Assignment w1 w2 M8H-N 119.738 8.121 S9H-N 120.013 8.952 E10H-N 122.902 8.81 V11H-N 120.014 7.9 T12H-N 118.261 7.687 R13H-N 120.934 8.237 S14H-N 114.255 8.037 L15H-N 124.846 7.689 L16H-N 115.568 7.93 Q17H-N 118.51 7.903 Q17HE21-NE2 111.82 7.466 Q17HE22-NE2 111.82 6.903 R18H-N 122.237 8.057 W19H-N 122.405 9.174 W19HE1-NE1 125.841 9.469 G20H-N 105.9 8.747 A21H-N 123.888 8.149 S22H-N 116.247 8.097 L23H-N 123.024 8.472 R24H-N 116.957 7.88 R25H-N 118.977 7.945 G26H-N 106.037 8.59 A27H-N 123.002 8.628 D28H-N 122.324 8.356 F29H-N 118.228 7.691 D30H-N 120.282 8.367 S31H-N 115.594 8.48 W32H-N 120.261 8.085 W32HE1-NE1 127.29 9.974 G33H-N 109.163 8.434 Q34H-N 124.055 8.755 Q34HE21-NE2 109.827 7.384 Q34HE22-NE2 109.827 6.758 L35H-N 119.744 7.407 V36H-N 117.967 7.955 E37H-N 120.307 8.756 A38H-N 121.563 7.912 I39H-N 115.949 8.295 D40H-N 117.217 7.722 E41H-N 118.373 7.67 Y42H-N 118.208 9.064 Q43H-N 117.454 8.857 Q43HE21-NE2 111.31 7.346 Q43HE22-NE2 111.31 6.948 I44H-N 121.344 8.216 L45H-N 121.116 8.15 A46H-N 120.613 8.86 R47H-N 115.565 7.7 H48H-N 121.04 7.888 L49H-N 119.489 8.519 Q50H-N 117.941 8.537 Q50HE21-NE2 110.202 7.214 Q50HE22-NE2 110.202 6.701 K51H-N 117.875 7.64 E52H-N 117.531 7.479 A53H-N 120.045 8.566 Q54H-N 112.622 7.579 Q54HE21-NE2 111.42 7.408 Q54HE22-NE2 111.42 6.82 A55H-N 124.219 7.413 S60H-N 113.513 7.751 E61H-N 123.09 8.709 F62H-N 117.643 7.941 T63H-N 112.975 8.745 E64H-N 120.347 9.103 E65H-N 118.679 8.717 Q66H-N 120.212 7.751 Q66HE21-NE2 109.854 7.517 Q66HE22-NE2 109.854 7.032 K67H-N 118.537 8.736 K68H-N 119.456 7.763 T69H-N 118.716 7.968 I70H-N 122.185 8.5 G71H-N 106.531 8.422 K72H-N 123.941 8.009 I73H-N 121.266 8.038 A74H-N 121.355 7.959 T75H-N 115.376 7.943 C76H-N 119.52 7.67 L77H-N 120.012 7.819 E78H-N 120.015 7.714 L79H-N 121.748 8.296 R80H-N 120.723 8.275 R80HE-NE 84.824 9.877 S81H-N 114.318 8.139 A82H-N 122.594 8.077 A83H-N 122.331 7.998 L84H-N 116.294 7.843 Q85H-N 116.684 7.645 Q85HE21-NE2 111.679 6.865 Q85HE22-NE2 111.679 7.111 S86H-N 114.267 7.649 T87H-N 115.258 8.419 Q88H-N 121.811 8.472 Q88HE21-NE2 112.951 7.553 Q88HE22-NE2 112.951 6.912 S89H-N 116.14 8.284 Q90H-N 121.252 8.292 Q90HE21-NE2 112.476 7.54 Q90HE22-NE2 112.476 6.856 E91H-N 120.282 8.378 E92H-N 122.363 8.598 F93H-N 122.51 7.556 K94H-N 127.544 8.631 L95H-N 125.712 8.973 E96H-N 114.998 8.96 D97H-N 118.494 6.411 L98H-N 121.752 7.47 K99H-N 115.913 8.331 K100H-N 118.27 7.48 L101H-N 114.052 8.108 E102H-N 119.746 7.558 I104H-N 117.751 6.415 L105H-N 117.463 7.825 K106H-N 112.629 7.647 N107H-N 113.965 7.428 N107HD21-ND2 115.974 7.91 N107HD22-ND2 115.974 7.132 I108H-N 121.041 7.115 L109H-N 116.011 8.307 T110H-N 105.914 7.809 Y111H-N 125.183 8.014 K113H-N 117.568 5.709 E114H-N 119.082 8.317 F117H-N 114.332 6.317 V119H-N 116.191 7.608 Q120H-N 121.018 8.506 Q120HE21-NE2 113.611 7.645 Q120HE22-NE2 113.611 6.815 I122H-N 122.962 7.702 S123H-N 119.31 8.165 G124H-N 110.109 8.203 S126H-N 116.515 8.534 S127H-N 117.896 8.336