NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
639026 |
6a4c   |
cing | 1-original | 2 | XPLOR/CNS | dihedral angle |
# Restraints file 2: talos.tbl
! 22 V -87.342 134.139 17.691 11.769 0.309 0.674 25 18 Strong
assign (resid 21 and name C ) (resid 22 and name N )
(resid 22 and name CA ) (resid 22 and name C ) 1.0 -87.3 35.4 2
assign (resid 22 and name N ) (resid 22 and name CA )
(resid 22 and name C ) (resid 23 and name N ) 1.0 134.1 23.5 2
! 23 K -97.239 134.997 15.472 9.422 0.347 0.758 25 18 Strong
assign (resid 22 and name C ) (resid 23 and name N )
(resid 23 and name CA ) (resid 23 and name C ) 1.0 -97.2 30.9 2
assign (resid 23 and name N ) (resid 23 and name CA )
(resid 23 and name C ) (resid 24 and name N ) 1.0 135.0 20.0 2
! 24 Y -129.789 145.784 9.263 10.453 0.343 0.829 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 -129.8 20.0 2
assign (resid 24 and name N ) (resid 24 and name CA )
(resid 24 and name C ) (resid 25 and name N ) 1.0 145.8 20.9 2
! 25 F -121.525 130.306 12.222 10.284 0.338 0.833 25 18 Strong
assign (resid 24 and name C ) (resid 25 and name N )
(resid 25 and name CA ) (resid 25 and name C ) 1.0 -121.5 24.4 2
assign (resid 25 and name N ) (resid 25 and name CA )
(resid 25 and name C ) (resid 26 and name N ) 1.0 130.3 20.6 2
! 26 V -80.891 125.088 11.579 10.271 0.376 0.845 25 18 Strong
assign (resid 25 and name C ) (resid 26 and name N )
(resid 26 and name CA ) (resid 26 and name C ) 1.0 -80.9 23.2 2
assign (resid 26 and name N ) (resid 26 and name CA )
(resid 26 and name C ) (resid 27 and name N ) 1.0 125.1 20.5 2
! 27 F -113.311 128.698 10.472 9.070 0.481 0.846 25 18 Strong
assign (resid 26 and name C ) (resid 27 and name N )
(resid 27 and name CA ) (resid 27 and name C ) 1.0 -113.3 20.9 2
assign (resid 27 and name N ) (resid 27 and name CA )
(resid 27 and name C ) (resid 28 and name N ) 1.0 128.7 20.0 2
! 28 K -127.271 140.094 11.395 12.114 0.500 0.856 25 18 Strong
assign (resid 27 and name C ) (resid 28 and name N )
(resid 28 and name CA ) (resid 28 and name C ) 1.0 -127.3 22.8 2
assign (resid 28 and name N ) (resid 28 and name CA )
(resid 28 and name C ) (resid 29 and name N ) 1.0 140.1 24.2 2
! 29 V -81.364 130.164 16.319 11.672 0.551 0.814 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 -81.4 32.6 2
assign (resid 29 and name N ) (resid 29 and name CA )
(resid 29 and name C ) (resid 30 and name N ) 1.0 130.2 23.3 2
! 30 M -76.534 132.446 20.172 10.312 0.654 0.800 25 18 Strong
assign (resid 29 and name C ) (resid 30 and name N )
(resid 30 and name CA ) (resid 30 and name C ) 1.0 -76.5 40.3 2
!assign (resid 30 and name N ) (resid 30 and name CA )
! (resid 30 and name C ) (resid 31 and name N ) 1.0 132.4 20.6 2
! 31 A -99.846 145.450 33.402 15.788 0.827 0.785 25 18 Strong
!assign (resid 30 and name C ) (resid 31 and name N )
! (resid 31 and name CA ) (resid 31 and name C ) 1.0 -99.8 66.8 2
assign (resid 31 and name N ) (resid 31 and name CA )
(resid 31 and name C ) (resid 32 and name N ) 1.0 145.4 31.6 2
! 33 E -68.638 -21.574 7.880 7.223 0.894 0.773 25 16 Strong
assign (resid 32 and name C ) (resid 33 and name N )
(resid 33 and name CA ) (resid 33 and name C ) 1.0 -68.6 20.0 2
assign (resid 33 and name N ) (resid 33 and name CA )
(resid 33 and name C ) (resid 34 and name N ) 1.0 -21.6 20.0 2
! 34 A -87.167 -4.811 4.878 6.198 0.683 0.665 10 15 Generous
assign (resid 33 and name C ) (resid 34 and name N )
(resid 34 and name CA ) (resid 34 and name C ) 1.0 -87.2 30.0 2
assign (resid 34 and name N ) (resid 34 and name CA )
(resid 34 and name C ) (resid 35 and name N ) 1.0 -4.8 30.0 2
! 35 G 92.264 4.766 10.072 12.367 0.536 0.616 10 11 Generous
assign (resid 34 and name C ) (resid 35 and name N )
(resid 35 and name CA ) (resid 35 and name C ) 1.0 92.3 30.2 2
!assign (resid 35 and name N ) (resid 35 and name CA )
! (resid 35 and name C ) (resid 36 and name N ) 1.0 4.8 37.1 2
! 36 Y -74.842 143.750 6.978 10.873 0.478 0.604 25 9 Strong
assign (resid 35 and name C ) (resid 36 and name N )
(resid 36 and name CA ) (resid 36 and name C ) 1.0 -74.8 20.0 2
assign (resid 36 and name N ) (resid 36 and name CA )
(resid 36 and name C ) (resid 37 and name N ) 1.0 143.8 21.7 2
! 37 I -88.901 127.546 13.723 12.581 0.537 0.765 25 10 Strong
assign (resid 36 and name C ) (resid 37 and name N )
(resid 37 and name CA ) (resid 37 and name C ) 1.0 -88.9 27.4 2
assign (resid 37 and name N ) (resid 37 and name CA )
(resid 37 and name C ) (resid 38 and name N ) 1.0 127.5 25.2 2
! 39 K -133.762 153.539 16.058 11.149 0.433 0.797 25 17 Strong
assign (resid 38 and name C ) (resid 39 and name N )
(resid 39 and name CA ) (resid 39 and name C ) 1.0 -133.8 32.1 2
assign (resid 39 and name N ) (resid 39 and name CA )
(resid 39 and name C ) (resid 40 and name N ) 1.0 153.5 22.3 2
! 40 L -69.583 139.442 10.579 11.808 0.428 0.742 25 14 Strong
assign (resid 39 and name C ) (resid 40 and name N )
(resid 40 and name CA ) (resid 40 and name C ) 1.0 -69.6 21.2 2
assign (resid 40 and name N ) (resid 40 and name CA )
(resid 40 and name C ) (resid 41 and name N ) 1.0 139.4 23.6 2
! 41 P -58.343 145.683 5.467 7.380 0.326 0.697 25 11 Strong
assign (resid 40 and name C ) (resid 41 and name N )
(resid 41 and name CA ) (resid 41 and name C ) 1.0 -58.3 20.0 2
assign (resid 41 and name N ) (resid 41 and name CA )
(resid 41 and name C ) (resid 42 and name N ) 1.0 145.7 20.0 2
! 42 N -57.960 133.444 4.985 6.191 0.238 0.685 25 9 Strong
assign (resid 41 and name C ) (resid 42 and name N )
(resid 42 and name CA ) (resid 42 and name C ) 1.0 -58.0 20.0 2
assign (resid 42 and name N ) (resid 42 and name CA )
(resid 42 and name C ) (resid 43 and name N ) 1.0 133.4 20.0 2
! 43 G 91.030 -6.557 7.038 8.839 0.229 0.709 25 12 Strong
assign (resid 42 and name C ) (resid 43 and name N )
(resid 43 and name CA ) (resid 43 and name C ) 1.0 91.0 20.0 2
assign (resid 43 and name N ) (resid 43 and name CA )
(resid 43 and name C ) (resid 44 and name N ) 1.0 -6.6 20.0 2
! 44 S -64.996 137.370 10.067 11.113 0.487 0.750 25 13 Strong
assign (resid 43 and name C ) (resid 44 and name N )
(resid 44 and name CA ) (resid 44 and name C ) 1.0 -65.0 20.1 2
assign (resid 44 and name N ) (resid 44 and name CA )
(resid 44 and name C ) (resid 45 and name N ) 1.0 137.4 22.2 2
! 45 P -61.744 144.150 6.646 6.829 0.420 0.791 25 16 Strong
assign (resid 44 and name C ) (resid 45 and name N )
(resid 45 and name CA ) (resid 45 and name C ) 1.0 -61.7 20.0 2
assign (resid 45 and name N ) (resid 45 and name CA )
(resid 45 and name C ) (resid 46 and name N ) 1.0 144.2 20.0 2
! 47 D -58.135 -38.940 4.554 5.510 0.209 0.883 25 18 Strong
assign (resid 46 and name C ) (resid 47 and name N )
(resid 47 and name CA ) (resid 47 and name C ) 1.0 -58.1 20.0 2
assign (resid 47 and name N ) (resid 47 and name CA )
(resid 47 and name C ) (resid 48 and name N ) 1.0 -38.9 20.0 2
! 48 W -65.722 -36.877 4.935 8.125 0.245 0.890 25 18 Strong
assign (resid 47 and name C ) (resid 48 and name N )
(resid 48 and name CA ) (resid 48 and name C ) 1.0 -65.7 20.0 2
assign (resid 48 and name N ) (resid 48 and name CA )
(resid 48 and name C ) (resid 49 and name N ) 1.0 -36.9 20.0 2
! 49 K -66.790 -32.791 6.506 7.689 0.207 0.883 25 18 Strong
assign (resid 48 and name C ) (resid 49 and name N )
(resid 49 and name CA ) (resid 49 and name C ) 1.0 -66.8 20.0 2
assign (resid 49 and name N ) (resid 49 and name CA )
