Assignment w1 w2 E5H-N 123.725 8.834 G6H-N 110.453 8.467 R7H-N 120.856 8.041 A8H-N 125.859 8.326 V9H-N 120.627 8.128 L10H-N 127.265 8.304 T11H-N 114.995 8.06 T14H-N 116.57 7.584 V15H-N 120.782 6.957 K16H-N 121.077 8.012 D17H-N 120.169 8.833 F18H-N 122.658 7.98 L20H-N 120.725 8.42 Q21H-N 119.66 8.096 L23H-N 123.285 8.661 N24H-N 120.25 8.637 S25H-N 116.81 8.009 L26H-N 122.379 7.584 D27H-N 117.318 7.617 I28H-N 124.409 9.454 K29H-N 116.384 8.595 G30H-N 110.979 7.83 N31H-N 122.009 8.47 N31HD21-ND2 111.446 6.81 N31HD22-ND2 111.446 7.359 A32H-N 121.643 8.542 S33H-N 112.652 7.796 K34H-N 118.821 7.294 D35H-N 118.129 7.451 A37H-N 122.599 8.258 Y38H-N 122.192 7.636 A39H-N 124.612 8.419 R40H-N 118.207 8.079 Q41H-N 118.398 8.301 T42H-N 119.162 8.275 C43H-N 120.162 7.973 E44H-N 118.6 8.491 A45H-N 122.82 8.26 I46H-N 118.888 8.354 L47H-N 118.813 8.497 S48H-N 117.022 8.869 A49H-N 126.08 7.86 V50H-N 121.118 8.158 Y51H-N 121.918 8.939 S52H-N 116.685 8.777 N53H-N 118.734 8.581 N53HD21-ND2 113.659 7.064 N53HD22-ND2 113.659 7.661 N54H-N 116.474 7.745 K55H-N 122.784 8.99 D56H-N 119.198 8.038 Q57H-N 118.291 7.768 C58H-N 117.124 8.597 C59H-N 116.861 8.595 K60H-N 118.15 7.471 L61H-N 120.391 7.255 L62H-N 121.681 8.284 I63H-N 120.214 8.585 S64H-N 117.88 7.918 K65H-N 120.3 7.479 G66H-N 109.469 8.017 V67H-N 120.942 7.883 S68H-N 119.731 8.428 I69H-N 118.43 8.156 T70H-N 118.997 7.964 F72H-N 118.756 6.971 L73H-N 119.034 8.385 K74H-N 122.013 8.509 E75H-N 121.46 8.086 I76H-N 115.847 8.891 G77H-N 114.228 8.151 E78H-N 123.44 7.891 A79H-N 121.822 7.732 A80H-N 122.519 8.537 Q81H-N 120.795 8.266 Q81HE21-NE2 110.48 6.486 Q81HE22-NE2 110.48 7.12 N82H-N 119.978 8.532 N82HD21-ND2 112.704 7.025 N82HD22-ND2 112.704 7.569 A83H-N 121.272 7.607 G84H-N 101.939 7.391 L85H-N 120.586 7.352 G87H-N 109.307 8.367 E88H-N 116.773 6.947 I89H-N 123.854 8.794 K90H-N 128.994 8.439 G92H-N 102.451 8.304 V93H-N 120.07 7.711 F94H-N 131.859 9.605 T95H-N 126.632 8.229 G97H-N 111.308 8.687 G98H-N 108.942 8.391 A99H-N 122.127 8.24 G100H-N 109.117 8.382 A101H-N 121.324 7.64 F104H-N 115.582 8.024 V105H-N 119.323 7.443 V106H-N 120.809 7.78 L108H-N 119.462 7.102 I109H-N 118.782 7.985 A110H-N 124.782 8.89 S111H-N 111.667 7.897 A112H-N 125.548 8.04 S113H-N 113.896 8.033 I114H-N 120.684 7.065 K115H-N 121.183 7.001 Y116H-N 115.368 8.039 H118H-N 115.576 8.609 M119H-N 117.961 7.676 F120H-N 115.617 7.377 I121H-N 119.82 7.451 N122H-N 118.711 8.409 N124H-N 122.566 8.375 Q126H-N 118.655 7.907 V127H-N 118.24 8.232 S128H-N 117.261 7.7 F129H-N 121.826 8.438 K130H-N 122.707 8.339 A131H-N 121.304 8.184 Y132H-N 120.305 7.965 A133H-N 121.536 8.535 E134H-N 115.769 8.409 K135H-N 120.374 7.785 I136H-N 114.257 8.329 V137H-N 124.587 8.082 M138H-N 118.225 8.299 K139H-N 120.636 7.788 E140H-N 120.726 7.639 V141H-N 106.598 8.047 T142H-N 119.517 7.787 L144H-N 116.827 7.999 F145H-N 116.064 7.943 N146H-N 119.544 7.729 K147H-N 118.979 8.044 G148H-N 108.321 7.905 T149H-N 109.69 8.255 M150H-N 123.04 7.933 T152H-N 105.701 7.768 Q154H-N 115.987 8.321 Q155H-N 121.17 7.808 F156H-N 124.002 9.025 Q157H-N 118.454 8.383 L158H-N 120.0 7.596 T159H-N 117.981 8.312 I160H-N 118.16 8.305 E161H-N 121.623 8.777 N162H-N 118.311 8.586 I163H-N 122.73 7.822 A164H-N 121.931 8.768 N165H-N 115.268 8.573 K166H-N 120.718 7.596 Y167H-N 116.646 7.438 L168H-N 119.906 8.16 Q169H-N 117.76 7.819 N170H-N 118.364 7.959 N170HD21-ND2 113.137 6.884 N170HD22-ND2 113.137 7.594 A171H-N 124.828 7.982 S172H-N 121.408 7.882