131.217 14.213 9.691 0.495 0.814 25 18 Strong
assign (resid 141 and name C ) (resid 142 and name N )
(resid 142 and name CA ) (resid 142 and name C ) 1.0 -118.1 28.4 2
assign (resid 142 and name N ) (resid 142 and name CA )
(resid 142 and name C ) (resid 143 and name N ) 1.0 131.2 20.0 2
! 143 F -117.210 141.340 15.724 13.836 0.391 0.805 25 18 Strong
assign (resid 142 and name C ) (resid 143 and name N )
(resid 143 and name CA ) (resid 143 and name C ) 1.0 -117.2 31.4 2
assign (resid 143 and name N ) (resid 143 and name CA )
(resid 143 and name C ) (resid 144 and name N ) 1.0 141.3 27.7 2
! 144 M -130.294 149.229 15.932 10.966 0.319 0.820 25 18 Strong
assign (resid 143 and name C ) (resid 144 and name N )
(resid 144 and name CA ) (resid 144 and name C ) 1.0 -130.3 31.9 2
assign (resid 144 and name N ) (resid 144 and name CA )
(resid 144 and name C ) (resid 145 and name N ) 1.0 149.2 21.9 2
! 145 S -68.115 154.750 6.238 8.571 0.357 0.819 25 18 Strong
assign (resid 144 and name C ) (resid 145 and name N )
(resid 145 and name CA ) (resid 145 and name C ) 1.0 -68.1 20.0 2
assign (resid 145 and name N ) (resid 145 and name CA )
(resid 145 and name C ) (resid 146 and name N ) 1.0 154.8 20.0 2
! 146 K -57.172 -35.773 5.532 7.629 0.524 0.845 25 18 Strong
assign (resid 145 and name C ) (resid 146 and name N )
(resid 146 and name CA ) (resid 146 and name C ) 1.0 -57.2 20.0 2
assign (resid 146 and name N ) (resid 146 and name CA )
(resid 146 and name C ) (resid 147 and name N ) 1.0 -35.8 20.0 2
! 147 S -67.858 -24.003 4.799 9.896 0.618 0.857 25 18 Strong
assign (resid 146 and name C ) (resid 147 and name N )
(resid 147 and name CA ) (resid 147 and name C ) 1.0 -67.9 20.0 2
assign (resid 147 and name N ) (resid 147 and name CA )
(resid 147 and name C ) (resid 148 and name N ) 1.0 -24.0 20.0 2
! 149 N -105.578 129.144 34.854 35.279 0.569 0.828 25 16 Strong
assign (resid 148 and name C ) (resid 149 and name N )
(resid 149 and name CA ) (resid 149 and name C ) 1.0 -105.6 69.7 2
assign (resid 149 and name N ) (resid 149 and name CA )
(resid 149 and name C ) (resid 150 and name N ) 1.0 129.1 70.0 2
! 150 P -63.704 -21.911 7.092 9.543 0.791 0.822 25 16 Strong
assign (resid 149 and name C ) (resid 150 and name N )
(resid 150 and name CA ) (resid 150 and name C ) 1.0 -63.7 20.0 2
assign (resid 150 and name N ) (resid 150 and name CA )
(resid 150 and name C ) (resid 151 and name N ) 1.0 -21.9 20.0 2
! 151 D -90.362 -6.202 12.070 16.119 0.750 0.833 25 16 Strong
assign (resid 150 and name C ) (resid 151 and name N )
(resid 151 and name CA ) (resid 151 and name C ) 1.0 -90.4 24.1 2
assign (resid 151 and name N ) (resid 151 and name CA )
(resid 151 and name C ) (resid 152 and name N ) 1.0 -6.2 32.2 2
! 153 G 74.472 22.027 5.610 6.317 0.495 0.873 25 17 Strong
assign (resid 152 and name C ) (resid 153 and name N )
(resid 153 and name CA ) (resid 153 and name C ) 1.0 74.5 20.0 2
assign (resid 153 and name N ) (resid 153 and name CA )
(resid 153 and name C ) (resid 154 and name N ) 1.0 22.0 20.0 2
