Assignment w1 w2 T3H-N 118.505 8.35 S4H-N 116.335 8.884 I5H-N 119.108 8.358 A6H-N 130.925 8.909 V7H-N 123.741 8.78 H8H-N 128.02 8.85 A9H-N 123.617 7.642 L10H-N 124.499 7.934 M11H-N 121.853 8.155 G12H-N 112.504 8.536 L13H-N 119.941 7.807 T15H-N 112.804 8.697 G16H-N 112.075 9.266 Q17H-N 121.209 7.56 Q17HE21-NE2 113.115 6.794 Q17HE22-NE2 113.115 7.724 A19H-N 129.32 8.635 N20H-N 117.257 7.647 N20HD21-ND2 111.42 7.953 N20HD22-ND2 111.42 7.285 G21H-N 108.323 8.64 T22H-N 110.438 7.772 K23H-N 120.786 8.323 L24H-N 128.892 8.094 S26H-N 118.864 8.664 L29H-N 120.534 6.809 K31H-N 120.636 8.201 V32H-N 121.647 8.002 D33H-N 129.51 8.784 G34H-N 108.382 8.732 M35H-N 120.775 7.889 S36H-N 120.494 9.014 F37H-N 122.324 9.096 T38H-N 120.517 9.6 L39H-N 127.165 8.46 Y40H-N 124.552 9.642 R41H-N 124.206 9.549 V42H-N 126.32 8.599 N43H-N 128.137 8.256 N43HD21-ND2 110.823 7.441 N43HD22-ND2 110.823 6.213 E44H-N 113.373 8.791 I45H-N 118.302 6.897 D46H-N 128.507 8.595 L47H-N 123.2 8.21 T48H-N 110.396 8.561 T49H-N 109.801 7.571 A51H-N 120.473 8.535 G52H-N 108.766 8.2 W53H-N 122.918 7.654 W53HE1-NE1 129.24 10.08 D54H-N 120.354 8.562 A55H-N 122.707 8.109 A56H-N 121.612 8.586 S57H-N 109.732 7.635 K58H-N 119.094 7.322 I59H-N 122.112 7.224 K60H-N 126.063 8.374 L61H-N 126.291 8.876 E62H-N 115.715 9.325 E63H-N 115.498 7.694 L64H-N 119.137 8.161 Y65H-N 120.003 7.6 T66H-N 121.044 8.162 G68H-N 101.64 8.286 H69H-N 116.596 7.139 T71H-N 113.025 7.751 D72H-N 115.68 8.454 K73H-N 116.326 7.783 V74H-N 108.988 7.42 T75H-N 116.182 8.978 K76H-N 130.295 9.442 V77H-N 128.159 9.293 A78H-N 116.176 7.387 T79H-N 118.415 8.649 K80H-N 125.546 9.332 K81H-N 119.762 8.278 T82H-N 112.03 9.081 E83H-N 125.332 8.391 G84H-N 120.25 9.41 G85H-N 104.521 9.342 V86H-N 118.85 7.389 A87H-N 132.655 8.85 K88H-N 124.817 8.587 F89H-N 127.59 9.142 D90H-N 121.836 8.287 N91H-N 114.037 9.084 N91HD21-ND2 113.068 7.604 N91HD22-ND2 113.068 6.873 L92H-N 117.599 8.543 T93H-N 112.734 7.379 A95H-N 129.437 9.2 L96H-N 119.178 8.279 Y97H-N 123.645 8.578 L98H-N 122.649 9.299 V99H-N 127.697 8.8 V100H-N 124.232 8.695 Q101H-N 128.284 9.03 Q101HE21-NE2 109.56 6.985 E102H-N 128.395 8.258 L103H-N 122.998 8.67 N104H-N 118.203 8.535 A106H-N 130.968 8.437 E107H-N 119.411 8.729 A108H-N 122.677 8.411 V109H-N 114.643 7.634 V110H-N 121.99 8.571 R111H-N 125.824 8.461 S112H-N 118.777 8.544 Q113H-N 123.464 8.713 Q113HE21-NE2 109.83 6.619 F115H-N 114.138 7.952 L116H-N 121.542 8.5 V117H-N 118.527 9.196 A118H-N 130.92 8.526 A119H-N 124.27 8.23 Q121H-N 113.883 8.018 T122H-N 118.443 8.583 N123H-N 123.295 8.144 N123HD21-ND2 109.83 6.78 N123HD22-ND2 109.83 7.44 T125H-N 106.125 7.49 G126H-N 110.148 7.747 D127H-N 119.07 8.141 G128H-N 108.585 7.755 W129H-N 121.034 8.734 W129HE1-NE1 129.0 9.79 L130H-N 124.319 9.496 Q131H-N 122.539 8.559 Q131HE21-NE2 109.83 6.619 D132H-N 116.822 7.596 V133H-N 123.415 8.331 H134H-N 128.736 9.197 V135H-N 114.469 8.726 Y136H-N 122.567 8.865 K138H-N 118.555 8.43 H139H-N 119.803 8.448 Q140H-N 117.727 8.02 Q140HE21-NE2 111.69 6.75 Q140HE22-NE2 111.69 7.59 A141H-N 125.057 8.682 L142H-N 122.495 8.157 S143H-N 121.847 7.861