Assignment w1 w2 R5H-N 122.846 8.471 K6H-N 123.308 8.431 K7H-N 123.385 8.296 I8H-N 123.0 8.036 F9H-N 125.466 8.944 K10H-N 123.848 9.227 E12H-N 118.058 9.763 E13H-N 119.994 7.208 L14H-N 119.377 7.828 R15H-N 118.607 8.134 Q16H-N 115.601 7.808 Q16HE21-NE2 111.67 7.588 Q16HE22-NE2 111.67 6.819 A17H-N 117.142 7.417 L18H-N 111.131 7.989 M19H-N 123.154 8.684 T21H-N 126.699 7.482 L22H-N 125.004 7.011 E23H-N 119.377 8.775 A24H-N 118.915 7.584 L25H-N 114.753 7.277 Y26H-N 116.988 7.897 R27H-N 112.981 7.848 Q28H-N 117.374 7.257 Q28HE21-NE2 115.37 7.944 Q28HE22-NE2 115.37 6.992 D29H-N 112.056 8.257 E31H-N 123.925 9.47 S32H-N 123.616 8.005 L33H-N 124.31 7.989 F35H-N 113.828 8.027 R36H-N 117.759 7.095 Q37H-N 113.983 7.584 Q37HE21-NE2 111.516 7.423 Q37HE22-NE2 111.516 6.837 V39H-N 125.466 8.46 D40H-N 128.087 7.301 Q42H-N 115.139 7.866 Q42HE21-NE2 112.21 7.659 Q42HE22-NE2 112.21 6.874 L43H-N 121.921 7.418 L44H-N 114.214 7.535 G45H-N 127.932 7.392 I46H-N 111.902 7.863 D48H-N 118.376 8.432 Y49H-N 122.152 8.006 F50H-N 113.289 8.513 D51H-N 117.759 7.639 I52H-N 118.838 7.182 V53H-N 122.46 8.617 K54H-N 123.154 7.655 N55H-N 116.988 8.585 N55HD21-ND2 114.06 6.9 N55HD22-ND2 114.06 7.614 M57H-N 119.069 8.42 D58H-N 120.765 7.292 L59H-N 119.146 8.816 S60H-N 115.678 8.235 T61H-N 124.85 7.28 I62H-N 123.693 7.53 K63H-N 119.146 8.783 R64H-N 117.99 7.805 K65H-N 121.998 8.487 L66H-N 120.534 8.568 D67H-N 119.994 9.128 T68H-N 125.158 7.768 G69H-N 109.898 7.435 Q70H-N 114.753 8.377 Q70HE21-NE2 113.289 7.312 Q70HE22-NE2 113.289 6.815 Y71H-N 117.682 8.115 Q72H-N 120.688 8.915 Q72HE21-NE2 112.904 7.595 Q72HE22-NE2 112.904 6.759 E73H-N 114.214 7.662 W75H-N 115.293 7.913 Q76H-N 118.53 6.93 Y77H-N 120.534 6.278 V78H-N 119.146 7.335 D79H-N 116.988 8.435 D80H-N 121.767 7.196 V81H-N 121.69 7.404 W82H-N 115.216 7.909 L83H-N 122.923 8.07 M84H-N 117.605 7.283 F85H-N 118.684 7.495 N86H-N 118.838 9.609 N86HD21-ND2 111.67 7.8 N86HD22-ND2 111.67 7.213 N87H-N 119.223 8.918 A88H-N 121.458 7.309 W89H-N 119.917 8.668 L90H-N 118.684 7.636 Y91H-N 115.601 8.337 N92H-N 112.981 7.833 R93H-N 118.067 8.795 K94H-N 122.846 8.821 T95H-N 122.614 6.878 S96H-N 118.221 7.845 R97H-N 123.616 8.822 V98H-N 114.984 8.031 Y99H-N 121.304 7.313 K100H-N 118.144 7.766 F101H-N 121.381 9.17 C102H-N 120.148 8.542 S103H-N 112.826 8.472 K104H-N 122.614 7.811 L105H-N 118.838 7.817 A106H-N 120.534 7.971 E107H-N 119.069 7.484 V108H-N 120.379 7.751 F109H-N 119.223 9.072 E110H-N 116.372 8.546 Q111H-N 115.139 7.336 E112H-N 116.603 7.938 I113H-N 117.682 8.835 D114H-N 122.614 7.002 V116H-N 117.99 6.569 M117H-N 118.53 8.445 Q118H-N 118.067 8.017 Q118HE21-NE2 112.826 7.593 Q118HE22-NE2 112.826 6.77 S119H-N 113.905 7.594 L120H-N 121.844 7.599 G121H-N 112.595 7.603