! 154 L -106.580 133.184 11.430 10.089 0.497 0.873 25 17 Strong
assign (resid 153 and name C ) (resid 154 and name N )
(resid 154 and name CA ) (resid 154 and name C ) 1.0 -106.6 22.9 2
assign (resid 154 and name N ) (resid 154 and name CA )
(resid 154 and name C ) (resid 155 and name N ) 1.0 133.2 20.2 2
! 155 I -87.166 129.464 12.522 7.399 0.475 0.866 25 18 Strong
assign (resid 154 and name C ) (resid 155 and name N )
(resid 155 and name CA ) (resid 155 and name C ) 1.0 -87.2 25.0 2
assign (resid 155 and name N ) (resid 155 and name CA )
(resid 155 and name C ) (resid 156 and name N ) 1.0 129.5 20.0 2
! 156 F -107.808 132.673 7.567 9.372 0.354 0.886 25 18 Strong
assign (resid 155 and name C ) (resid 156 and name N )
(resid 156 and name CA ) (resid 156 and name C ) 1.0 -107.8 20.0 2
assign (resid 156 and name N ) (resid 156 and name CA )
(resid 156 and name C ) (resid 157 and name N ) 1.0 132.7 20.0 2
! 157 S -129.329 150.223 7.915 6.549 0.263 0.900 25 18 Strong
assign (resid 156 and name C ) (resid 157 and name N )
(resid 157 and name CA ) (resid 157 and name C ) 1.0 -129.3 20.0 2
assign (resid 157 and name N ) (resid 157 and name CA )
(resid 157 and name C ) (resid 158 and name N ) 1.0 150.2 20.0 2
! 158 Y -148.066 158.364 10.994 9.049 0.270 0.888 25 18 Strong
assign (resid 157 and name C ) (resid 158 and name N )
(resid 158 and name CA ) (resid 158 and name C ) 1.0 -148.1 22.0 2
assign (resid 158 and name N ) (resid 158 and name CA )
(resid 158 and name C ) (resid 159 and name N ) 1.0 158.4 20.0 2
! 159 Y -93.048 136.343 19.158 17.000 0.369 0.842 25 18 Strong
assign (resid 158 and name C ) (resid 159 and name N )
(resid 159 and name CA ) (resid 159 and name C ) 1.0 -93.0 38.3 2
assign (resid 159 and name N ) (resid 159 and name CA )
(resid 159 and name C ) (resid 160 and name N ) 1.0 136.3 34.0 2
! 160 K -68.998 146.220 7.957 12.858 0.332 0.767 10 18 Generous
assign (resid 159 and name C ) (resid 160 and name N )
(resid 160 and name CA ) (resid 160 and name C ) 1.0 -69.0 30.0 2
assign (resid 160 and name N ) (resid 160 and name CA )
(resid 160 and name C ) (resid 161 and name N ) 1.0 146.2 38.6 2
! 161 E -58.304 133.601 5.938 9.192 0.397 0.727 10 14 Generous
assign (resid 160 and name C ) (resid 161 and name N )
(resid 161 and name CA ) (resid 161 and name C ) 1.0 -58.3 30.0 2
assign (resid 161 and name N ) (resid 161 and name CA )
(resid 161 and name C ) (resid 162 and name N ) 1.0 133.6 30.0 2
! 162 G 86.281 0.331 5.761 10.479 0.393 0.664 25 13 Strong
assign (resid 161 and name C ) (resid 162 and name N )
(resid 162 and name CA ) (resid 162 and name C ) 1.0 86.3 20.0 2
assign (resid 162 and name N ) (resid 162 and name CA )
(resid 162 and name C ) (resid 163 and name N ) 1.0 0.3 21.0 2
! 163 A -75.832 148.475 11.419 11.564 0.577 0.660 25 10 Strong
assign (resid 162 and name C ) (resid 163 and name N )
(resid 163 and name CA ) (resid 163 and name C ) 1.0 -75.8 22.8 2
assign (resid 163 and name N ) (resid 163 and name CA )
(resid 163 and name C ) (resid 164 and name N ) 1.0 148.5 23.1 2
