Assignment w1 w2 S3H-N 118.224 8.608 G4H-N 110.897 8.494 S5H-N 115.475 8.25 S6H-N 117.737 8.303 G7H-N 110.496 7.863 K9H-N 122.854 8.427 K10H-N 124.158 8.334 M13H-N 118.762 8.404 G15H-N 107.175 9.217 Y16H-N 123.978 8.088 Q17H-N 118.997 8.558 Q17HE21-NE2 112.192 7.537 Q17HE22-NE2 112.192 6.963 K18H-N 120.945 7.651 F19H-N 121.744 8.267 S20H-N 113.205 8.435 Q21H-N 119.238 7.909 Q21HE21-NE2 110.902 7.396 Q21HE22-NE2 110.902 6.724 E22H-N 120.862 7.971 L23H-N 120.104 7.639 L24H-N 118.673 8.4 S25H-N 113.504 7.984 N26H-N 119.188 7.825 N26HD21-ND2 110.386 7.573 N26HD22-ND2 110.386 6.843 G27H-N 106.4 7.546 E28H-N 121.297 8.604 L29H-N 115.272 8.759 N30H-N 118.191 7.438 N30HD21-ND2 111.458 7.729 N30HD22-ND2 111.458 7.19 L32H-N 122.97 7.349 L34H-N 123.426 8.605 K35H-N 116.803 8.846 E36H-N 118.438 7.751 R37H-N 122.261 8.735 R37HE-NE 120.516 6.613 M38H-N 114.15 8.049 V39H-N 122.15 7.559 E40H-N 122.012 7.918 I41H-N 120.871 8.488 G42H-N 106.924 8.107 S43H-N 118.646 8.309 R44H-N 121.145 8.701 W45H-N 120.729 8.738 W45HE1-NE1 128.348 10.086 Q46H-N 114.342 7.736 Q46HE21-NE2 112.174 7.617 Q46HE22-NE2 112.174 6.914 R47H-N 114.468 7.247 I48H-N 117.64 7.085 S49H-N 119.404 8.537 Q50H-N 121.584 8.99 Q50HE21-NE2 112.885 7.768 Q50HE22-NE2 112.885 6.89 S51H-N 113.471 8.52 Q52H-N 124.138 7.873 Q52HE21-NE2 112.116 7.59 Q52HE22-NE2 112.116 6.889 K53H-N 121.308 8.517 E54H-N 119.656 8.374 H55H-N 120.753 7.954 Y56H-N 117.607 8.22 K57H-N 121.558 8.318 K58H-N 120.12 8.239 L59H-N 119.794 8.238 A60H-N 122.332 8.281 E61H-N 118.868 8.326 E62H-N 120.696 8.238 Q63H-N 119.311 8.079 Q63HE21-NE2 111.46 7.691 Q63HE22-NE2 111.46 6.961 Q64H-N 120.721 8.491 Q64HE21-NE2 110.364 7.377 Q64HE22-NE2 110.364 6.492 R65H-N 121.033 8.112 Q66H-N 118.071 8.155 Q66HE21-NE2 111.994 7.616 Q66HE22-NE2 111.994 6.88 Y67H-N 120.716 8.29 K68H-N 118.717 7.747 V69H-N 118.609 7.399 H70H-N 118.862 8.2 L71H-N 123.591 9.154 D72H-N 118.915 7.952 L73H-N 118.59 7.788 W74H-N 122.251 8.352 W74HE1-NE1 129.993 9.858 V75H-N 120.455 8.85 K76H-N 118.038 7.655 S77H-N 114.25 7.552 L78H-N 122.264 6.96 S79H-N 118.62 9.092 Q81H-N 117.131 8.701 Q81HE21-NE2 112.323 7.616 Q81HE22-NE2 112.323 6.913 D82H-N 122.577 7.856 R83H-N 122.97 8.902 A84H-N 121.576 7.929 A85H-N 120.75 7.77 Y86H-N 120.955 8.235 K87H-N 119.304 8.173 E88H-N 119.718 8.03 Y89H-N 121.227 8.075 I90H-N 117.582 8.097 S91H-N 116.695 7.872 N92H-N 119.63 8.065 N92HD21-ND2 113.062 7.623 N92HD22-ND2 113.062 6.967 K93H-N 121.047 8.016 R94H-N 120.824 8.09 K95H-N 122.037 8.186 S96H-N 116.461 8.23 G97H-N 110.559 8.2 S99H-N 116.309 8.533 S100H-N 117.897 8.441 G101H-N 116.807 8.048