Assignment w1 w2 D2H-N 120.838 8.324 Y3H-N 120.96 8.14 N4H-N 122.518 8.216 N4HD21-ND2 112.626 7.634 N4HD22-ND2 112.626 6.797 I5H-N 123.297 8.598 K6H-N 121.049 8.053 N7H-N 115.902 7.971 N7HD21-ND2 113.183 7.538 N7HD22-ND2 113.183 6.872 G8H-N 108.174 7.874 L9H-N 120.296 8.308 S11H-N 122.744 9.171 E12H-N 122.608 9.884 T13H-N 109.998 7.63 Y14H-N 115.078 7.35 I15H-N 120.166 7.122 T16H-N 117.992 8.175 C17H-N 119.571 8.648 A18H-N 121.398 8.847 E19H-N 119.189 7.923 A20H-N 123.62 8.716 N21H-N 116.424 8.078 N21HD21-ND2 111.716 7.494 N21HD22-ND2 111.716 6.764 E22H-N 119.251 7.644 M23H-N 121.533 8.605 A24H-N 119.716 8.1 K25H-N 115.157 7.292 T26H-N 107.348 7.232 D27H-N 123.695 8.563 S28H-N 119.003 8.512 A29H-N 125.49 8.515 Q30H-N 119.273 7.651 Q30HE21-NE2 111.806 7.406 Q30HE22-NE2 111.806 6.715 V31H-N 117.801 7.208 A32H-N 121.184 8.027 E33H-N 118.59 7.645 I34H-N 120.581 7.747 V35H-N 118.807 8.478 A36H-N 122.226 7.936 V37H-N 118.61 8.12 M38H-N 120.387 8.567 G39H-N 108.847 8.978 N40H-N 119.183 8.263 N40HD21-ND2 112.441 7.507 N40HD22-ND2 112.441 6.862 A41H-N 123.349 7.751 S42H-N 118.831 8.203 V43H-N 118.348 7.67 A44H-N 119.728 8.084 S45H-N 113.292 8.213 R46H-N 118.561 7.464 D47H-N 119.283 7.765 L48H-N 115.336 7.917 K49H-N 121.358 8.868 I50H-N 123.376 7.934 E51H-N 126.844 8.392 Q52H-N 123.718 8.469 Q52HE21-NE2 125.331 8.232 Q52HE22-NE2 125.331 7.777 S53H-N 117.72 7.703 E55H-N 116.834 8.403 L56H-N 122.616 7.712 S57H-N 113.994 8.351 A58H-N 122.63 7.74 K59H-N 119.633 7.782 V60H-N 120.664 8.321 V61H-N 118.003 7.627 E62H-N 119.246 7.757 K63H-N 119.912 7.929 L64H-N 122.012 8.873 N65H-N 116.156 8.101 N65HD21-ND2 111.976 7.451 N65HD22-ND2 111.976 6.851 Q66H-N 119.691 7.57 Q66HE21-NE2 110.504 7.414 Q66HE22-NE2 110.504 6.762 V67H-N 121.849 8.493 C68H-N 115.605 8.582 A69H-N 119.389 7.516 K70H-N 116.213 7.284 D71H-N 112.363 6.943 Q73H-N 110.235 7.379 Q73HE21-NE2 111.299 7.395 Q73HE22-NE2 111.299 6.774 M74H-N 117.469 8.001 L75H-N 121.412 8.767 L76H-N 127.003 9.055 I77H-N 119.068 9.803 T78H-N 119.612 6.468 A79H-N 124.978 7.871 I80H-N 120.245 9.256 D81H-N 123.395 7.973 D82H-N 118.501 9.26 T83H-N 119.184 7.864 M84H-N 118.836 8.667 R85H-N 117.422 8.43 A86H-N 119.846 7.577 I87H-N 116.849 7.895 G88H-N 108.084 8.478 K89H-N 120.102 7.869 K90H-N 122.172 8.239