! 165 C -106.182 147.732 37.290 17.764 0.849 0.759 25 12 Strong
assign (resid 164 and name C ) (resid 165 and name N )
(resid 165 and name CA ) (resid 165 and name C ) 1.0 -106.2 70.0 2
assign (resid 165 and name N ) (resid 165 and name CA )
(resid 165 and name C ) (resid 166 and name N ) 1.0 147.7 35.5 2
! 166 P -66.204 140.751 13.174 10.604 0.604 0.829 25 15 Strong
assign (resid 165 and name C ) (resid 166 and name N )
(resid 166 and name CA ) (resid 166 and name C ) 1.0 -66.2 26.3 2
assign (resid 166 and name N ) (resid 166 and name CA )
(resid 166 and name C ) (resid 167 and name N ) 1.0 140.8 21.2 2
! 167 T -106.965 130.184 19.079 11.104 0.495 0.871 25 16 Strong
assign (resid 166 and name C ) (resid 167 and name N )
(resid 167 and name CA ) (resid 167 and name C ) 1.0 -107.0 38.2 2
assign (resid 167 and name N ) (resid 167 and name CA )
(resid 167 and name C ) (resid 168 and name N ) 1.0 130.2 22.2 2
! 168 F -111.582 128.681 14.442 9.310 0.357 0.886 25 18 Strong
assign (resid 167 and name C ) (resid 168 and name N )
(resid 168 and name CA ) (resid 168 and name C ) 1.0 -111.6 28.9 2
assign (resid 168 and name N ) (resid 168 and name CA )
(resid 168 and name C ) (resid 169 and name N ) 1.0 128.7 20.0 2
! 169 V -120.310 128.212 8.917 8.913 0.331 0.867 25 18 Strong
assign (resid 168 and name C ) (resid 169 and name N )
(resid 169 and name CA ) (resid 169 and name C ) 1.0 -120.3 20.0 2
assign (resid 169 and name N ) (resid 169 and name CA )
(resid 169 and name C ) (resid 170 and name N ) 1.0 128.2 20.0 2
! 170 Y -119.080 142.547 8.630 12.273 0.314 0.854 25 18 Strong
assign (resid 169 and name C ) (resid 170 and name N )
(resid 170 and name CA ) (resid 170 and name C ) 1.0 -119.1 20.0 2
assign (resid 170 and name N ) (resid 170 and name CA )
(resid 170 and name C ) (resid 171 and name N ) 1.0 142.5 24.5 2
! 171 V -73.258 129.499 13.229 19.557 0.360 0.839 25 18 Strong
assign (resid 170 and name C ) (resid 171 and name N )
(resid 171 and name CA ) (resid 171 and name C ) 1.0 -73.3 26.5 2
assign (resid 171 and name N ) (resid 171 and name CA )
(resid 171 and name C ) (resid 172 and name N ) 1.0 129.5 39.1 2
! 172 K -54.346 -36.163 5.094 7.375 0.540 0.856 25 18 Strong
assign (resid 171 and name C ) (resid 172 and name N )
(resid 172 and name CA ) (resid 172 and name C ) 1.0 -54.3 20.0 2
assign (resid 172 and name N ) (resid 172 and name CA )
(resid 172 and name C ) (resid 173 and name N ) 1.0 -36.2 20.0 2
! 173 S -68.946 -16.069 4.351 6.812 0.545 0.852 25 17 Strong
assign (resid 172 and name C ) (resid 173 and name N )
(resid 173 and name CA ) (resid 173 and name C ) 1.0 -68.9 20.0 2
assign (resid 173 and name N ) (resid 173 and name CA )
(resid 173 and name C ) (resid 174 and name N ) 1.0 -16.1 20.0 2
! 175 Y -123.444 149.796 12.438 10.758 0.437 0.819 25 17 Strong
assign (resid 174 and name C ) (resid 175 and name N )
(resid 175 and name CA ) (resid 175 and name C ) 1.0 -123.4 24.9 2
assign (resid 175 and name N ) (resid 175 and name CA )
(resid 175 and name C ) (resid 176 and name N ) 1.0 149.8 21.5 2
