Assignment w1 w2 M3H-N 123.019 8.492 E4H-N 126.771 8.584 L5H-N 124.527 8.299 F6H-N 120.933 9.058 V8H-N 119.252 8.414 E9H-N 126.572 7.62 L10H-N 122.243 8.841 E11H-N 122.249 8.555 K12H-N 124.529 8.494 D13H-N 123.621 7.53 S14H-N 115.266 8.47 E15H-N 119.525 8.353 G16H-N 108.216 7.938 L17H-N 123.805 9.158 G18H-N 105.069 8.772 I19H-N 111.843 7.053 S20H-N 116.701 8.173 I21H-N 115.607 8.434 I22H-N 119.008 8.881 G23H-N 112.984 8.399 M24H-N 122.059 8.841 G25H-N 110.537 8.577 A26H-N 124.197 8.325 G27H-N 108.452 8.373 A28H-N 123.783 8.223 D29H-N 118.22 8.306 M30H-N 119.443 8.117 G31H-N 108.828 8.241 L32H-N 121.251 7.892 E33H-N 120.473 8.406 K34H-N 121.282 7.961 L35H-N 122.526 8.139 G36H-N 108.682 8.296 I37H-N 122.395 8.403 F38H-N 124.242 8.792 V39H-N 119.891 8.882 K40H-N 133.071 9.245 T41H-N 107.291 7.149 V42H-N 122.033 8.276 T43H-N 123.575 7.968 E44H-N 133.185 9.226 G45H-N 116.666 9.244 G46H-N 107.175 7.658 A47H-N 120.647 8.791 A48H-N 119.167 7.708 H49H-N 124.956 9.233 R50H-N 117.458 8.571 D51H-N 117.66 7.384 G52H-N 103.672 7.412 R53H-N 119.108 7.764 I54H-N 120.524 8.828 Q55H-N 125.702 9.012 V56H-N 119.278 8.218 N57H-N 120.108 9.17 N57HD21-ND2 112.715 7.53 N57HD22-ND2 112.715 6.653 D58H-N 121.355 7.915 L59H-N 122.346 8.946 L60H-N 124.874 8.88 V61H-N 124.409 8.195 E62H-N 118.103 7.645 V63H-N 121.718 8.306 D64H-N 128.765 9.599 G65H-N 103.874 8.399 T66H-N 120.011 8.299 S67H-N 121.69 8.823 L68H-N 125.444 8.237 V69H-N 124.874 7.974 G70H-N 117.673 8.522 V71H-N 111.201 7.011 T72H-N 108.217 7.903 Q73H-N 121.273 9.066 Q73HE21-NE2 111.74 7.517 Q73HE22-NE2 111.74 6.785 S74H-N 113.075 8.452 F75H-N 124.986 7.965 A76H-N 121.67 8.301 A77H-N 118.681 8.697 S78H-N 115.622 7.568 V79H-N 123.083 7.569 L80H-N 118.096 8.019 N82H-N 116.285 7.259 N82HD21-ND2 113.203 7.42 N82HD22-ND2 113.203 6.726 T83H-N 110.205 6.955 K84H-N 121.713 8.772 G85H-N 108.14 8.234 R86H-N 122.137 7.591 V87H-N 128.353 9.102 F89H-N 122.951 9.445 M90H-N 120.015 8.362 I91H-N 128.827 8.666 G92H-N 110.596 9.267 R93H-N 125.052 8.839 E94H-N 128.936 8.776 R95H-N 126.208 8.669 G97H-N 109.092 8.422 E98H-N 120.66 8.238 Q99H-N 121.343 8.442 S100H-N 117.671 8.34 E101H-N 123.519 8.519 V102H-N 121.068 8.033 A103H-N 126.696 8.199 Q104H-N 119.139 8.099 L105H-N 123.256 8.058 I106H-N 121.948 8.037 Q107H-N 124.104 8.262 T109H-N 116.157 8.118 L110H-N 124.717 8.174 E111H-N 121.667 8.253 Q112H-N 121.601 8.198 E113H-N 128.098 8.01