(resid 49 and name C ) (resid 50 and name N ) 1.0 -32.8 20.0 2
! 50 F -66.203 -31.152 5.871 6.929 0.259 0.866 25 18 Strong
assign (resid 49 and name C ) (resid 50 and name N )
(resid 50 and name CA ) (resid 50 and name C ) 1.0 -66.2 20.0 2
assign (resid 50 and name N ) (resid 50 and name CA )
(resid 50 and name C ) (resid 51 and name N ) 1.0 -31.2 20.0 2
! 51 H -107.754 11.731 8.928 13.374 0.344 0.834 25 18 Strong
assign (resid 50 and name C ) (resid 51 and name N )
(resid 51 and name CA ) (resid 51 and name C ) 1.0 -107.8 20.0 2
assign (resid 51 and name N ) (resid 51 and name CA )
(resid 51 and name C ) (resid 52 and name N ) 1.0 11.7 26.7 2
! 52 E -62.535 135.098 7.852 9.414 0.340 0.830 10 17 Generous
assign (resid 51 and name C ) (resid 52 and name N )
(resid 52 and name CA ) (resid 52 and name C ) 1.0 -62.5 30.0 2
assign (resid 52 and name N ) (resid 52 and name CA )
(resid 52 and name C ) (resid 53 and name N ) 1.0 135.1 30.0 2
! 53 G 78.224 11.473 8.136 9.289 0.443 0.821 25 17 Strong
assign (resid 52 and name C ) (resid 53 and name N )
(resid 53 and name CA ) (resid 53 and name C ) 1.0 78.2 20.0 2
assign (resid 53 and name N ) (resid 53 and name CA )
(resid 53 and name C ) (resid 54 and name N ) 1.0 11.5 20.0 2
! 54 I -120.771 152.380 11.891 10.630 0.700 0.846 25 17 Strong
assign (resid 53 and name C ) (resid 54 and name N )
(resid 54 and name CA ) (resid 54 and name C ) 1.0 -120.8 23.8 2
assign (resid 54 and name N ) (resid 54 and name CA )
(resid 54 and name C ) (resid 55 and name N ) 1.0 152.4 21.3 2
! 55 S -73.582 133.269 12.105 13.044 0.552 0.851 25 18 Strong
assign (resid 54 and name C ) (resid 55 and name N )
(resid 55 and name CA ) (resid 55 and name C ) 1.0 -73.6 24.2 2
assign (resid 55 and name N ) (resid 55 and name CA )
(resid 55 and name C ) (resid 56 and name N ) 1.0 133.3 26.1 2
! 57 A -54.868 -38.273 5.548 6.425 0.428 0.867 25 18 Strong
assign (resid 56 and name C ) (resid 57 and name N )
(resid 57 and name CA ) (resid 57 and name C ) 1.0 -54.9 20.0 2
assign (resid 57 and name N ) (resid 57 and name CA )
(resid 57 and name C ) (resid 58 and name N ) 1.0 -38.3 20.0 2
! 58 K -67.924 -19.143 5.590 7.631 0.313 0.827 25 18 Strong
assign (resid 57 and name C ) (resid 58 and name N )
(resid 58 and name CA ) (resid 58 and name C ) 1.0 -67.9 20.0 2
assign (resid 58 and name N ) (resid 58 and name CA )
(resid 58 and name C ) (resid 59 and name N ) 1.0 -19.1 20.0 2
! 59 D -95.995 -1.084 7.417 7.988 0.333 0.776 25 18 Strong
assign (resid 58 and name C ) (resid 59 and name N )
(resid 59 and name CA ) (resid 59 and name C ) 1.0 -96.0 20.0 2
assign (resid 59 and name N ) (resid 59 and name CA )
(resid 59 and name C ) (resid 60 and name N ) 1.0 -1.1 20.0 2
! 60 F -80.532 134.708 17.027 10.989 0.321 0.720 25 16 Strong
assign (resid 59 and name C ) (resid 60 and name N )
(resid 60 and name CA ) (resid 60 and name C ) 1.0 -80.5 34.1 2
assign (resid 60 and name N ) (resid 60 and name CA )
(resid 60 and name C ) (resid 61 and name N ) 1.0 134.7 22.0 2
! 61 P -64.918 144.340 5.154 6.274 0.355 0.708 25 16 Strong
assign (resid 60 and name C ) (resid 61 and name N )
(resid 61 and name CA ) (resid 61 and name C ) 1.0 -64.9 20.0 2
assign (resid 61 and name N ) (resid 61 and name CA )
(resid 61 and name C ) (resid 62 and name N ) 1.0 144.3 20.0 2
! 62 V -72.275 128.935 14.242 10.412 0.399 0.685 25 15 Strong
assign (resid 61 and name C ) (resid 62 and name N )
(resid 62 and name CA ) (resid 62 and name C ) 1.0 -72.3 28.5 2
assign (resid 62 and name N ) (resid 62 and name CA )
(resid 62 and name C ) (resid 63 and name N ) 1.0 128.9 20.8 2
! 63 G 88.971 -7.417 12.115 10.188 0.385 0.722 10 16 Generous
assign (resid 62 and name C ) (resid 63 and name N )
(resid 63 and name CA ) (resid 63 and name C ) 1.0 89.0 36.3 2
assign (resid 63 and name N ) (resid 63 and name CA )
(resid 63 and name C ) (resid 64 and name N ) 1.0 -7.4 30.6 2
! 64 G -81.000 168.356 15.142 14.667 0.378 0.774 10 16 Generous
assign (resid 63 and name C ) (resid 64 and name N )
(resid 64 and name CA ) (resid 64 and name C ) 1.0 -81.0 45.4 2
assign (resid 64 and name N ) (resid 64 and name CA )
(resid 64 and name C ) (resid 65 and name N ) 1.0 168.4 44.0 2
! 65 E -124.215 148.468 14.830 8.930 0.410 0.870 25 17 Strong
assign (resid 64 and name C ) (resid 65 and name N )
(resid 65 and name CA ) (resid 65 and name C ) 1.0 -124.2 29.7 2
assign (resid 65 and name N ) (resid 65 and name CA )
(resid 65 and name C ) (resid 66 and name N ) 1.0 148.5 20.0 2
! 66 V -131.124 156.811 6.369 7.520 0.410 0.911 25 18 Strong
assign (resid 65 and name C ) (resid 66 and name N )
(resid 66 and name CA ) (resid 66 and name C ) 1.0 -131.1 20.0 2
assign (resid 66 and name N ) (resid 66 and name CA )
(resid 66 and name C ) (resid 67 and name N ) 1.0 156.8 20.0 2
! 67 S -126.499 146.021 19.750 12.442 0.535 0.894 25 17 Strong
assign (resid 66 and name C ) (resid 67 and name N )
(resid 67 and name CA ) (resid 67 and name C ) 1.0 -126.5 39.5 2
assign (resid 67 and name N ) (resid 67 and name CA )
(resid 67 and name C ) (resid 68 and name N ) 1.0 146.0 24.9 2
! 68 F -83.977 135.078 11.031 14.236 0.553 0.815 25 15 Strong
assign (resid 67 and name C ) (resid 68 and name N )
(resid 68 and name CA ) (resid 68 and name C ) 1.0 -84.0 22.1 2
assign (resid 68 and name N ) (resid 68 and name CA )
(resid 68 and name C ) (resid 69 and name N ) 1.0 135.1 28.5 2
! 69 S -66.483 145.030 10.020 12.373 0.646 0.722 10 13 Generous
assign (resid 68 and name C ) (resid 69 and name N )
(resid 69 and name CA ) (resid 69 and name C ) 1.0 -66.5 30.1 2
assign (resid 69 and name N ) (resid 69 and name CA )
(resid 69 and name C ) (resid 70 and name N ) 1.0 145.0 37.1 2
! 70 K -65.376 -24.023 7.569 7.712 0.541 0.679 25 13 Strong
assign (resid 69 and name C ) (resid 70 and name N )
(resid 70 and name CA ) (resid 70 and name C ) 1.0 -65.4 20.0 2
!assign (resid 70 and name N ) (resid 70 and name CA )
! (resid 70 and name C ) (resid 71 and name N ) 1.0 -24.0 20.0 2
! 71 N -82.723 -5.848 11.802 15.734 0.471 0.664 25 9 Strong
assign (resid 70 and name C ) (resid 71 and name N )
(resid 71 and name CA ) (resid 71 and name C ) 1.0 -82.7 23.6 2
assign (resid 71 and name N ) (resid 71 and name CA )
(resid 71 and name C ) (resid 72 and name N ) 1.0 -5.8 31.5 2
! 77 N -73.340 138.047 8.244 10.115 0.659 0.771 25 18 Strong
assign (resid 76 and name C ) (resid 77 and name N )
(resid 77 and name CA ) (resid 77 and name C ) 1.0 -73.3 20.0 2
!assign (resid 77 and name N ) (resid 77 and name CA )
! (resid 77 and name C ) (resid 78 and name N ) 1.0 138.0 20.2 2
! 78 L -111.157 130.203 11.448 8.603 0.731 0.819 25 18 Strong
assign (resid 77 and name C ) (resid 78 and name N )
(resid 78 and name CA ) (resid 78 and name C ) 1.0 -111.2 22.9 2
assign (resid 78 and name N ) (resid 78 and name CA )
(resid 78 and name C ) (resid 79 and name N ) 1.0 130.2 20.0 2
! 79 Y -124.379 143.889 12.453 15.298 0.825 0.851 25 18 Strong
assign (resid 78 and name C ) (resid 79 and name N )
(resid 79 and name CA ) (resid 79 and name C ) 1.0 -124.4 24.9 2
!assign (resid 79 and name N ) (resid 79 and name CA )
! (resid 79 and name C ) (resid 80 and name N ) 1.0 143.9 30.6 2
! 81 F -125.047 146.721 17.849 13.951 1.034 0.890 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 -125.0 35.7 2
assign (resid 81 and name N ) (resid 81 and name CA )