! 176 K -112.721 127.924 13.478 13.772 0.309 0.801 25 18 Strong
assign (resid 175 and name C ) (resid 176 and name N )
(resid 176 and name CA ) (resid 176 and name C ) 1.0 -112.7 27.0 2
assign (resid 176 and name N ) (resid 176 and name CA )
(resid 176 and name C ) (resid 177 and name N ) 1.0 127.9 27.5 2
! 177 V -94.003 125.875 11.880 11.030 0.270 0.764 25 18 Strong
assign (resid 176 and name C ) (resid 177 and name N )
(resid 177 and name CA ) (resid 177 and name C ) 1.0 -94.0 23.8 2
assign (resid 177 and name N ) (resid 177 and name CA )
(resid 177 and name C ) (resid 178 and name N ) 1.0 125.9 22.1 2
! 178 V -112.775 129.276 11.638 9.363 0.249 0.762 25 18 Strong
assign (resid 177 and name C ) (resid 178 and name N )
(resid 178 and name CA ) (resid 178 and name C ) 1.0 -112.8 23.3 2
assign (resid 178 and name N ) (resid 178 and name CA )
(resid 178 and name C ) (resid 179 and name N ) 1.0 129.3 20.0 2
! 179 K -88.769 128.255 11.602 9.175 0.270 0.735 25 18 Strong
assign (resid 178 and name C ) (resid 179 and name N )
(resid 179 and name CA ) (resid 179 and name C ) 1.0 -88.8 23.2 2
assign (resid 179 and name N ) (resid 179 and name CA )
(resid 179 and name C ) (resid 180 and name N ) 1.0 128.3 20.0 2
! 180 F -95.600 132.538 12.421 14.479 0.364 0.739 25 12 Strong
assign (resid 179 and name C ) (resid 180 and name N )
(resid 180 and name CA ) (resid 180 and name C ) 1.0 -95.6 24.8 2
assign (resid 180 and name N ) (resid 180 and name CA )
(resid 180 and name C ) (resid 181 and name N ) 1.0 132.5 29.0 2
! 187 H -67.337 145.093 13.831 17.987 7.934 0.838 10 10 Generous
assign (resid 186 and name C ) (resid 187 and name N )
(resid 187 and name CA ) (resid 187 and name C ) 1.0 -67.3 41.5 2
assign (resid 187 and name N ) (resid 187 and name CA )
(resid 187 and name C ) (resid 188 and name N ) 1.0 145.1 54.0 2
! 2 I 16 0.855 0.048 0.097 g- -56.3 7.0
assign (resid 2 and name N ) (resid 2 and name CA )
(resid 2 and name CB ) (resid 2 and name CG1 ) 1.0 -56.3 20.0 2
! 4 Y 18 0.709 0.051 0.241 g- -60.5 6.5
assign (resid 4 and name N ) (resid 4 and name CA )
(resid 4 and name CB ) (resid 4 and name CG ) 1.0 -60.5 20.0 2
! 6 D 18 0.234 0.109 0.657 t -174.2 9.2
assign (resid 6 and name N ) (resid 6 and name CA )
(resid 6 and name CB ) (resid 6 and name CG ) 1.0 -174.2 20.0 2
! 8 I 18 0.803 0.152 0.046 g- -58.5 6.9
assign (resid 8 and name N ) (resid 8 and name CA )
(resid 8 and name CB ) (resid 8 and name CG1 ) 1.0 -58.5 20.0 2
! 9 S 17 0.085 0.829 0.085 g+ 68.1 6.7
assign (resid 9 and name N ) (resid 9 and name CA )
(resid 9 and name CB ) (resid 9 and name OG ) 1.0 68.1 20.0 2
! 12 E 18 0.720 0.088 0.192 g- -61.6 14.5
assign (resid 12 and name N ) (resid 12 and name CA )
(resid 12 and name CB ) (resid 12 and name CG ) 1.0 -61.6 29.0 2
! 13 V 18 0.620 0.062 0.318 g- -61.0 4.7
assign (resid 13 and name N ) (resid 13 and name CA )
(resid 13 and name CB ) (resid 13 and name CG1 ) 1.0 -61.0 20.0 2
! 15 S 18 0.295 0.606 0.099 g+ 62.7 10.3
assign (resid 15 and name N ) (resid 15 and name CA )
(resid 15 and name CB ) (resid 15 and name OG ) 1.0 62.7 20.6 2
