Assignment w1 w2 D3H-N 122.491 8.55 G4H-N 108.842 8.314 D5H-N 119.935 8.009 A6H-N 123.033 7.838 L7H-N 120.553 8.329 L8H-N 112.366 7.08 K9H-N 122.037 7.23 C11H-N 115.6 7.419 K12H-N 123.413 9.479 L13H-N 126.563 9.333 G14H-N 112.988 8.865 D15H-N 118.927 7.699 M16H-N 126.233 8.626 Q17H-N 122.314 8.308 Q17HE21-NE2 112.451 7.568 Q17HE22-NE2 112.451 6.872 C18H-N 121.267 8.049 L19H-N 121.647 8.174 S20H-N 117.75 8.54 S21H-N 119.42 7.718 A22H-N 125.662 9.205 T23H-N 116.998 8.34 E24H-N 121.35 7.844 Q25H-N 118.311 7.871 Q25HE21-NE2 110.611 7.011 Q25HE22-NE2 110.611 6.649 F26H-N 121.608 8.749 L27H-N 120.861 9.055 E28H-N 120.08 7.947 K29H-N 117.022 8.139 T30H-N 106.005 7.794 S31H-N 117.422 7.482 K32H-N 118.193 7.938 G33H-N 109.415 7.98 I34H-N 116.722 8.329 Q36H-N 117.665 9.341 Q36HE21-NE2 111.572 7.204 Q36HE22-NE2 111.572 6.762 Y37H-N 116.819 7.298 D38H-N 117.982 8.287 I39H-N 117.609 7.325 W40H-N 138.113 10.148 W40HE1-NE1 128.618 9.845 I42H-N 112.932 7.537 D43H-N 119.341 7.751 L45H-N 125.478 8.833 V46H-N 126.116 8.26 V47H-N 129.541 8.764 T48H-N 122.232 8.721 S49H-N 113.416 7.425 L50H-N 125.956 8.215 D51H-N 126.928 8.602 V52H-N 122.56 9.532 I53H-N 127.8 8.442 A54H-N 131.389 8.259 S56H-N 111.865 7.97 D57H-N 120.096 7.892 A58H-N 123.579 8.077 G59H-N 105.471 8.361 I60H-N 121.622 7.768 V61H-N 127.068 8.723 I62H-N 127.066 8.961 R63H-N 125.48 9.114 R63HE-NE 86.477 7.635 F64H-N 121.473 9.24 K65H-N 121.144 8.934 N66H-N 117.888 8.611 N66HD21-ND2 115.21 7.919 N66HD22-ND2 115.21 6.827 L67H-N 117.598 8.111 N68H-N 123.331 9.529 N68HD21-ND2 110.509 7.043 N68HD22-ND2 110.509 6.592 I69H-N 126.656 9.54 T70H-N 121.828 9.453 G71H-N 110.13 8.646 L72H-N 122.154 9.074 K73H-N 120.845 10.482 N74H-N 115.416 7.51 N74HD21-ND2 112.679 7.702 N74HD22-ND2 112.679 6.903 Q75H-N 118.053 6.918 Q75HE22-NE2 104.811 7.883 Q76H-N 117.97 8.65 Q76HE21-NE2 113.088 7.505 Q76HE22-NE2 113.088 6.859 I77H-N 123.242 9.347 S78H-N 125.054 9.219 D79H-N 118.405 8.054 F80H-N 123.872 8.378 Q81H-N 126.215 8.627 Q81HE21-NE2 113.425 8.061 Q81HE22-NE2 113.425 6.587 M82H-N 126.799 8.462 D83H-N 127.835 8.567 T84H-N 114.935 8.534 K85H-N 123.714 8.399 A86H-N 121.799 7.891 K87H-N 114.298 7.72 T88H-N 108.214 7.776 V89H-N 122.288 8.758 L90H-N 128.626 8.147 L91H-N 127.999 8.989 K92H-N 126.105 8.976 T93H-N 115.323 9.049 K94H-N 118.876 8.866 A95H-N 126.175 8.985 D96H-N 123.65 8.87 L97H-N 122.619 8.967 H98H-N 121.731 8.741 I99H-N 128.649 9.138 V100H-N 124.379 8.467 G101H-N 111.858 9.172 D102H-N 120.744 8.139 I103H-N 118.987 8.718 V104H-N 127.435 8.646 I105H-N 126.462 9.309 E106H-N 127.595 9.409 L107H-N 125.732 8.452 T108H-N 116.992 8.101 E109H-N 121.341 9.021 Q110H-N 114.613 7.41 Q110HE21-NE2 112.603 7.58 Q110HE22-NE2 112.603 6.983 S111H-N 113.1 7.8 K112H-N 116.963 7.214 S113H-N 115.945 7.881 F114H-N 121.645 8.879 T115H-N 114.713 8.581 G116H-N 108.352 8.355 L117H-N 127.462 8.778 Y118H-N 127.437 9.165 T119H-N 121.698 7.769 A120H-N 125.084 9.156 D121H-N 