(resid 81 and name C ) (resid 82 and name N ) 1.0 146.7 27.9 2
! 82 Q -112.059 128.213 15.513 14.472 1.149 0.866 25 16 Strong
assign (resid 81 and name C ) (resid 82 and name N )
(resid 82 and name CA ) (resid 82 and name C ) 1.0 -112.1 31.0 2
assign (resid 82 and name N ) (resid 82 and name CA )
(resid 82 and name C ) (resid 83 and name N ) 1.0 128.2 28.9 2
! 84 N -132.164 149.021 15.638 16.208 1.131 0.806 25 16 Strong
assign (resid 83 and name C ) (resid 84 and name N )
(resid 84 and name CA ) (resid 84 and name C ) 1.0 -132.2 31.3 2
assign (resid 84 and name N ) (resid 84 and name CA )
(resid 84 and name C ) (resid 85 and name N ) 1.0 149.0 32.4 2
! 85 I -83.822 129.873 20.779 18.560 2.020 0.801 10 18 Generous
!assign (resid 84 and name C ) (resid 85 and name N )
! (resid 85 and name CA ) (resid 85 and name C ) 1.0 -83.8 62.3 2
!assign (resid 85 and name N ) (resid 85 and name CA )
! (resid 85 and name C ) (resid 86 and name N ) 1.0 129.9 55.7 2
! 88 N -101.943 145.091 17.379 13.960 0.657 0.862 25 18 Strong
assign (resid 87 and name C ) (resid 88 and name N )
(resid 88 and name CA ) (resid 88 and name C ) 1.0 -101.9 34.8 2
assign (resid 88 and name N ) (resid 88 and name CA )
(resid 88 and name C ) (resid 89 and name N ) 1.0 145.1 27.9 2
! 89 L -102.632 121.371 10.015 7.731 0.744 0.885 25 18 Strong
assign (resid 88 and name C ) (resid 89 and name N )
(resid 89 and name CA ) (resid 89 and name C ) 1.0 -102.6 20.0 2
assign (resid 89 and name N ) (resid 89 and name CA )
(resid 89 and name C ) (resid 90 and name N ) 1.0 121.4 20.0 2
! 90 L -106.401 121.755 10.824 7.645 0.707 0.906 25 18 Strong
assign (resid 89 and name C ) (resid 90 and name N )
(resid 90 and name CA ) (resid 90 and name C ) 1.0 -106.4 21.6 2
assign (resid 90 and name N ) (resid 90 and name CA )
(resid 90 and name C ) (resid 91 and name N ) 1.0 121.8 20.0 2
! 91 V -118.887 134.195 10.579 9.307 0.674 0.914 25 18 Strong
assign (resid 90 and name C ) (resid 91 and name N )
(resid 91 and name CA ) (resid 91 and name C ) 1.0 -118.9 21.2 2
assign (resid 91 and name N ) (resid 91 and name CA )
(resid 91 and name C ) (resid 92 and name N ) 1.0 134.2 20.0 2
! 92 S -76.801 148.877 30.294 15.989 0.848 0.907 25 17 Strong
assign (resid 91 and name C ) (resid 92 and name N )
(resid 92 and name CA ) (resid 92 and name C ) 1.0 -76.8 60.6 2
assign (resid 92 and name N ) (resid 92 and name CA )
(resid 92 and name C ) (resid 93 and name N ) 1.0 148.9 32.0 2
! 94 R -65.354 -37.995 4.383 6.152 0.323 0.870 25 17 Strong
assign (resid 93 and name C ) (resid 94 and name N )
(resid 94 and name CA ) (resid 94 and name C ) 1.0 -65.4 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 -38.0 20.0 2
! 95 A -66.856 -42.065 7.505 4.647 0.229 0.870 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 -66.9 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 -42.1 20.0 2
! 96 R -64.261 -40.554 2.470 3.214 0.109 0.882 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 -64.3 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 -40.6 20.0 2
! 97 K -64.737 -41.175 3.075 5.351 0.090 0.898 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 -64.7 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 -41.2 20.0 2
! 98 L -66.330 -41.254 4.263 4.609 0.092 0.908 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 -66.3 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 -41.3 20.0 2
! 99 I -62.926 -43.631 2.572 2.532 0.100 0.911 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 -62.9 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 -43.6 20.0 2
! 100 E -64.314 -38.068 3.542 5.837 0.095 0.886 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 -64.3 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 -38.1 20.0 2
! 101 S -66.269 -28.283 3.647 6.693 0.109 0.794 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 -66.3 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 -28.3 20.0 2
! 102 L -86.726 -5.340 5.433 7.475 0.130 0.686 25 17 Strong
assign (resid 101 and name C ) (resid 102 and name N )
(resid 102 and name CA ) (resid 102 and name C ) 1.0 -86.7 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 -5.3 20.0 2
! 103 G 77.439 24.665 12.550 11.422 0.263 0.638 25 17 Strong
assign (resid 102 and name C ) (resid 103 and name N )
(resid 103 and name CA ) (resid 103 and name C ) 1.0 77.4 25.1 2
assign (resid 103 and name N ) (resid 103 and name CA )
(resid 103 and name C ) (resid 104 and name N ) 1.0 24.7 22.8 2
! 104 V -79.209 130.717 16.023 14.783 0.675 0.650 25 17 Strong
assign (resid 103 and name C ) (resid 104 and name N )
(resid 104 and name CA ) (resid 104 and name C ) 1.0 -79.2 32.0 2
assign (resid 104 and name N ) (resid 104 and name CA )
(resid 104 and name C ) (resid 105 and name N ) 1.0 130.7 29.6 2
! 106 N 59.901 33.933 7.651 16.134 0.839 0.790 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 59.9 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 33.9 32.3 2
! 107 A -81.896 140.987 20.934 12.916 0.603 0.844 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 -81.9 41.9 2
assign (resid 107 and name N ) (resid 107 and name CA )
(resid 107 and name C ) (resid 108 and name N ) 1.0 141.0 25.8 2
! 108 E -97.336 126.392 18.750 9.561 0.500 0.864 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 -97.3 37.5 2
assign (resid 108 and name N ) (resid 108 and name CA )
(resid 108 and name C ) (resid 109 and name N ) 1.0 126.4 20.0 2
! 109 W -110.949 127.956 14.906 15.363 0.654 0.869 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 -110.9 29.8 2
assign (resid 109 and name N ) (resid 109 and name CA )
(resid 109 and name C ) (resid 110 and name N ) 1.0 128.0 30.7 2
! 110 L -113.235 102.225 17.171 17.549 0.441 0.877 25 16 Strong
assign (resid 109 and name C ) (resid 110 and name N )
(resid 110 and name CA ) (resid 110 and name C ) 1.0 -113.2 34.3 2
assign (resid 110 and name N ) (resid 110 and name CA )
(resid 110 and name C ) (resid 111 and name N ) 1.0 102.2 35.1 2
! 111 P -64.595 137.782 5.437 7.699 0.407 0.889 25 16 Strong
assign (resid 110 and name C ) (resid 111 and name N )
(resid 111 and name CA ) (resid 111 and name C ) 1.0 -64.6 20.0 2
assign (resid 111 and name N ) (resid 111 and name CA )
(resid 111 and name C ) (resid 112 and name N ) 1.0 137.8 20.0 2
! 112 V -137.988 154.252 10.987 11.291 0.383 0.900 25 16 Strong
assign (resid 111 and name C ) (resid 112 and name N )
(resid 112 and name CA ) (resid 112 and name C ) 1.0 -138.0 22.0 2
assign (resid 112 and name N ) (resid 112 and name CA )
(resid 112 and name C ) (resid 113 and name N ) 1.0 154.3 22.6 2
! 113 A -118.794 140.795 13.573 11.787 0.482 0.901 25 18 Strong
assign (resid 112 and name C ) (resid 113 and name N )
(resid 113 and name CA ) (resid 113 and name C ) 1.0 -118.8 27.1 2
assign (resid 113 and name N ) (resid 113 and name CA )
(resid 113 and name C ) (resid 114 and name N ) 1.0 140.8 23.6 2
! 114 I -97.277 123.655 11.449 7.565 0.320 0.896 25 18 Strong
assign (resid 113 and name C ) (resid 114 and name N )
(resid 114 and name CA ) (resid 114 and name C ) 1.0 -97.3 22.9 2
assign (resid 114 and name N ) (resid 114 and name CA )
(resid 114 and name C ) (resid 115 and name N ) 1.0 123.7 20.0 2
! 115 K -117.861 146.036 12.095 12.103 0.286 0.908 25 18 Strong
assign (resid 114 and name C ) (resid 115 and name N )
(resid 115 and name CA ) (resid 115 and name C ) 1.0 -117.9 24.2 2
assign (resid 115 and name N ) (resid 115 and name CA )