! 18 L 18 0.840 0.080 0.080 g- -64.0 9.8
assign (resid 18 and name N ) (resid 18 and name CA )
(resid 18 and name CB ) (resid 18 and name CG ) 1.0 -64.0 20.0 2
! 20 I 18 0.886 0.050 0.064 g- -63.2 6.7
assign (resid 20 and name N ) (resid 20 and name CA )
(resid 20 and name CB ) (resid 20 and name CG1 ) 1.0 -63.2 20.0 2
! 23 V 16 0.053 0.113 0.834 t -177.8 5.2
assign (resid 23 and name N ) (resid 23 and name CA )
(resid 23 and name CB ) (resid 23 and name CG1 ) 1.0 -177.8 20.0 2
! 24 M 18 0.767 0.116 0.116 g- -61.2 5.2
assign (resid 24 and name N ) (resid 24 and name CA )
(resid 24 and name CB ) (resid 24 and name CG ) 1.0 -61.2 20.0 2
! 25 E 12 0.613 0.066 0.321 g- -65.4 12.4
assign (resid 25 and name N ) (resid 25 and name CA )
(resid 25 and name CB ) (resid 25 and name CG ) 1.0 -65.4 24.8 2
! 30 V 16 0.059 0.059 0.882 t 175.2 7.3
assign (resid 30 and name N ) (resid 30 and name CA )
(resid 30 and name CB ) (resid 30 and name CG1 ) 1.0 175.2 20.0 2
! 33 L 17 0.766 0.047 0.187 g- -64.6 9.9
assign (resid 33 and name N ) (resid 33 and name CA )
(resid 33 and name CB ) (resid 33 and name CG ) 1.0 -64.6 20.0 2
! 34 F 18 0.165 0.808 0.027 g+ 65.4 4.9
assign (resid 34 and name N ) (resid 34 and name CA )
(resid 34 and name CB ) (resid 34 and name CG ) 1.0 65.4 20.0 2
! 36 V 18 0.234 0.153 0.613 t -177.5 6.3
assign (resid 36 and name N ) (resid 36 and name CA )
(resid 36 and name CB ) (resid 36 and name CG1 ) 1.0 -177.5 20.0 2
! 40 M 18 0.606 0.157 0.237 g- -60.6 9.4
assign (resid 40 and name N ) (resid 40 and name CA )
(resid 40 and name CB ) (resid 40 and name CG ) 1.0 -60.6 20.0 2
! 41 V 18 0.667 0.167 0.167 g- -59.5 7.6
assign (resid 41 and name N ) (resid 41 and name CA )
(resid 41 and name CB ) (resid 41 and name CG1 ) 1.0 -59.5 20.0 2
! 43 V 17 0.165 0.104 0.731 t -176.8 6.6
assign (resid 43 and name N ) (resid 43 and name CA )
(resid 43 and name CB ) (resid 43 and name CG1 ) 1.0 -176.8 20.0 2
! 47 D 16 0.633 0.058 0.309 g- -73.0 9.8
assign (resid 47 and name N ) (resid 47 and name CA )
(resid 47 and name CB ) (resid 47 and name CG ) 1.0 -73.0 20.0 2
! 48 I 18 0.776 0.172 0.052 g- -61.8 6.9
assign (resid 48 and name N ) (resid 48 and name CA )
(resid 48 and name CB ) (resid 48 and name CG1 ) 1.0 -61.8 20.0 2
! 50 I 17 0.688 0.229 0.083 g- -55.3 9.0
assign (resid 50 and name N ) (resid 50 and name CA )
(resid 50 and name CB ) (resid 50 and name CG1 ) 1.0 -55.3 20.0 2
! 56 F 8 0.692 0.142 0.167 g- -64.4 11.9
assign (resid 56 and name N ) (resid 56 and name CA )
(resid 56 and name CB ) (resid 56 and name CG ) 1.0 -64.4 23.8 2
! 70 Q 18 0.651 0.079 0.270 g- -70.7 18.5
assign (resid 70 and name N ) (resid 70 and name CA )
(resid 70 and name CB ) (resid 70 and name CG ) 1.0 -70.7 37.0 2
! 71 K 18 0.659 0.138 0.203 g- -65.7 9.9
assign (resid 71 and name N ) (resid 71 and name CA )
(resid 71 and name CB ) (resid 71 and name CG ) 1.0 -65.7 20.0 2
! 73 N 18 0.358 0.038 0.605 t -174.7 8.1
assign (resid 73 and name N ) (resid 73 and name CA )
