Assignment w1 w2 L3H-N 125.082 8.321 E4H-N 122.906 8.521 R5H-N 120.27 8.327 N6H-N 118.639 8.257 N6HD21-ND2 112.891 7.748 N6HD22-ND2 112.891 7.024 E7H-N 123.935 8.185 V8H-N 118.916 8.095 K9H-N 117.791 7.771 R10H-N 119.032 7.834 L11H-N 120.881 8.147 L12H-N 116.294 8.331 A13H-N 117.998 7.109 S14H-N 114.833 7.265 R15H-N 125.37 8.872 N16H-N 120.536 8.367 N16HD21-ND2 114.278 7.85 N16HD22-ND2 114.278 6.995 S17H-N 121.694 8.656 K18H-N 120.961 8.06 E19H-N 118.377 7.52 L20H-N 118.101 7.741 E21H-N 116.13 7.747 T22H-N 106.131 7.446 L23H-N 120.178 7.538 I24H-N 113.99 8.904 C25H-N 117.755 9.021 L26H-N 119.952 8.778 F27H-N 116.116 7.827 L29H-N 120.206 8.365 S30H-N 117.22 8.652 D31H-N 121.514 8.587 K32H-N 117.99 8.053 V33H-N 119.57 7.333 S34H-N 118.908 7.099 S36H-N 111.48 8.172 L37H-N 123.898 7.751 I38H-N 119.411 7.636 C39H-N 120.43 8.64 Q40H-N 118.263 8.213 Q40HE21-NE2 111.642 6.984 F41H-N 121.411 7.806 L42H-N 119.016 8.436 Q43H-N 116.21 8.236 Q43HE21-NE2 111.346 7.703 Q43HE22-NE2 111.346 6.715 E44H-N 117.05 8.926 E45H-N 114.95 8.054 I46H-N 115.649 6.749 H47H-N 111.685 6.652 I48H-N 118.069 7.963 N49H-N 123.991 9.222 E50H-N 125.549 8.971 K51H-N 116.019 8.424 D52H-N 117.576 7.908 I53H-N 120.515 7.48 R54H-N 125.353 9.063 K55H-N 116.212 7.569 I56H-N 122.685 8.229 L57H-N 126.095 9.279 L58H-N 122.946 8.925 V59H-N 123.378 8.637 S60H-N 124.152 8.755 D61H-N 119.224 9.011 F62H-N 110.179 6.702 N63H-N 114.98 7.708 N63HD21-ND2 111.4 7.858 N63HD22-ND2 111.4 7.096 G64H-N 102.117 7.722 A65H-N 120.262 8.785 I66H-N 121.244 9.39 I67H-N 127.255 9.291 I68H-N 124.623 8.681 F69H-N 126.1 9.086 R70H-N 115.935 8.268 D71H-N 113.892 7.673 S72H-N 118.59 9.103 K73H-N 125.872 8.332 F74H-N 123.145 8.482 A75H-N 119.451 7.835 A76H-N 117.626 7.68 K77H-N 118.273 7.302 M78H-N 117.578 7.785 L79H-N 120.984 8.197 M80H-N 114.071 7.018 I81H-N 118.056 7.615 L82H-N 116.858 8.16 N83H-N 117.015 7.058 N83HD21-ND2 113.366 7.674 N83HD22-ND2 113.366 6.874 G84H-N 116.878 9.053 S85H-N 116.615 7.666 Q86H-N 117.824 8.381 Q86HE21-NE2 112.665 7.077 Q86HE22-NE2 112.665 6.719 F87H-N 124.095 8.974 Q88H-N 126.108 9.139 Q88HE21-NE2 111.532 7.162 Q88HE22-NE2 111.532 6.458 G89H-N 103.132 8.58 K90H-N 119.783 7.457 V91H-N 121.517 8.256 I92H-N 124.746 8.788 R93H-N 119.723 8.5 S94H-N 110.386 7.7 G95H-N 106.738 8.36 T96H-N 111.493 9.274 I97H-N 121.293 9.339 N98H-N 117.358 8.162 N98HD21-ND2 113.107 7.67 N98HD22-ND2 113.107 6.984 D99H-N 121.336 7.865 M100H-N 122.932 7.874 K101H-N 118.764 7.994 R102H-N 118.974 8.088 Y103H-N 119.904 8.058 Y104H-N 119.418 7.846 N105H-N 117.373 8.499 N105HD21-ND2 111.572 7.516 N106H-N 118.101 8.081 N106HD21-ND2 112.082 7.515 N106HD22-ND2 112.082 6.841 Q107H-N 118.903 7.772 Q107HE21-NE2 110.781 7.358 Q107HE22-NE2 110.781 6.65 Q108H-N 118.101 7.854 Q108HE21-NE2 112.106 7.67 Q108HE22-NE2 112.106 7.003 N109H-N 117.229 7.932 N109HD21-ND2 112.825 7.447 N109HD22-ND2 112.825 6.803 H110H-N 118.498 7.961