(resid 115 and name C ) (resid 116 and name N ) 1.0 146.0 24.2 2
! 116 D -84.421 179.178 6.374 7.922 0.209 0.915 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 -84.4 20.0 2
assign (resid 116 and name N ) (resid 116 and name CA )
(resid 116 and name C ) (resid 117 and name N ) 1.0 179.2 20.0 2
! 117 H -62.367 -23.137 6.645 8.778 0.221 0.895 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 -62.4 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 -23.1 20.0 2
! 118 Q -89.904 1.068 6.888 6.607 0.151 0.772 25 17 Strong
assign (resid 117 and name C ) (resid 118 and name N )
(resid 118 and name CA ) (resid 118 and name C ) 1.0 -89.9 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 1.1 20.0 2
! 119 G 82.869 9.814 6.407 5.458 0.149 0.706 25 17 Strong
assign (resid 118 and name C ) (resid 119 and name N )
(resid 119 and name CA ) (resid 119 and name C ) 1.0 82.9 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 9.8 20.0 2
! 120 K -81.329 140.997 11.734 9.372 0.270 0.689 25 17 Strong
assign (resid 119 and name C ) (resid 120 and name N )
(resid 120 and name CA ) (resid 120 and name C ) 1.0 -81.3 23.5 2
assign (resid 120 and name N ) (resid 120 and name CA )
(resid 120 and name C ) (resid 121 and name N ) 1.0 141.0 20.0 2
! 124 P -63.873 -21.606 4.459 6.355 0.649 0.764 25 15 Strong
assign (resid 123 and name C ) (resid 124 and name N )
(resid 124 and name CA ) (resid 124 and name C ) 1.0 -63.9 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 -21.6 20.0 2
! 125 D -96.634 7.624 8.701 10.908 0.542 0.771 25 16 Strong
assign (resid 124 and name C ) (resid 125 and name N )
(resid 125 and name CA ) (resid 125 and name C ) 1.0 -96.6 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 7.6 21.8 2
! 126 Y -92.466 146.608 26.215 10.628 0.672 0.800 25 18 Strong
assign (resid 125 and name C ) (resid 126 and name N )
(resid 126 and name CA ) (resid 126 and name C ) 1.0 -92.5 52.4 2
assign (resid 126 and name N ) (resid 126 and name CA )
(resid 126 and name C ) (resid 127 and name N ) 1.0 146.6 21.3 2
! 127 A -116.959 139.386 25.137 15.700 0.555 0.862 25 18 Strong
assign (resid 126 and name C ) (resid 127 and name N )
(resid 127 and name CA ) (resid 127 and name C ) 1.0 -117.0 50.3 2
assign (resid 127 and name N ) (resid 127 and name CA )
(resid 127 and name C ) (resid 128 and name N ) 1.0 139.4 31.4 2
! 128 F -100.140 125.722 9.087 8.303 0.540 0.884 25 18 Strong
assign (resid 127 and name C ) (resid 128 and name N )
(resid 128 and name CA ) (resid 128 and name C ) 1.0 -100.1 20.0 2
assign (resid 128 and name N ) (resid 128 and name CA )
(resid 128 and name C ) (resid 129 and name N ) 1.0 125.7 20.0 2
! 129 L -105.235 117.975 7.361 11.346 0.463 0.880 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 -105.2 20.0 2
assign (resid 129 and name N ) (resid 129 and name CA )
(resid 129 and name C ) (resid 130 and name N ) 1.0 118.0 22.7 2
! 130 N -103.359 120.599 9.655 8.911 0.446 0.865 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 -103.4 20.0 2
assign (resid 130 and name N ) (resid 130 and name CA )
(resid 130 and name C ) (resid 131 and name N ) 1.0 120.6 20.0 2
! 131 L -88.482 116.362 14.306 13.569 0.448 0.804 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 -88.5 28.6 2
assign (resid 131 and name N ) (resid 131 and name CA )
(resid 131 and name C ) (resid 132 and name N ) 1.0 116.4 27.1 2
! 132 L -76.320 130.066 22.146 14.133 0.569 0.785 10 17 Generous
assign (resid 131 and name C ) (resid 132 and name N )
(resid 132 and name CA ) (resid 132 and name C ) 1.0 -76.3 66.4 2
assign (resid 132 and name N ) (resid 132 and name CA )
(resid 132 and name C ) (resid 133 and name N ) 1.0 130.1 42.4 2
! 133 G 88.855 4.251 11.079 12.074 0.699 0.792 25 17 Strong
assign (resid 132 and name C ) (resid 133 and name N )
(resid 133 and name CA ) (resid 133 and name C ) 1.0 88.9 22.2 2
assign (resid 133 and name N ) (resid 133 and name CA )
(resid 133 and name C ) (resid 134 and name N ) 1.0 4.3 24.1 2
! 134 A -107.098 153.232 34.928 9.792 1.146 0.850 25 17 Strong
assign (resid 133 and name C ) (resid 134 and name N )
(resid 134 and name CA ) (resid 134 and name C ) 1.0 -107.1 69.9 2
assign (resid 134 and name N ) (resid 134 and name CA )
(resid 134 and name C ) (resid 135 and name N ) 1.0 153.2 20.0 2
! 135 E -104.101 134.723 21.570 17.051 1.553 0.882 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 -104.1 43.1 2
assign (resid 135 and name N ) (resid 135 and name CA )
(resid 135 and name C ) (resid 136 and name N ) 1.0 134.7 34.1 2
! 137
!assign (resid 136 and name C ) (resid 137 and name N )
! (resid 137 and name CA ) (resid 137 and name C ) 1.0 -120.0 60.0 2
! 138 I -74.184 132.813 15.830 8.686 0.738 0.840 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 -74.2 31.7 2
assign (resid 138 and name N ) (resid 138 and name CA )
(resid 138 and name C ) (resid 139 and name N ) 1.0 132.8 20.0 2
! 139 D -83.999 107.547 9.598 9.046 0.522 0.829 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 -84.0 20.0 2
assign (resid 139 and name N ) (resid 139 and name CA )
(resid 139 and name C ) (resid 140 and name N ) 1.0 107.5 20.0 2
! 140 M -83.093 -6.809 19.108 18.914 0.589 0.823 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 -83.1 38.2 2
assign (resid 140 and name N ) (resid 140 and name CA )
(resid 140 and name C ) (resid 141 and name N ) 1.0 -6.8 37.8 2
! 141 E -75.267 -27.324 11.725 11.242 0.529 0.827 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 -75.3 23.4 2
assign (resid 141 and name N ) (resid 141 and name CA )
(resid 141 and name C ) (resid 142 and name N ) 1.0 -27.3 22.5 2
! 142 R -92.245 -9.857 10.292 10.613 0.626 0.826 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 -92.2 20.6 2
assign (resid 142 and name N ) (resid 142 and name CA )
(resid 142 and name C ) (resid 143 and name N ) 1.0 -9.9 21.2 2
! 145 Y -125.782 150.582 21.886 13.575 0.686 0.865 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 -125.8 43.8 2
assign (resid 145 and name N ) (resid 145 and name CA )
(resid 145 and name C ) (resid 146 and name N ) 1.0 150.6 27.1 2
! 146 E -128.015 142.639 13.520 12.515 0.589 0.870 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 -128.0 27.0 2
assign (resid 146 and name N ) (resid 146 and name CA )
(resid 146 and name C ) (resid 147 and name N ) 1.0 142.6 25.0 2
! 147 M -78.312 131.160 11.040 11.004 0.582 0.862 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 -78.3 22.1 2
assign (resid 147 and name N ) (resid 147 and name CA )
(resid 147 and name C ) (resid 148 and name N ) 1.0 131.2 22.0 2
! 149 S -70.294 -22.478 9.066 11.098 0.671 0.733 10 18 Generous
assign (resid 148 and name C ) (resid 149 and name N )
(resid 149 and name CA ) (resid 149 and name C ) 1.0 -70.3 30.0 2
assign (resid 149 and name N ) (resid 149 and name CA )
(resid 149 and name C ) (resid 150 and name N ) 1.0 -22.5 33.3 2
! 152 K -65.988 -19.076 9.671 9.375 0.477 0.712 10 18 Generous
assign (resid 151 and name C ) (resid 152 and name N )
(resid 152 and name CA ) (resid 152 and name C ) 1.0 -66.0 30.0 2
assign (resid 152 and name N ) (resid 152 and name CA )
(resid 152 and name C ) (resid 153 and name N ) 1.0 -19.1 30.0 2
! 153 D -94.223 3.270 8.707 11.252 0.491 0.788 25 18 Strong
assign (resid 152 and name C ) (resid 153 and name N )