(resid 73 and name CB ) (resid 73 and name CG ) 1.0 -174.7 20.0 2
! 75 V 18 0.213 0.139 0.649 t -178.8 15.0
assign (resid 75 and name N ) (resid 75 and name CA )
(resid 75 and name CB ) (resid 75 and name CG1 ) 1.0 -178.8 30.0 2
! 76 S 17 0.130 0.632 0.239 g+ 61.4 11.0
assign (resid 76 and name N ) (resid 76 and name CA )
(resid 76 and name CB ) (resid 76 and name OG ) 1.0 61.4 22.0 2
! 83 Y 18 0.796 0.171 0.034 g- -58.1 9.4
assign (resid 83 and name N ) (resid 83 and name CA )
(resid 83 and name CB ) (resid 83 and name CG ) 1.0 -58.1 20.0 2
! 84 T 18 0.677 0.231 0.092 g- -55.7 12.5
assign (resid 84 and name N ) (resid 84 and name CA )
(resid 84 and name CB ) (resid 84 and name OG1 ) 1.0 -55.7 25.0 2
! 86 M 16 0.767 0.116 0.116 g- -60.2 9.1
assign (resid 86 and name N ) (resid 86 and name CA )
(resid 86 and name CB ) (resid 86 and name CG ) 1.0 -60.2 20.0 2
! 88 F 14 0.772 0.027 0.200 g- -65.3 12.3
assign (resid 88 and name N ) (resid 88 and name CA )
(resid 88 and name CB ) (resid 88 and name CG ) 1.0 -65.3 24.6 2
! 89 S 16 0.252 0.612 0.137 g+ 61.8 11.5
assign (resid 89 and name N ) (resid 89 and name CA )
(resid 89 and name CB ) (resid 89 and name OG ) 1.0 61.8 23.0 2
! 94 F 18 0.107 0.028 0.864 t 177.8 8.2
assign (resid 94 and name N ) (resid 94 and name CA )
(resid 94 and name CB ) (resid 94 and name CG ) 1.0 177.8 20.0 2
! 98 V 18 0.118 0.055 0.827 t 175.2 6.5
assign (resid 98 and name N ) (resid 98 and name CA )
(resid 98 and name CB ) (resid 98 and name CG1 ) 1.0 175.2 20.0 2
! 100 D 18 0.690 0.063 0.246 g- -73.7 5.4
assign (resid 100 and name N ) (resid 100 and name CA )
(resid 100 and name CB ) (resid 100 and name CG ) 1.0 -73.7 20.0 2
! 101 Y 18 0.246 0.031 0.724 t 176.0 7.4
assign (resid 101 and name N ) (resid 101 and name CA )
(resid 101 and name CB ) (resid 101 and name CG ) 1.0 176.0 20.0 2
! 102 V 18 0.072 0.072 0.856 t 177.4 8.0
assign (resid 102 and name N ) (resid 102 and name CA )
(resid 102 and name CB ) (resid 102 and name CG1 ) 1.0 177.4 20.0 2
! 104 N 18 0.712 0.044 0.244 g- -78.6 11.7
assign (resid 104 and name N ) (resid 104 and name CA )
(resid 104 and name CB ) (resid 104 and name CG ) 1.0 -78.6 23.4 2
! 105 V 18 0.072 0.072 0.856 t 173.8 7.1
assign (resid 105 and name N ) (resid 105 and name CA )
(resid 105 and name CB ) (resid 105 and name CG1 ) 1.0 173.8 20.0 2
! 107 Q 18 0.629 0.110 0.261 g- -66.5 10.1
assign (resid 107 and name N ) (resid 107 and name CA )
(resid 107 and name CB ) (resid 107 and name CG ) 1.0 -66.5 20.2 2
! 109 L 18 0.692 0.045 0.263 g- -70.3 5.2
assign (resid 109 and name N ) (resid 109 and name CA )
(resid 109 and name CB ) (resid 109 and name CG ) 1.0 -70.3 20.0 2
! 112 S 14 0.252 0.612 0.137 g+ 67.6 8.1
assign (resid 112 and name N ) (resid 112 and name CA )
(resid 112 and name CB ) (resid 112 and name OG ) 1.0 67.6 20.0 2
! 114 V 15 0.113 0.053 0.834 t 178.9 5.7
assign (resid 114 and name N ) (resid 114 and name CA )
(resid 114 and name CB ) (resid 114 and name CG1 ) 1.0 178.9 20.0 2
! 116 V 18 0.111 0.111 0.778 t 176.5 5.6
assign (resid 116 and name N ) (resid 116 and name CA )
