Assignment w1 w2 Q2H-N 118.156 7.957 F3H-N 119.84 7.242 K4H-N 127.256 11.595 E5H-N 129.456 9.03 G6H-N 116.5 8.961 E7H-N 120.634 7.595 H8H-N 114.842 8.608 Y9H-N 110.606 7.397 Q10H-N 119.601 9.342 V11H-N 125.702 9.383 L12H-N 128.926 9.374 K13H-N 117.561 8.446 T14H-N 111.911 7.553 A16H-N 122.19 8.448 S17H-N 114.983 7.838 S18H-N 122.184 8.555 S19H-N 116.09 7.716 V21H-N 125.049 9.139 V22H-N 126.799 8.992 S23H-N 121.289 9.435 E24H-N 121.986 8.553 F25H-N 129.022 9.839 F26H-N 122.726 9.087 S27H-N 112.262 7.604 F28H-N 130.55 11.191 Y29H-N 113.797 8.467 C30H-N 125.295 7.732 H32H-N 126.715 9.579 C33H-N 129.326 10.518 N34H-N 118.293 7.849 N34HD21-ND2 113.146 7.49 N34HD22-ND2 113.146 6.803 T35H-N 113.43 7.929 F36H-N 120.188 7.926 E37H-N 120.009 7.24 I39H-N 118.254 7.204 I40H-N 121.339 7.436 A41H-N 121.137 8.205 Q42H-N 116.413 7.247 L43H-N 122.449 8.729 K44H-N 116.202 8.226 Q45H-N 115.154 7.181 Q46H-N 114.954 7.547 Q46HE21-NE2 110.966 7.063 Q46HE22-NE2 110.966 6.928 L47H-N 121.049 7.066 E49H-N 121.766 8.565 G50H-N 112.18 8.772 A51H-N 122.092 7.815 K52H-N 121.637 7.853 F53H-N 122.459 8.724 Q54H-N 127.856 8.521 K55H-N 126.844 8.549 N56H-N 119.928 8.717 H57H-N 112.645 11.389 V58H-N 117.384 7.338 S59H-N 117.855 9.904 F60H-N 115.28 6.939 M61H-N 118.907 6.705 G62H-N 108.252 8.543 G63H-N 111.539 8.58 M65H-N 117.966 7.81 G66H-N 110.005 7.91 Q67H-N 120.388 8.461 A68H-N 122.864 8.05 M69H-N 118.924 8.973 S70H-N 118.41 8.583 K71H-N 122.803 8.771 A72H-N 125.935 9.537 Y73H-N 119.907 8.73 A74H-N 120.111 8.784 T75H-N 117.177 8.664 M76H-N 121.373 8.35 I77H-N 117.512 7.409 A78H-N 124.197 8.59 L79H-N 113.853 8.32 E80H-N 116.666 8.097 V81H-N 108.017 8.512 E82H-N 125.518 8.814 D83H-N 116.39 8.67 K84H-N 116.685 7.511 M85H-N 113.214 8.554 V86H-N 122.223 8.841 V88H-N 116.913 6.754 M89H-N 121.176 8.341 F90H-N 117.004 8.369 N91H-N 116.941 8.561 N91HD21-ND2 113.57 7.929 N91HD22-ND2 113.57 7.088 R92H-N 122.009 8.739 I93H-N 114.698 7.461 H94H-N 115.268 8.448 T95H-N 117.193 8.172 L96H-N 118.257 8.375 R97H-N 109.733 6.645 K98H-N 117.472 8.234 K101H-N 123.434 8.791 D102H-N 113.773 7.602 E103H-N 117.255 9.062 Q104H-N 122.652 8.377 E105H-N 122.582 8.895 L106H-N 119.758 7.839 R107H-N 118.955 7.68 Q108H-N 119.329 7.911 I109H-N 118.038 7.654 F110H-N 115.367 7.241 L111H-N 121.297 7.9 D112H-N 121.156 9.09 E113H-N 117.077 7.335 G114H-N 106.475 8.052 I115H-N 122.735 7.496 D116H-N 127.728 8.497 A117H-N 129.836 8.776 A118H-N 118.075 8.215 K119H-N 118.693 8.052 F120H-N 120.152 8.615 D121H-N 119.731 9.136 A122H-N 119.917 7.735 A123H-N 118.908 7.533 Y124H-N 120.191 9.091 N125H-N 109.692 7.003 G126H-N 107.645 7.634 F127H-N 119.023 8.419 A128H-N 124.731 8.47 V129H-N 120.698 8.579 D130H-N 119.439 7.252 S131H-N 111.959 8.276 M132H-N 122.54 7.996 V133H-N 116.928 7.917 R134H-N 117.154 7.696 R135H-N 120.03 7.702 F136H-N 120.599 8.803 D137H-N 116.293 8.044 K138H-N 122.374 8.591 Q139H-N 117.325 8.909 F140H-N 120.749 8.038 Q141H-N 119.345 8.543 D142H-N 121.238 9.464 S143H-N 112.071 7.486 G144H-N 107.713 7.56 L145H-N 118.798 6.834 T146H-N 106.142 8.306 G147H-N 108.669 7.549 V148H-N 108.566 8.256 A150H-N 123.462 8.512 V151H-N 125.807 9.452 V152H-N 127.144 9.406 V153H-N 130.199 10.142 N154H-N 128.3 10.446 N154HD21-ND2 108.121 7.545 N154HD22-ND2 108.121 6.482 N155H-N 113.132 9.369 N155HD21-ND2 110.5 7.901 N155HD22-ND2 110.5 6.943 R156H-N 117.579 7.581 Y157H-N 117.919 8.398 L158H-N 127.968 8.873 V159H-N 128.984 9.024 Q160H-N 128.096 8.416 G161H-N 112.588 8.513 Q162H-N 118.724 9.04 S163H-N 114.907 8.153 A164H-N 125.259 7.727 K165H-N 121.664 9.199 S166H-N 111.005 7.775 L167H-N 123.626 8.915 D168H-N 115.533 8.057 E169H-N 119.402 7.743 Y170H-N 121.332 7.953 F171H-N 116.984 8.433 D172H-N 120.487 8.342 L173H-N 124.115 8.327 V174H-N 119.562 7.957 N175H-N 116.396 8.363 N175HD21-ND2 108.657 7.308 N175HD22-ND2 108.657 7.081 Y176H-N 121.634 8.427 L177H-N 121.521 8.313 L178H-N 117.148 7.87 T179H-N 107.737 7.608 L180H-N 124.635 7.261 K181H-N 127.285 7.886