120.203 8.22 T122H-N 116.662 8.553 N123H-N 124.762 8.304 N123HD21-ND2 111.643 7.67 N123HD22-ND2 111.643 6.285 V124H-N 120.88 8.958 I125H-N 122.42 8.501 G126H-N 116.01 8.761 A127H-N 122.718 7.79 V128H-N 115.657 9.348 R129H-N 121.767 8.21 R129HE-NE 85.48 7.222 Y130H-N 118.152 8.278 G131H-N 107.138 8.661 Y132H-N 113.288 7.725 N133H-N 114.512 8.55 N133HD21-ND2 113.769 7.724 N133HD22-ND2 113.769 7.033 L134H-N 123.952 8.801 K135H-N 123.558 8.815 N136H-N 124.474 8.892 N136HD21-ND2 110.131 7.346 N136HD22-ND2 110.131 6.658 D137H-N 121.696 8.57 D138H-N 117.624 8.482 N139H-N 116.696 8.439 N139HD21-ND2 113.497 7.671 N139HD22-ND2 113.497 6.89 G140H-N 108.338 8.159 V141H-N 123.256 8.11 Q142H-N 127.506 8.594 Q142HE21-NE2 111.809 7.527 Q142HE22-NE2 111.809 6.73 H143H-N 121.875 9.094 F144H-N 119.367 9.438 E145H-N 123.362 9.294 V146H-N 127.468 8.259 Q147H-N 132.282 8.539 Q147HE21-NE2 111.134 6.929 Q147HE22-NE2 111.134 6.834 E149H-N 127.838 10.212 T150H-N 113.93 8.959 F151H-N 127.784 9.125 T152H-N 123.151 8.522 C153H-N 125.71 8.627 E154H-N 128.402 7.605 S155H-N 109.711 7.917 I156H-N 119.41 8.47 G157H-N 110.242 8.142 E158H-N 125.293 8.503 K160H-N 123.849 8.542 I161H-N 127.187 8.732 T162H-N 122.401 9.146 L163H-N 125.585 8.708 S164H-N 116.631 8.322 S165H-N 118.258 8.929 D166H-N 121.044 8.963 L167H-N 124.851 7.701 S168H-N 114.388 8.625 S169H-N 115.072 8.207 A170H-N 124.45 7.651 L171H-N 118.192 8.099 E172H-N 120.62 8.221 K173H-N 119.292 8.07 D174H-N 118.266 7.872 S175H-N 112.284 7.813 G176H-N 110.521 8.09 N177H-N 118.072 8.246 N177HD21-ND2 112.519 7.45 N177HD22-ND2 112.519 6.869 N178H-N 117.782 8.264 N178HD21-ND2 112.748 7.557 N178HD22-ND2 112.748 6.833 S179H-N 112.675 7.859 L180H-N 123.237 8.464 E181H-N 124.056 8.099 D183H-N 114.44 8.144 M184H-N 118.841 7.696 E185H-N 120.933 8.831 L187H-N 126.289 8.131 K188H-N 119.092 8.139 T189H-N 117.571 7.84 L190H-N 120.021 7.986 R191H-N 114.506 7.77 R191HE-NE 83.866 7.461 Q192H-N 118.333 7.494 Q192HE21-NE2 111.408 7.371 Q192HE22-NE2 111.408 6.895 A193H-N 124.329 8.495 A194H-N 115.152 8.931 I195H-N 115.107 7.084 C196H-N 116.64 7.941 K197H-N 121.174 8.044 I198H-N 122.133 8.297 A199H-N 122.558 9.154 E200H-N 120.41 8.279 A201H-N 120.474 7.335 C202H-N 116.441 7.996 Y203H-N 119.226 8.626 I204H-N 123.294 8.528 S205H-N 117.947 7.319 V206H-N 121.28 7.85 V207H-N 119.214 8.891 H208H-N 121.199 8.489 N209H-N 117.796 7.614 N209HD21-ND2 113.919 8.925 N209HD22-ND2 113.919 8.628 I210H-N 124.187 7.532 R211H-N 121.049 8.316 R211HE-NE 82.998 6.141 A212H-N 120.829 9.007 S213H-N 115.38 8.13 A214H-N 124.481 8.392 K215H-N 116.096 7.349 I216H-N 112.822 7.003 L217H-N 123.224 8.347 A219H-N 126.695 8.81 S220H-N 110.423 8.257 S221H-N 117.53 8.003 F222H-N 114.245 7.547 F223H-N 111.124 7.143 E224H-N 119.886 7.969 N225H-N 116.559 8.426 N225HD21-ND2 112.041 7.659 N225HD22-ND2 112.041 7.029 L226H-N 120.59 8.092 N227H-N 124.328 7.791 N227HD21-ND2 112.628 7.402 N227HD22-ND2 112.628 6.756