(resid 116 and name CB ) (resid 116 and name CG1 ) 1.0 176.5 20.0 2
! 118 D 18 0.829 0.076 0.095 g- -72.9 5.5
assign (resid 118 and name N ) (resid 118 and name CA )
(resid 118 and name CB ) (resid 118 and name CG ) 1.0 -72.9 20.0 2
! 119 I 18 0.898 0.051 0.051 g- -67.1 6.5
assign (resid 119 and name N ) (resid 119 and name CA )
(resid 119 and name CB ) (resid 119 and name CG1 ) 1.0 -67.1 20.0 2
! 122 F 18 0.285 0.023 0.692 t -178.9 7.3
assign (resid 122 and name N ) (resid 122 and name CA )
(resid 122 and name CB ) (resid 122 and name CG ) 1.0 -178.9 20.0 2
! 123 M 18 0.665 0.075 0.260 g- -65.2 9.4
assign (resid 123 and name N ) (resid 123 and name CA )
(resid 123 and name CB ) (resid 123 and name CG ) 1.0 -65.2 20.0 2
! 125 E 18 0.613 0.066 0.321 g- -66.7 9.5
assign (resid 125 and name N ) (resid 125 and name CA )
(resid 125 and name CB ) (resid 125 and name CG ) 1.0 -66.7 20.0 2
! 128 T 16 0.784 0.173 0.043 g- -62.9 9.7
assign (resid 128 and name N ) (resid 128 and name CA )
(resid 128 and name CB ) (resid 128 and name OG1 ) 1.0 -62.9 20.0 2
! 129 F 18 0.772 0.027 0.200 g- -70.7 10.1
assign (resid 129 and name N ) (resid 129 and name CA )
(resid 129 and name CB ) (resid 129 and name CG ) 1.0 -70.7 20.2 2
! 130 V 18 0.055 0.073 0.872 t 175.9 6.1
assign (resid 130 and name N ) (resid 130 and name CA )
(resid 130 and name CB ) (resid 130 and name CG1 ) 1.0 175.9 20.0 2
! 132 W 18 0.192 0.054 0.754 t 179.0 11.5
assign (resid 132 and name N ) (resid 132 and name CA )
(resid 132 and name CB ) (resid 132 and name CG ) 1.0 179.0 23.0 2
! 134 V 18 0.113 0.053 0.834 t 178.9 5.2
assign (resid 134 and name N ) (resid 134 and name CA )
(resid 134 and name CB ) (resid 134 and name CG1 ) 1.0 178.9 20.0 2
! 135 D 18 0.829 0.076 0.095 g- -70.9 4.7
assign (resid 135 and name N ) (resid 135 and name CA )
(resid 135 and name CB ) (resid 135 and name CG ) 1.0 -70.9 20.0 2
! 137 Y 18 0.246 0.031 0.724 t -177.7 8.8
assign (resid 137 and name N ) (resid 137 and name CA )
(resid 137 and name CB ) (resid 137 and name CG ) 1.0 -177.7 20.0 2
! 138 D 18 0.655 0.172 0.172 g- -67.9 8.6
assign (resid 138 and name N ) (resid 138 and name CA )
(resid 138 and name CB ) (resid 138 and name CG ) 1.0 -67.9 20.0 2
! 139 D 18 0.657 0.109 0.234 g- -65.3 5.2
assign (resid 139 and name N ) (resid 139 and name CA )
(resid 139 and name CB ) (resid 139 and name CG ) 1.0 -65.3 20.0 2
! 140 L 18 0.766 0.047 0.187 g- -63.0 5.4
assign (resid 140 and name N ) (resid 140 and name CA )
(resid 140 and name CB ) (resid 140 and name CG ) 1.0 -63.0 20.0 2
! 142 F 18 0.840 0.104 0.055 g- -63.6 9.0
assign (resid 142 and name N ) (resid 142 and name CA )
(resid 142 and name CB ) (resid 142 and name CG ) 1.0 -63.6 20.0 2
! 143 F 18 0.785 0.189 0.026 g- -60.7 10.0
assign (resid 143 and name N ) (resid 143 and name CA )
(resid 143 and name CB ) (resid 143 and name CG ) 1.0 -60.7 20.0 2
! 144 M 18 0.619 0.190 0.190 g- -62.0 11.8
assign (resid 144 and name N ) (resid 144 and name CA )
(resid 144 and name CB ) (resid 144 and name CG ) 1.0 -62.0 23.6 2