(resid 153 and name CA ) (resid 153 and name C ) 1.0 -94.2 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 3.3 22.5 2
! 154 Q -127.328 142.889 12.330 13.257 0.487 0.840 25 18 Strong
assign (resid 153 and name C ) (resid 154 and name N )
(resid 154 and name CA ) (resid 154 and name C ) 1.0 -127.3 24.7 2
assign (resid 154 and name N ) (resid 154 and name CA )
(resid 154 and name C ) (resid 155 and name N ) 1.0 142.9 26.5 2
! 155 I -64.436 134.987 9.497 9.492 0.465 0.818 25 17 Strong
assign (resid 154 and name C ) (resid 155 and name N )
(resid 155 and name CA ) (resid 155 and name C ) 1.0 -64.4 20.0 2
assign (resid 155 and name N ) (resid 155 and name CA )
(resid 155 and name C ) (resid 156 and name N ) 1.0 135.0 20.0 2
! 157 N -119.351 139.351 39.155 7.714 0.634 0.782 25 17 Strong
assign (resid 156 and name C ) (resid 157 and name N )
(resid 157 and name CA ) (resid 157 and name C ) 1.0 -119.4 70.0 2
assign (resid 157 and name N ) (resid 157 and name CA )
(resid 157 and name C ) (resid 158 and name N ) 1.0 139.4 20.0 2
! 158 I -117.040 124.696 13.653 7.651 0.716 0.803 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 -117.0 27.3 2
assign (resid 158 and name N ) (resid 158 and name CA )
(resid 158 and name C ) (resid 159 and name N ) 1.0 124.7 20.0 2
! 160 A -117.824 130.760 21.750 9.825 0.474 0.857 25 18 Strong
assign (resid 159 and name C ) (resid 160 and name N )
(resid 160 and name CA ) (resid 160 and name C ) 1.0 -117.8 43.5 2
assign (resid 160 and name N ) (resid 160 and name CA )
(resid 160 and name C ) (resid 161 and name N ) 1.0 130.8 20.0 2
! 161 L -104.890 124.165 12.922 6.728 0.429 0.876 25 18 Strong
assign (resid 160 and name C ) (resid 161 and name N )
(resid 161 and name CA ) (resid 161 and name C ) 1.0 -104.9 25.8 2
assign (resid 161 and name N ) (resid 161 and name CA )
(resid 161 and name C ) (resid 162 and name N ) 1.0 124.2 20.0 2
! 162 A -109.731 126.579 7.487 8.021 0.345 0.887 25 18 Strong
assign (resid 161 and name C ) (resid 162 and name N )
(resid 162 and name CA ) (resid 162 and name C ) 1.0 -109.7 20.0 2
assign (resid 162 and name N ) (resid 162 and name CA )
(resid 162 and name C ) (resid 163 and name N ) 1.0 126.6 20.0 2
! 163 L -109.984 133.285 6.174 12.179 0.249 0.878 25 18 Strong
!assign (resid 162 and name C ) (resid 163 and name N )
! (resid 163 and name CA ) (resid 163 and name C ) 1.0 -110.0 20.0 2
assign (resid 163 and name N ) (resid 163 and name CA )
(resid 163 and name C ) (resid 164 and name N ) 1.0 133.3 24.4 2
! 165 T -61.946 -26.532 8.253 9.778 0.292 0.834 25 18 Strong
assign (resid 164 and name C ) (resid 165 and name N )
(resid 165 and name CA ) (resid 165 and name C ) 1.0 -61.9 20.0 2
assign (resid 165 and name N ) (resid 165 and name CA )
(resid 165 and name C ) (resid 166 and name N ) 1.0 -26.5 20.0 2
! 166 S -69.138 -20.496 5.123 7.106 0.253 0.771 25 18 Strong
assign (resid 165 and name C ) (resid 166 and name N )
(resid 166 and name CA ) (resid 166 and name C ) 1.0 -69.1 20.0 2
assign (resid 166 and name N ) (resid 166 and name CA )
(resid 166 and name C ) (resid 167 and name N ) 1.0 -20.5 20.0 2
! 167 A -89.926 -10.312 11.078 9.768 0.316 0.761 25 18 Strong
assign (resid 166 and name C ) (resid 167 and name N )
(resid 167 and name CA ) (resid 167 and name C ) 1.0 -89.9 22.2 2
assign (resid 167 and name N ) (resid 167 and name CA )
(resid 167 and name C ) (resid 168 and name N ) 1.0 -10.3 20.0 2
! 168 I -70.953 133.975 7.973 7.720 0.201 0.761 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 -71.0 20.0 2
assign (resid 168 and name N ) (resid 168 and name CA )
(resid 168 and name C ) (resid 169 and name N ) 1.0 134.0 20.0 2
! 169 R -66.558 145.367 8.468 12.074 0.374 0.804 10 16 Generous
assign (resid 168 and name C ) (resid 169 and name N )
(resid 169 and name CA ) (resid 169 and name C ) 1.0 -66.6 30.0 2
assign (resid 169 and name N ) (resid 169 and name CA )
(resid 169 and name C ) (resid 170 and name N ) 1.0 145.4 36.2 2
! 170 P -60.141 -25.926 8.065 8.760 0.334 0.766 25 16 Strong
assign (resid 169 and name C ) (resid 170 and name N )
(resid 170 and name CA ) (resid 170 and name C ) 1.0 -60.1 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 -25.9 20.0 2
! 171 D -93.160 6.939 9.598 10.639 0.243 0.753 25 16 Strong
assign (resid 170 and name C ) (resid 171 and name N )
(resid 171 and name CA ) (resid 171 and name C ) 1.0 -93.2 20.0 2
assign (resid 171 and name N ) (resid 171 and name CA )
(resid 171 and name C ) (resid 172 and name N ) 1.0 6.9 21.3 2
! 172 A -68.999 130.827 7.532 7.525 0.268 0.760 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 -69.0 20.0 2
assign (resid 172 and name N ) (resid 172 and name CA )
(resid 172 and name C ) (resid 173 and name N ) 1.0 130.8 20.0 2
! 173 K -107.256 -34.906 14.338 8.543 0.328 0.826 10 18 Generous
assign (resid 172 and name C ) (resid 173 and name N )
(resid 173 and name CA ) (resid 173 and name C ) 1.0 -107.3 43.0 2
assign (resid 173 and name N ) (resid 173 and name CA )
(resid 173 and name C ) (resid 174 and name N ) 1.0 -34.9 30.0 2
! 174 M -135.796 138.527 14.562 10.262 0.591 0.880 25 18 Strong
assign (resid 173 and name C ) (resid 174 and name N )
(resid 174 and name CA ) (resid 174 and name C ) 1.0 -135.8 29.1 2
assign (resid 174 and name N ) (resid 174 and name CA )
(resid 174 and name C ) (resid 175 and name N ) 1.0 138.5 20.5 2
! 175 F -128.197 143.158 12.520 18.814 0.710 0.910 25 18 Strong
assign (resid 174 and name C ) (resid 175 and name N )
(resid 175 and name CA ) (resid 175 and name C ) 1.0 -128.2 25.0 2
assign (resid 175 and name N ) (resid 175 and name CA )
(resid 175 and name C ) (resid 176 and name N ) 1.0 143.2 37.6 2
! 176 R -122.242 138.093 14.291 13.270 0.616 0.923 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 -122.2 28.6 2
assign (resid 176 and name N ) (resid 176 and name CA )
(resid 176 and name C ) (resid 177 and name N ) 1.0 138.1 26.5 2
! 177 C -76.559 147.772 10.059 13.273 0.615 0.920 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 -76.6 20.1 2
assign (resid 177 and name N ) (resid 177 and name CA )
(resid 177 and name C ) (resid 178 and name N ) 1.0 147.8 26.5 2
! 178 T -60.516 -30.005 5.096 6.375 0.604 0.911 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 -60.5 20.0 2
assign (resid 178 and name N ) (resid 178 and name CA )
(resid 178 and name C ) (resid 179 and name N ) 1.0 -30.0 20.0 2
! 179 K -92.933 4.827 9.399 12.736 0.671 0.874 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 -92.9 20.0 2
assign (resid 179 and name N ) (resid 179 and name CA )
(resid 179 and name C ) (resid 180 and name N ) 1.0 4.8 25.5 2
! 181 R -68.864 -30.540 6.565 13.834 0.578 0.782 25 18 Strong
assign (resid 180 and name C ) (resid 181 and name N )
(resid 181 and name CA ) (resid 181 and name C ) 1.0 -68.9 20.0 2
assign (resid 181 and name N ) (resid 181 and name CA )
(resid 181 and name C ) (resid 182 and name N ) 1.0 -30.5 27.7 2
! 183 L -90.717 121.624 14.018 8.235 0.587 0.858 25 18 Strong
assign (resid 182 and name C ) (resid 183 and name N )
(resid 183 and name CA ) (resid 183 and name C ) 1.0 -90.7 28.0 2
assign (resid 183 and name N ) (resid 183 and name CA )
(resid 183 and name C ) (resid 184 and name N ) 1.0 121.6 20.0 2
! 184 I -106.200 124.037 8.197 8.776 0.541 0.910 25 18 Strong
assign (resid 183 and name C ) (resid 184 and name N )
(resid 184 and name CA ) (resid 184 and name C ) 1.0 -106.2 20.0 2
