Assignment w1 w2 C6H-N 127.86 8.929 S7H-N 113.603 7.874 N8H-N 126.242 10.3 K9H-N 123.443 9.04 T10H-N 110.238 8.505 G11H-N 110.687 8.261 R12H-N 118.195 7.53 F13H-N 121.999 8.934 L14H-N 129.844 8.112 A15H-N 125.218 8.217 T16H-N 119.166 9.125 E17H-N 128.804 9.279 I18H-N 129.204 8.816 V19H-N 127.121 8.608 D20H-N 122.874 9.05 F21H-N 113.487 6.532 T22H-N 112.247 9.637 Q23H-N 122.472 9.773 D24H-N 114.142 7.752 D25H-N 116.425 7.653 L26H-N 118.139 7.306 D27H-N 127.86 8.606 E28H-N 124.784 8.644 N29H-N 115.891 9.343 D30H-N 127.062 8.706 V31H-N 112.817 7.355 Y32H-N 120.94 9.688 L33H-N 119.741 9.096 L34H-N 125.792 9.84 D35H-N 126.711 9.745 T36H-N 118.606 8.582 W37H-N 122.07 9.083 D38H-N 117.884 8.67 Q39H-N 110.649 7.303 I40H-N 120.279 8.662 F41H-N 124.681 9.548 F42H-N 128.802 9.651 W43H-N 128.676 9.983 I44H-N 126.181 8.359 G45H-N 119.338 7.601 K46H-N 124.957 9.102 G47H-N 106.221 8.951 A48H-N 125.975 7.479 N49H-N 119.716 8.913 E50H-N 118.065 8.835 S51H-N 115.481 8.407 E52H-N 122.332 8.57 K53H-N 119.364 7.698 E54H-N 119.263 8.166 A55H-N 121.33 7.954 A56H-N 123.472 8.405 A57H-N 120.82 7.699 E58H-N 118.366 7.418 T59H-N 118.765 8.367 L64H-N 119.167 7.78 R65H-N 116.942 7.845 S66H-N 112.508 7.918 H67H-N 123.434 7.476 D74H-N 117.742 8.47 T75H-N 119.761 7.284 I78H-N 130.028 8.971 V79H-N 130.118 8.884 V80H-N 129.061 9.598 K81H-N 123.898 8.449 Q82H-N 121.249 6.478 G83H-N 118.64 10.061 F84H-N 127.152 7.803 T88H-N 107.142 7.311 F89H-N 119.053 7.434 T90H-N 107.268 7.675 G91H-N 106.675 7.866 W92H-N 117.998 7.02 F93H-N 118.938 7.963 M94H-N 121.846 8.824 A95H-N 120.795 8.047 W96H-N 121.049 8.482 D97H-N 128.976 8.844 L99H-N 118.462 8.361 C100H-N 119.337 7.057 W101H-N 115.831 7.616 S102H-N 116.085 7.945 D103H-N 122.412 8.471 K105H-N 121.938 8.298 S106H-N 116.665 8.366 Y107H-N 122.275 8.347 D108H-N 120.814 8.324 E109H-N 121.252 8.25 L110H-N 122.079 8.188 K111H-N 121.135 8.142 A112H-N 124.129 8.1 E113H-N 119.576 8.28 L114H-N 122.012 8.246 G115H-N 108.838 8.296 N117H-N 119.163 8.473 A118H-N 123.743 8.267 S119H-N 114.665 8.287 I120H-N 121.904 8.069 G121H-N 111.767 8.462 Q122H-N 119.731 8.161 L123H-N 123.272 8.315 V124H-N 120.931 8.207 S125H-N 119.196 8.407 G126H-N 110.724 8.442 L127H-N 121.361 8.143 T128H-N 114.147 8.208 S129H-N 118.082 8.347 K130H-N 123.045 8.421 N131H-N 119.566 8.452 E132H-N 121.592 8.377 V133H-N 120.996 8.142 F134H-N 124.383 8.423 T135H-N 117.215 8.106 A136H-N 126.784 8.345 T137H-N 113.495 8.246 T138H-N 116.599 8.195 T139H-N 117.447 8.226 L140H-N 125.641 8.356 V141H-N 123.329 8.219 T143H-N 115.66 8.28 K144H-N 124.643 8.344 L145H-N 125.514 8.321 E146H-N 124.218 8.857 T147H-N 121.191 8.088 F148H-N 128.975 7.837 L150H-N 122.744 8.635 D151H-N 112.805 8.546 V152H-N 116.623 7.313 L153H-N 117.667 7.359 V154H-N 117.5 8.058 T156H-N 114.711 7.452 A157H-N 130.861 9.082 A158H-N 124.357 8.723 E159H-N 114.887 9.252 D160H-N 118.109 7.82 L161H-N 122.276 7.191 R163H-N 122.642 8.518 G164H-N 110.387 8.781 V165H-N 119.989 7.147 D166H-N 130.937 8.701 S168H-N 113.887 8.661 R169H-N 125.182 7.972 E171H-N 117.29 10.836 N172H-N 120.477 7.95 H173H-N 116.599 8.049 L174H-N 117.852 6.94 S175H-N 120.35 10.088 D176H-N 122.523 9.26 E177H-N 119.424 8.932 D178H-N 122.575 8.05 F179H-N 121.765 9.313 K180H-N 117.965 7.985 A181H-N 122.305 7.852 V182H-N 117.258 8.234 F183H-N 113.263 8.347 G184H-N 108.694 8.298 M185H-N 112.75 7.582 T186H-N 107.335 8.25 R187H-N 120.736 8.593 S188H-N 113.804 8.191 A189H-N 125.389 7.624 F190H-N 120.818 8.274 A191H-N 117.954 7.936 N192H-N 113.42 7.196 L193H-N 122.033 7.449 L195H-N 125.883 8.897 W196H-N 114.663 8.032 K197H-N 123.691 6.124 Q198H-N 119.053 7.584 Q199H-N 115.286 8.388 N200H-N 119.114 8.052 L201H-N 121.219 8.52 K202H-N 117.106 8.453 K203H-N 120.422 8.726 E204H-N 119.85 8.153 K205H-N 113.863 7.537 G206H-N 106.109 7.677