! 145 S 18 0.137 0.612 0.252 g+ 71.9 12.7
assign (resid 145 and name N ) (resid 145 and name CA )
(resid 145 and name CB ) (resid 145 and name OG ) 1.0 71.9 25.4 2
! 147 S 18 0.158 0.685 0.158 g+ 62.9 11.5
assign (resid 147 and name N ) (resid 147 and name CA )
(resid 147 and name CB ) (resid 147 and name OG ) 1.0 62.9 23.0 2
! 148 M 18 0.666 0.101 0.233 g- -60.1 11.0
assign (resid 148 and name N ) (resid 148 and name CA )
(resid 148 and name CB ) (resid 148 and name CG ) 1.0 -60.1 22.0 2
! 151 D 16 0.609 0.160 0.230 g- -67.7 9.7
assign (resid 151 and name N ) (resid 151 and name CA )
(resid 151 and name CB ) (resid 151 and name CG ) 1.0 -67.7 20.0 2
! 155 I 18 0.873 0.063 0.063 g- -61.9 8.2
assign (resid 155 and name N ) (resid 155 and name CA )
(resid 155 and name CB ) (resid 155 and name CG1 ) 1.0 -61.9 20.0 2
! 156 F 18 0.753 0.154 0.093 g- -67.4 9.3
assign (resid 156 and name N ) (resid 156 and name CA )
(resid 156 and name CB ) (resid 156 and name CG ) 1.0 -67.4 20.0 2
! 158 Y 18 0.241 0.709 0.051 g+ 67.0 6.5
assign (resid 158 and name N ) (resid 158 and name CA )
(resid 158 and name CB ) (resid 158 and name CG ) 1.0 67.0 20.0 2
! 159 Y 18 0.796 0.034 0.171 g- -63.4 9.7
assign (resid 159 and name N ) (resid 159 and name CA )
(resid 159 and name CB ) (resid 159 and name CG ) 1.0 -63.4 20.0 2
! 164 H 13 0.622 0.281 0.097 g- -66.7 8.7
assign (resid 164 and name N ) (resid 164 and name CA )
(resid 164 and name CB ) (resid 164 and name CG ) 1.0 -66.7 20.0 2
! 167 T 16 0.787 0.106 0.106 g- -57.9 7.5
assign (resid 167 and name N ) (resid 167 and name CA )
(resid 167 and name CB ) (resid 167 and name OG1 ) 1.0 -57.9 20.0 2
! 168 F 18 0.787 0.052 0.161 g- -65.8 8.5
assign (resid 168 and name N ) (resid 168 and name CA )
(resid 168 and name CB ) (resid 168 and name CG ) 1.0 -65.8 20.0 2
! 169 V 18 0.107 0.107 0.787 t -173.4 4.9
assign (resid 169 and name N ) (resid 169 and name CA )
(resid 169 and name CB ) (resid 169 and name CG1 ) 1.0 -173.4 20.0 2
! 170 Y 18 0.748 0.161 0.091 g- -64.0 11.9
assign (resid 170 and name N ) (resid 170 and name CA )
(resid 170 and name CB ) (resid 170 and name CG ) 1.0 -64.0 23.8 2
! 171 V 18 0.150 0.150 0.701 t -174.1 10.0
assign (resid 171 and name N ) (resid 171 and name CA )
(resid 171 and name CB ) (resid 171 and name CG1 ) 1.0 -174.1 20.0 2
! 175 Y 17 0.777 0.056 0.167 g- -67.9 12.0
assign (resid 175 and name N ) (resid 175 and name CA )
(resid 175 and name CB ) (resid 175 and name CG ) 1.0 -67.9 24.0 2
! 177 V 18 0.072 0.072 0.856 t -178.6 5.6
assign (resid 177 and name N ) (resid 177 and name CA )
(resid 177 and name CB ) (resid 177 and name CG1 ) 1.0 -178.6 20.0 2
! 178 V 18 0.072 0.072 0.856 t -175.7 8.0
assign (resid 178 and name N ) (resid 178 and name CA )
(resid 178 and name CB ) (resid 178 and name CG1 ) 1.0 -175.7 20.0 2
! 180 F 12 0.677 0.045 0.279 g- -64.8 10.1
assign (resid 180 and name N ) (resid 180 and name CA )
(resid 180 and name CB ) (resid 180 and name CG ) 1.0 -64.8 20.2 2
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