assign (resid 184 and name N ) (resid 184 and name CA )
(resid 184 and name C ) (resid 185 and name N ) 1.0 124.0 20.0 2
! 185 L -111.717 140.460 14.150 11.239 0.454 0.928 25 18 Strong
assign (resid 184 and name C ) (resid 185 and name N )
(resid 185 and name CA ) (resid 185 and name C ) 1.0 -111.7 28.3 2
assign (resid 185 and name N ) (resid 185 and name CA )
(resid 185 and name C ) (resid 186 and name N ) 1.0 140.5 22.5 2
! 186 I -132.168 156.781 9.240 9.659 0.407 0.921 25 18 Strong
assign (resid 185 and name C ) (resid 186 and name N )
(resid 186 and name CA ) (resid 186 and name C ) 1.0 -132.2 20.0 2
assign (resid 186 and name N ) (resid 186 and name CA )
(resid 186 and name C ) (resid 187 and name N ) 1.0 156.8 20.0 2
! 187 R -65.770 142.009 6.916 9.609 0.400 0.891 25 18 Strong
assign (resid 186 and name C ) (resid 187 and name N )
(resid 187 and name CA ) (resid 187 and name C ) 1.0 -65.8 20.0 2
assign (resid 187 and name N ) (resid 187 and name CA )
(resid 187 and name C ) (resid 188 and name N ) 1.0 142.0 20.0 2
! 188 E -58.209 -37.474 4.871 7.598 0.359 0.884 25 18 Strong
assign (resid 187 and name C ) (resid 188 and name N )
(resid 188 and name CA ) (resid 188 and name C ) 1.0 -58.2 20.0 2
assign (resid 188 and name N ) (resid 188 and name CA )
(resid 188 and name C ) (resid 189 and name N ) 1.0 -37.5 20.0 2
! 189 D -66.338 -32.520 2.706 4.678 0.312 0.896 25 18 Strong
assign (resid 188 and name C ) (resid 189 and name N )
(resid 189 and name CA ) (resid 189 and name C ) 1.0 -66.3 20.0 2
assign (resid 189 and name N ) (resid 189 and name CA )
(resid 189 and name C ) (resid 190 and name N ) 1.0 -32.5 20.0 2
! 190 V -70.401 -42.233 3.992 3.683 0.230 0.924 25 18 Strong
assign (resid 189 and name C ) (resid 190 and name N )
(resid 190 and name CA ) (resid 190 and name C ) 1.0 -70.4 20.0 2
assign (resid 190 and name N ) (resid 190 and name CA )
(resid 190 and name C ) (resid 191 and name N ) 1.0 -42.2 20.0 2
! 191 H -62.429 -41.645 3.370 3.715 0.206 0.936 25 18 Strong
assign (resid 190 and name C ) (resid 191 and name N )
(resid 191 and name CA ) (resid 191 and name C ) 1.0 -62.4 20.0 2
assign (resid 191 and name N ) (resid 191 and name CA )
(resid 191 and name C ) (resid 192 and name N ) 1.0 -41.6 20.0 2
! 192 A -62.744 -41.396 3.909 3.968 0.170 0.919 25 18 Strong
assign (resid 191 and name C ) (resid 192 and name N )
(resid 192 and name CA ) (resid 192 and name C ) 1.0 -62.7 20.0 2
assign (resid 192 and name N ) (resid 192 and name CA )
(resid 192 and name C ) (resid 193 and name N ) 1.0 -41.4 20.0 2
! 193 A -66.159 -38.554 2.676 4.268 0.132 0.900 25 18 Strong
assign (resid 192 and name C ) (resid 193 and name N )
(resid 193 and name CA ) (resid 193 and name C ) 1.0 -66.2 20.0 2
assign (resid 193 and name N ) (resid 193 and name CA )
(resid 193 and name C ) (resid 194 and name N ) 1.0 -38.6 20.0 2
! 194 F -67.790 -38.523 4.800 3.298 0.137 0.882 25 18 Strong
assign (resid 193 and name C ) (resid 194 and name N )
(resid 194 and name CA ) (resid 194 and name C ) 1.0 -67.8 20.0 2
assign (resid 194 and name N ) (resid 194 and name CA )
(resid 194 and name C ) (resid 195 and name N ) 1.0 -38.5 20.0 2
! 195 E -66.805 -39.672 4.221 5.086 0.097 0.876 25 18 Strong
assign (resid 194 and name C ) (resid 195 and name N )
(resid 195 and name CA ) (resid 195 and name C ) 1.0 -66.8 20.0 2
assign (resid 195 and name N ) (resid 195 and name CA )
(resid 195 and name C ) (resid 196 and name N ) 1.0 -39.7 20.0 2
! 196 Q -66.901 -27.661 4.477 4.510 0.089 0.839 25 18 Strong
assign (resid 195 and name C ) (resid 196 and name N )
(resid 196 and name CA ) (resid 196 and name C ) 1.0 -66.9 20.0 2
assign (resid 196 and name N ) (resid 196 and name CA )
(resid 196 and name C ) (resid 197 and name N ) 1.0 -27.7 20.0 2
! 197 A -85.323 -7.018 8.141 8.327 0.127 0.786 25 17 Strong
assign (resid 196 and name C ) (resid 197 and name N )
(resid 197 and name CA ) (resid 197 and name C ) 1.0 -85.3 20.0 2
assign (resid 197 and name N ) (resid 197 and name CA )
(resid 197 and name C ) (resid 198 and name N ) 1.0 -7.0 20.0 2
! 198 G 73.953 27.345 7.407 7.777 0.154 0.755 25 17 Strong
assign (resid 197 and name C ) (resid 198 and name N )
(resid 198 and name CA ) (resid 198 and name C ) 1.0 74.0 20.0 2
assign (resid 198 and name N ) (resid 198 and name CA )
(resid 198 and name C ) (resid 199 and name N ) 1.0 27.3 20.0 2
! 199 L -69.221 139.239 9.666 12.804 0.282 0.761 25 17 Strong
assign (resid 198 and name C ) (resid 199 and name N )
(resid 199 and name CA ) (resid 199 and name C ) 1.0 -69.2 20.0 2
assign (resid 199 and name N ) (resid 199 and name CA )
(resid 199 and name C ) (resid 200 and name N ) 1.0 139.2 25.6 2
! 202 F -142.331 153.109 10.628 10.356 0.575 0.908 25 17 Strong
assign (resid 201 and name C ) (resid 202 and name N )
(resid 202 and name CA ) (resid 202 and name C ) 1.0 -142.3 21.3 2
assign (resid 202 and name N ) (resid 202 and name CA )
(resid 202 and name C ) (resid 203 and name N ) 1.0 153.1 20.7 2
! 203 K -133.427 150.224 14.044 13.655 0.724 0.912 25 18 Strong
assign (resid 202 and name C ) (resid 203 and name N )
(resid 203 and name CA ) (resid 203 and name C ) 1.0 -133.4 28.1 2
assign (resid 203 and name N ) (resid 203 and name CA )
(resid 203 and name C ) (resid 204 and name N ) 1.0 150.2 27.3 2
! 204 V -127.474 150.402 9.147 8.419 0.758 0.924 25 18 Strong
assign (resid 203 and name C ) (resid 204 and name N )
(resid 204 and name CA ) (resid 204 and name C ) 1.0 -127.5 20.0 2
assign (resid 204 and name N ) (resid 204 and name CA )
(resid 204 and name C ) (resid 205 and name N ) 1.0 150.4 20.0 2
! 205 Y -127.653 145.418 19.856 14.449 0.813 0.904 25 18 Strong
assign (resid 204 and name C ) (resid 205 and name N )
(resid 205 and name CA ) (resid 205 and name C ) 1.0 -127.7 39.7 2
assign (resid 205 and name N ) (resid 205 and name CA )
(resid 205 and name C ) (resid 206 and name N ) 1.0 145.4 28.9 2
! 207 A -64.818 -25.308 7.676 8.994 0.953 0.834 25 18 Strong
assign (resid 206 and name C ) (resid 207 and name N )
(resid 207 and name CA ) (resid 207 and name C ) 1.0 -64.8 20.0 2
assign (resid 207 and name N ) (resid 207 and name CA )
(resid 207 and name C ) (resid 208 and name N ) 1.0 -25.3 20.0 2
! 209 G 89.467 3.350 10.517 15.554 1.123 0.772 25 17 Strong
assign (resid 208 and name C ) (resid 209 and name N )
(resid 209 and name CA ) (resid 209 and name C ) 1.0 89.5 21.0 2
assign (resid 209 and name N ) (resid 209 and name CA )
(resid 209 and name C ) (resid 210 and name N ) 1.0 3.4 31.1 2
! 210 W -73.748 133.806 13.467 11.471 -4.489 0.769 10 16 Generous
assign (resid 209 and name C ) (resid 210 and name N )
(resid 210 and name CA ) (resid 210 and name C ) 1.0 -73.7 40.4 2
assign (resid 210 and name N ) (resid 210 and name CA )
(resid 210 and name C ) (resid 211 and name N ) 1.0 133.8 34.4 2
! 211 D -60.656 128.069 20.390 30.342 1.383 0.760 25 14 Strong
assign (resid 210 and name C ) (resid 211 and name N )
(resid 211 and name CA ) (resid 211 and name C ) 1.0 -60.7 40.8 2
assign (resid 211 and name N ) (resid 211 and name CA )
(resid 211 and name C ) (resid 212 and name N ) 1.0 128.1 60.7 2
! 212 G 89.004 -5.333 9.017 9.974 0.968 0.745 25 14 Strong
assign (resid 211 and name C ) (resid 212 and name N )
(resid 212 and name CA ) (resid 212 and name C ) 1.0 89.0 20.0 2
assign (resid 212 and name N ) (resid 212 and name CA )
(resid 212 and name C ) (resid 213 and name N ) 1.0 -5.3 20.0 2
