Assignment w1 w2 G2H-N 120.4 8.516 Q3H-N 119.856 8.59 S4H-N 117.336 8.146 T6H-N 114.274 8.136 M7H-N 123.577 8.15 Q9H-N 121.759 8.489 Q9HE21-NE2 112.355 7.67 Q9HE22-NE2 112.355 6.691 G10H-N 110.812 8.47 F11H-N 119.898 8.045 S12H-N 117.109 8.614 Q13H-N 122.851 8.532 Q13HE21-NE2 112.051 7.463 Q13HE22-NE2 112.051 6.803 M14H-N 126.267 8.91 T15H-N 114.456 8.718 S16H-N 114.226 7.815 F17H-N 122.066 8.878 Q18H-N 127.659 7.826 Q18HE21-NE2 111.924 7.291 Q18HE22-NE2 111.924 6.786 S19H-N 121.659 8.257 N20H-N 115.906 8.747 N20HD21-ND2 112.879 7.507 N20HD22-ND2 112.879 6.828 K21H-N 117.458 7.074 F22H-N 120.202 7.708 Q23H-N 110.177 6.899 Q23HE21-NE2 112.722 7.746 Q23HE22-NE2 112.722 7.265 G24H-N 109.481 9.531 E25H-N 120.325 8.564 W26H-N 126.241 9.034 W26HE1-NE1 129.144 8.648 F27H-N 120.466 9.795 V28H-N 123.376 8.669 L29H-N 127.221 8.745 G30H-N 103.912 7.384 L31H-N 124.218 8.822 A32H-N 124.489 9.114 D33H-N 122.276 7.919 N34H-N 123.137 8.81 N34HD21-ND2 111.415 7.555 N34HD22-ND2 111.415 6.936 T35H-N 113.526 9.831 Y36H-N 124.108 7.835 K37H-N 122.104 7.899 R38H-N 121.905 8.309 E39H-N 118.645 8.579 H40H-N 118.248 8.219 R41H-N 122.229 8.129 L43H-N 121.673 8.155 L44H-N 122.961 7.88 T49H-N 121.0 8.935 L50H-N 127.842 8.817 F51H-N 124.677 8.857 K52H-N 126.12 9.109 L53H-N 130.211 8.942 R54H-N 126.383 8.843 D55H-N 120.103 8.427 N56H-N 115.26 8.299 N56HD21-ND2 111.066 7.487 N56HD22-ND2 111.066 6.567 S57H-N 108.486 8.174 E58H-N 116.855 7.438 F59H-N 115.342 8.52 Q60H-N 122.825 9.551 Q60HE21-NE2 111.008 7.168 Q60HE22-NE2 111.008 6.757 V61H-N 131.512 9.044 T62H-N 122.143 8.573 N63H-N 124.984 8.465 S64H-N 115.48 8.819 M65H-N 125.812 9.156 R67H-N 126.453 8.381 G68H-N 116.785 9.038 K69H-N 124.69 8.77 H70H-N 117.252 8.035 C71H-N 123.828 8.814 S72H-N 121.29 9.021 T73H-N 116.809 8.524 W74H-N 124.403 8.403 W74HE1-NE1 129.249 10.278 S75H-N 116.643 8.853 Y76H-N 117.437 8.463 T77H-N 116.569 8.896 L78H-N 125.367 9.48 I79H-N 123.377 9.349 T81H-N 111.825 7.705 N82H-N 115.482 8.242 N82HD21-ND2 111.863 7.499 N82HD22-ND2 111.863 6.831 K83H-N 121.851 7.847 G85H-N 111.572 8.492 Q86H-N 119.178 7.284 Q86HE21-NE2 111.613 7.368 Q86HE22-NE2 111.613 6.793 F87H-N 123.39 9.405 T88H-N 114.701 9.524 R89H-N 124.093 8.342 D90H-N 126.448 8.861 N91H-N 124.592 8.613 N91HD21-ND2 112.174 7.485 N91HD22-ND2 112.174 6.885 R92H-N 121.646 8.417 G93H-N 109.955 8.608 S94H-N 115.121 7.987 G95H-N 110.3 8.245 G97H-N 109.466 8.53 A98H-N 123.068 7.632 D99H-N 120.319 8.215 K100H-N 121.388 8.151 E101H-N 123.777 8.714 N102H-N 124.926 8.659 N102HD21-ND2 110.998 7.31 N102HD22-ND2 110.998 6.657 I103H-N 124.175 8.996 Q104H-N 125.58 9.376 Q104HE21-NE2 109.326 7.441 Q104HE22-NE2 109.326 6.51 V105H-N 127.598 8.959 I106H-N 130.448 8.622 E107H-N 113.908 7.144 T108H-N 116.916 8.372 D109H-N 123.846 7.161 Y110H-N 116.878 9.033 V111H-N 113.629 8.909 K112H-N 122.919 9.202 F113H-N 120.279 9.9 A114H-N 122.692 9.193 L115H-N 120.693 8.749 V116H-N 123.649 8.907 L117H-N 130.193 9.216 S118H-N 122.59 9.508 L119H-N 127.22 8.83 R120H-N 125.723 9.008 Q121H-N 125.684 8.786 Q121HE21-NE2 111.332 7.43 Q121HE22-NE2 111.332 6.678 A122H-N 127.778 8.318 S123H-N 117.494 8.877 N124H-N 115.604 8.527 N124HD21-ND2 112.653 7.499 N124HD22-ND2 112.653 6.812 Q125H-N 117.367 7.635 Q125HE21-NE2 111.003 7.299 Q125HE22-NE2 111.003 6.722 N126H-N 121.419 8.515 N126HD21-ND2 112.027 7.389 N126HD22-ND2 112.027 6.673 I127H-N 126.31 9.102 T128H-N 126.627 8.792 R129H-N 124.684 8.935 V130H-N 126.119 9.307 S131H-N 120.279 9.402 L132H-N 125.851 8.437 L133H-N 128.084 9.335 G134H-N 106.576 9.796 R135H-N 120.799 8.298 D136H-N 117.134 8.177 W137H-N 114.554 7.179 W137HE1-NE1 128.613 9.48 K138H-N 120.817 7.365 I139H-N 121.094 7.876 T140H-N 114.634 7.848 H141H-N 121.208 9.066 K142H-N 118.446 8.281 T143H-N 115.743 7.4 I144H-N 122.812 7.458 D145H-N 119.833 8.283 R146H-N 122.098 7.709 F147H-N 119.936 8.08 I148H-N 120.951 8.962 A149H-N 124.007 8.453 L150H-N 119.64 8.175 T151H-N 113.286 8.452 K152H-N 122.419 7.72 T153H-N 111.343 7.665 Q154H-N 116.998 7.021 Q154HE21-NE2 112.584 7.006 Q154HE22-NE2 112.584 6.748 N155H-N 113.261 7.937 N155HD21-ND2 112.772 7.476 N155HD22-ND2 112.772 6.783 L156H-N 116.933 7.296 T157H-N 113.369 8.787 K158H-N 119.248 8.628 N159H-N 115.725 7.939 N159HD21-ND2 113.297 7.624 N159HD22-ND2 113.297 7.101 N160H-N 114.47 8.05 F163H-N 123.079 8.716 D165H-N 120.976 8.46 T167H-N 112.803 8.079 D168H-N 119.664 8.014 W169H-N 121.299 7.587 W169HE1-NE1 128.322 9.802 L170H-N 118.886 7.765 L171H-N 118.983 7.405 K174H-N 121.539 8.638 V175H-N 118.868 7.74 C176H-N 118.425 8.068