! 213 L -74.033 135.750 8.796 8.842 0.428 0.721 25 15 Strong
assign (resid 212 and name C ) (resid 213 and name N )
(resid 213 and name CA ) (resid 213 and name C ) 1.0 -74.0 20.0 2
assign (resid 213 and name N ) (resid 213 and name CA )
(resid 213 and name C ) (resid 214 and name N ) 1.0 135.8 20.0 2
! 214 E -88.517 101.272 9.423 14.977 0.460 0.696 25 18 Strong
assign (resid 213 and name C ) (resid 214 and name N )
(resid 214 and name CA ) (resid 214 and name C ) 1.0 -88.5 20.0 2
assign (resid 214 and name N ) (resid 214 and name CA )
(resid 214 and name C ) (resid 215 and name N ) 1.0 101.3 30.0 2
! 14 L 17 0.633 0.041 0.326 g- -71.2 14.4
assign (resid 14 and name N ) (resid 14 and name CA )
(resid 14 and name CB ) (resid 14 and name CG ) 1.0 -71.2 28.8 2
! 15 V 16 0.165 0.104 0.731 t -178.3 11.1
assign (resid 15 and name N ) (resid 15 and name CA )
(resid 15 and name CB ) (resid 15 and name CG1 ) 1.0 -178.3 22.2 2
! 20 H 10 0.762 0.081 0.158 g- -64.6 10.3
!assign (resid 20 and name N ) (resid 20 and name CA )
! (resid 20 and name CB ) (resid 20 and name CG ) 1.0 -64.6 20.6 2
! 22 V 18 0.072 0.072 0.856 t -175.4 7.3
assign (resid 22 and name N ) (resid 22 and name CA )
(resid 22 and name CB ) (resid 22 and name CG1 ) 1.0 -175.4 20.0 2
! 24 Y 18 0.645 0.309 0.046 g- -59.2 6.7
assign (resid 24 and name N ) (resid 24 and name CA )
(resid 24 and name CB ) (resid 24 and name CG ) 1.0 -59.2 20.0 2
! 25 F 18 0.840 0.104 0.055 g- -65.9 11.6
assign (resid 25 and name N ) (resid 25 and name CA )
(resid 25 and name CB ) (resid 25 and name CG ) 1.0 -65.9 23.2 2
! 26 V 18 0.072 0.072 0.856 t 178.8 5.6
assign (resid 26 and name N ) (resid 26 and name CA )
(resid 26 and name CB ) (resid 26 and name CG1 ) 1.0 178.8 20.0 2
! 27 F 18 0.161 0.052 0.787 t -173.8 10.5
assign (resid 27 and name N ) (resid 27 and name CA )
(resid 27 and name CB ) (resid 27 and name CG ) 1.0 -173.8 21.0 2
! 29 V 18 0.056 0.056 0.888 t -178.7 4.6
assign (resid 29 and name N ) (resid 29 and name CA )
(resid 29 and name CB ) (resid 29 and name CG1 ) 1.0 -178.7 20.0 2
! 36 Y 9 0.859 0.036 0.104 g- -64.5 6.2
assign (resid 36 and name N ) (resid 36 and name CA )
(resid 36 and name CB ) (resid 36 and name CG ) 1.0 -64.5 20.0 2
! 37 I 10 0.793 0.159 0.048 g- -59.5 8.1
assign (resid 37 and name N ) (resid 37 and name CA )
(resid 37 and name CB ) (resid 37 and name CG1 ) 1.0 -59.5 20.0 2
! 38 E 16 0.621 0.085 0.294 g- -55.4 17.3
assign (resid 38 and name N ) (resid 38 and name CA )
(resid 38 and name CB ) (resid 38 and name CG ) 1.0 -55.4 34.6 2
! 40 L 14 0.755 0.049 0.196 g- -62.6 8.7
assign (resid 40 and name N ) (resid 40 and name CA )
(resid 40 and name CB ) (resid 40 and name CG ) 1.0 -62.6 20.0 2
! 42 N 9 0.133 0.133 0.733 t -174.6 18.7
assign (resid 42 and name N ) (resid 42 and name CA )
(resid 42 and name CB ) (resid 42 and name CG ) 1.0 -174.6 37.4 2
! 46 T 16 0.247 0.690 0.063 g+ 61.8 6.5
assign (resid 46 and name N ) (resid 46 and name CA )
(resid 46 and name CB ) (resid 46 and name OG1 ) 1.0 61.8 20.0 2
! 47 D 18 0.707 0.176 0.117 g- -71.1 8.5
assign (resid 47 and name N ) (resid 47 and name CA )
(resid 47 and name CB ) (resid 47 and name CG ) 1.0 -71.1 20.0 2
! 50 F 18 0.796 0.028 0.176 g- -73.9 14.7
assign (resid 50 and name N ) (resid 50 and name CA )
(resid 50 and name CB ) (resid 50 and name CG ) 1.0 -73.9 29.4 2
! 51 H 18 0.838 0.081 0.081 g- -63.7 6.8
assign (resid 51 and name N ) (resid 51 and name CA )
(resid 51 and name CB ) (resid 51 and name CG ) 1.0 -63.7 20.0 2
! 54 I 17 0.078 0.800 0.122 g+ 62.6 7.8
assign (resid 54 and name N ) (resid 54 and name CA )
(resid 54 and name CB ) (resid 54 and name CG1 ) 1.0 62.6 20.0 2
! 55 S 18 0.181 0.183 0.637 t 173.0 7.2
assign (resid 55 and name N ) (resid 55 and name CA )
(resid 55 and name CB ) (resid 55 and name OG ) 1.0 173.0 20.0 2
! 56 L 18 0.647 0.039 0.314 g- -68.3 8.3
assign (resid 56 and name N ) (resid 56 and name CA )
(resid 56 and name CB ) (resid 56 and name CG ) 1.0 -68.3 20.0 2
! 59 D 18 0.657 0.109 0.234 g- -65.4 4.5
assign (resid 59 and name N ) (resid 59 and name CA )
(resid 59 and name CB ) (resid 59 and name CG ) 1.0 -65.4 20.0 2
! 62 V 15 0.073 0.055 0.872 t -178.3 5.6
assign (resid 62 and name N ) (resid 62 and name CA )
(resid 62 and name CB ) (resid 62 and name CG1 ) 1.0 -178.3 20.0 2
! 65 E 17 0.623 0.230 0.147 g- -61.5 10.7
assign (resid 65 and name N ) (resid 65 and name CA )
(resid 65 and name CB ) (resid 65 and name CG ) 1.0 -61.5 21.4 2
! 66 V 18 0.820 0.111 0.069 g- -59.6 6.6
assign (resid 66 and name N ) (resid 66 and name CA )
(resid 66 and name CB ) (resid 66 and name CG1 ) 1.0 -59.6 20.0 2
! 68 F 15 0.846 0.032 0.121 g- -60.6 7.9
assign (resid 68 and name N ) (resid 68 and name CA )
(resid 68 and name CB ) (resid 68 and name CG ) 1.0 -60.6 20.0 2
! 69 S 13 0.155 0.689 0.155 g+ 69.1 8.5
assign (resid 69 and name N ) (resid 69 and name CA )
(resid 69 and name CB ) (resid 69 and name OG ) 1.0 69.1 20.0 2
! 76 R 16 0.613 0.194 0.194 g- -56.6 11.0
assign (resid 76 and name N ) (resid 76 and name CA )
(resid 76 and name CB ) (resid 76 and name CG ) 1.0 -56.6 22.0 2
! 78 L 18 0.705 0.043 0.252 g- -59.9 9.3
assign (resid 78 and name N ) (resid 78 and name CA )
(resid 78 and name CB ) (resid 78 and name CG ) 1.0 -59.9 20.0 2
! 79 Y 18 0.643 0.218 0.138 g- -65.3 7.2
assign (resid 79 and name N ) (resid 79 and name CA )
(resid 79 and name CB ) (resid 79 and name CG ) 1.0 -65.3 20.0 2
! 80 D 18 0.644 0.113 0.243 g- -64.3 5.1
assign (resid 80 and name N ) (resid 80 and name CA )
(resid 80 and name CB ) (resid 80 and name CG ) 1.0 -64.3 20.0 2
! 85 I 18 0.652 0.217 0.131 g- -60.2 8.1
assign (resid 85 and name N ) (resid 85 and name CA )
(resid 85 and name CB ) (resid 85 and name CG1 ) 1.0 -60.2 20.0 2
! 86 M 18 0.700 0.150 0.150 g- -62.7 12.2
assign (resid 86 and name N ) (resid 86 and name CA )
(resid 86 and name CB ) (resid 86 and name CG ) 1.0 -62.7 24.4 2
! 89 L 18 0.187 0.047 0.766 t 178.8 9.6
assign (resid 89 and name N ) (resid 89 and name CA )
(resid 89 and name CB ) (resid 89 and name CG ) 1.0 178.8 20.0 2
! 91 V 18 0.150 0.150 0.701 t -171.8 11.2
assign (resid 91 and name N ) (resid 91 and name CA )
(resid 91 and name CB ) (resid 91 and name CG1 ) 1.0 -171.8 22.4 2
! 92 S 17 0.130 0.632 0.239 g+ 70.8 8.3
assign (resid 92 and name N ) (resid 92 and name CA )
(resid 92 and name CB ) (resid 92 and name OG ) 1.0 70.8 20.0 2
! 98 L 18 0.611 0.043 0.346 g- -73.5 7.4
assign (resid 98 and name N ) (resid 98 and name CA )
(resid 98 and name CB ) (resid 98 and name CG ) 1.0 -73.5 20.0 2
! 99 I 18 0.886 0.050 0.064 g- -65.2 5.7
assign (resid 99 and name N ) (resid 99 and name CA )
(resid 99 and name CB ) (resid 99 and name CG1 ) 1.0 -65.2 20.0 2
! 100 E 18 0.634 0.062 0.304 g- -66.7 6.9
assign (resid 100 and name N ) (resid 100 and name CA )
(resid 100 and name CB ) (resid 100 and name CG ) 1.0 -66.7 20.0 2
! 102 L 17 0.705 0.043 0.252 g- -67.3 9.9
assign (resid 102 and name N ) (resid 102 and name CA )
(resid 102 and name CB ) (resid 102 and name CG ) 1.0 -67.3 20.0 2
! 104 V 17 0.059 0.059 0.882 t 178.7 3.4
assign (resid 104 and name N ) (resid 104 and name CA )
(resid 104 and name CB ) (resid 104 and name CG1 ) 1.0 178.7 20.0 2
! 106 N 18 0.854 0.073 0.073 g- -59.0 8.5
assign (resid 106 and name N ) (resid 106 and name CA )
(resid 106 and name CB ) (resid 106 and name CG ) 1.0 -59.0 20.0 2
! 108 E 18 0.304 0.062 0.634 t -174.2 13.6
assign (resid 108 and name N ) (resid 108 and name CA )
(resid 108 and name CB ) (resid 108 and name CG ) 1.0 -174.2 27.2 2
! 109 W 18 0.849 0.061 0.090 g- -62.8 9.0
assign (resid 109 and name N ) (resid 109 and name CA )
(resid 109 and name CB ) (resid 109 and name CG ) 1.0 -62.8 20.0 2
! 110 L 16 0.865 0.053 0.083 g- -58.2 8.3
assign (resid 110 and name N ) (resid 110 and name CA )
(resid 110 and name CB ) (resid 110 and name CG ) 1.0 -58.2 20.0 2
! 114 I 18 0.886 0.064 0.050 g- -56.9 6.3
assign (resid 114 and name N ) (resid 114 and name CA )
(resid 114 and name CB ) (resid 114 and name CG1 ) 1.0 -56.9 20.0 2
! 116 D 18 0.077 0.845 0.077 g+ 68.0 9.0
assign (resid 116 and name N ) (resid 116 and name CA )
(resid 116 and name CB ) (resid 116 and name CG ) 1.0 68.0 20.0 2
! 117 H 18 0.647 0.176 0.176 g- -66.3 7.3
assign (resid 117 and name N ) (resid 117 and name CA )
(resid 117 and name CB ) (resid 117 and name CG ) 1.0 -66.3 20.0 2
! 118 Q 17 0.817 0.091 0.091 g- -63.7 8.0
assign (resid 118 and name N ) (resid 118 and name CA )
(resid 118 and name CB ) (resid 118 and name CG ) 1.0 -63.7 20.0 2
! 121 V 18 0.158 0.100 0.741 t 179.6 9.3
assign (resid 121 and name N ) (resid 121 and name CA )
(resid 121 and name CB ) (resid 121 and name CG1 ) 1.0 179.6 20.0 2
! 126 Y 18 0.805 0.098 0.098 g- -63.3 9.4
assign (resid 126 and name N ) (resid 126 and name CA )
(resid 126 and name CB ) (resid 126 and name CG ) 1.0 -63.3 20.0 2
! 128 F 18 0.692 0.023 0.285 g- -67.7 9.3
assign (resid 128 and name N ) (resid 128 and name CA )
(resid 128 and name CB ) (resid 128 and name CG ) 1.0 -67.7 20.0 2
! 129 L 18 0.314 0.039 0.647 t -177.6 12.2
assign (resid 129 and name N ) (resid 129 and name CA )
(resid 129 and name CB ) (resid 129 and name CG ) 1.0 -177.6 24.4 2
! 131 L 18 0.647 0.039 0.314 g- -62.0 9.3
assign (resid 131 and name N ) (resid 131 and name CA )
(resid 131 and name CB ) (resid 131 and name CG ) 1.0 -62.0 20.0 2
! 132 L 17 0.766 0.047 0.187 g- -61.3 6.9
assign (resid 132 and name N ) (resid 132 and name CA )
(resid 132 and name CB ) (resid 132 and name CG ) 1.0 -61.3 20.0 2
! 138 I 18 0.726 0.137 0.137 g- -63.0 7.3
assign (resid 138 and name N ) (resid 138 and name CA )
(resid 138 and name CB ) (resid 138 and name CG1 ) 1.0 -63.0 20.0 2
! 139 D 18 0.130 0.090 0.781 t -179.5 6.6
assign (resid 139 and name N ) (resid 139 and name CA )
(resid 139 and name CB ) (resid 139 and name CG ) 1.0 -179.5 20.0 2
! 142 R 18 0.706 0.091 0.203 g- -63.9 6.4
assign (resid 142 and name N ) (resid 142 and name CA )
(resid 142 and name CB ) (resid 142 and name CG ) 1.0 -63.9 20.0 2
! 150 L 18 0.633 0.041 0.326 g- -69.1 8.0
assign (resid 150 and name N ) (resid 150 and name CA )
(resid 150 and name CB ) (resid 150 and name CG ) 1.0 -69.1 20.0 2
! 154 Q 18 0.621 0.189 0.189 g- -64.5 11.2
assign (resid 154 and name N ) (resid 154 and name CA )
(resid 154 and name CB ) (resid 154 and name CG ) 1.0 -64.5 22.4 2
! 155 I 17 0.855 0.048 0.097 g- -63.3 7.7
assign (resid 155 and name N ) (resid 155 and name CA )
(resid 155 and name CB ) (resid 155 and name CG1 ) 1.0 -63.3 20.0 2
! 158 I 18 0.793 0.057 0.150 g- -60.6 8.7
assign (resid 158 and name N ) (resid 158 and name CA )
(resid 158 and name CB ) (resid 158 and name CG1 ) 1.0 -60.6 20.0 2
! 161 L 18 0.083 0.053 0.865 t 176.8 8.1
assign (resid 161 and name N ) (resid 161 and name CA )
(resid 161 and name CB ) (resid 161 and name CG ) 1.0 176.8 20.0 2
! 163 L 18 0.825 0.050 0.125 g- -67.0 11.1
assign (resid 163 and name N ) (resid 163 and name CA )
(resid 163 and name CB ) (resid 163 and name CG ) 1.0 -67.0 22.2 2
! 164 D 18 0.058 0.633 0.309 g+ 62.0 6.9
assign (resid 164 and name N ) (resid 164 and name CA )
(resid 164 and name CB ) (resid 164 and name CG ) 1.0 62.0 20.0 2
! 165 T 18 0.114 0.840 0.046 g+ 59.3 6.5
assign (resid 165 and name N ) (resid 165 and name CA )
(resid 165 and name CB ) (resid 165 and name OG1 ) 1.0 59.3 20.0 2
! 168 I 18 0.793 0.057 0.150 g- -61.0 6.6
assign (resid 168 and name N ) (resid 168 and name CA )
(resid 168 and name CB ) (resid 168 and name CG1 ) 1.0 -61.0 20.0 2
! 169 R 16 0.774 0.113 0.113 g- -74.1 14.9
assign (resid 169 and name N ) (resid 169 and name CA )
(resid 169 and name CB ) (resid 169 and name CG ) 1.0 -74.1 29.8 2
! 171 D 16 0.273 0.657 0.070 g+ 60.7 8.1
assign (resid 171 and name N ) (resid 171 and name CA )
(resid 171 and name CB ) (resid 171 and name CG ) 1.0 60.7 20.0 2
! 175 F 18 0.060 0.910 0.030 g+ 66.6 5.8
assign (resid 175 and name N ) (resid 175 and name CA )
(resid 175 and name CB ) (resid 175 and name CG ) 1.0 66.6 20.0 2
! 178 T 18 0.342 0.619 0.039 g+ 55.1 7.7
assign (resid 178 and name N ) (resid 178 and name CA )
(resid 178 and name CB ) (resid 178 and name OG1 ) 1.0 55.1 20.0 2
! 179 K 18 0.659 0.138 0.203 g- -66.2 6.1
assign (resid 179 and name N ) (resid 179 and name CA )
(resid 179 and name CB ) (resid 179 and name CG ) 1.0 -66.2 20.0 2
! 182 R 18 0.678 0.126 0.195 g- -63.7 7.9
assign (resid 182 and name N ) (resid 182 and name CA )
(resid 182 and name CB ) (resid 182 and name CG ) 1.0 -63.7 20.0 2
! 183 L 18 0.083 0.053 0.865 t -178.2 8.6
assign (resid 183 and name N ) (resid 183 and name CA )
(resid 183 and name CB ) (resid 183 and name CG ) 1.0 -178.2 20.0 2
! 184 I 18 0.886 0.050 0.064 g- -61.5 6.4
assign (resid 184 and name N ) (resid 184 and name CA )
(resid 184 and name CB ) (resid 184 and name CG1 ) 1.0 -61.5 20.0 2
! 185 L 18 0.647 0.039 0.314 g- -56.5 8.5
assign (resid 185 and name N ) (resid 185 and name CA )
(resid 185 and name CB ) (resid 185 and name CG ) 1.0 -56.5 20.0 2
! 186 I 18 0.232 0.629 0.140 g+ 58.6 7.6
assign (resid 186 and name N ) (resid 186 and name CA )
(resid 186 and name CB ) (resid 186 and name CG1 ) 1.0 58.6 20.0 2
! 190 V 18 0.069 0.111 0.820 t 177.0 7.2
assign (resid 190 and name N ) (resid 190 and name CA )
(resid 190 and name CB ) (resid 190 and name CG1 ) 1.0 177.0 20.0 2
! 194 F 18 0.692 0.023 0.285 g- -73.2 11.5
assign (resid 194 and name N ) (resid 194 and name CA )
(resid 194 and name CB ) (resid 194 and name CG ) 1.0 -73.2 23.0 2
! 195 E 18 0.616 0.088 0.296 g- -66.6 8.0
assign (resid 195 and name N ) (resid 195 and name CA )
(resid 195 and name CB ) (resid 195 and name CG ) 1.0 -66.6 20.0 2
! 199 L 17 0.865 0.053 0.083 g- -59.2 8.3
assign (resid 199 and name N ) (resid 199 and name CA )
(resid 199 and name CB ) (resid 199 and name CG ) 1.0 -59.2 20.0 2
! 200 T 17 0.076 0.876 0.048 g+ 57.5 4.9
assign (resid 200 and name N ) (resid 200 and name CA )
(resid 200 and name CB ) (resid 200 and name OG1 ) 1.0 57.5 20.0 2
! 204 V 18 0.820 0.069 0.111 g- -58.7 8.9
assign (resid 204 and name N ) (resid 204 and name CA )
(resid 204 and name CB ) (resid 204 and name CG1 ) 1.0 -58.7 20.0 2
! 205 Y 18 0.611 0.238 0.151 g- -65.8 15.4
assign (resid 205 and name N ) (resid 205 and name CA )
(resid 205 and name CB ) (resid 205 and name CG ) 1.0 -65.8 30.8 2
! 208 E 17 0.613 0.066 0.321 g- -65.4 7.5
assign (resid 208 and name N ) (resid 208 and name CA )
(resid 208 and name CB ) (resid 208 and name CG ) 1.0 -65.4 20.0 2
! 213 L 15 0.647 0.039 0.314 g- -66.1 12.7
assign (resid 213 and name N ) (resid 213 and name CA )
(resid 213 and name CB ) (resid 213 and name CG ) 1.0 -66.1 25.4 2
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