Assignment w1 w2 F2H-N 118.067 9.553 G4H-N 110.344 10.439 D5H-N 114.78 8.21 T6H-N 119.629 7.904 R7H-N 126.273 8.669 I8H-N 119.97 9.412 L9H-N 127.101 7.663 V10H-N 120.491 9.028 Q11H-N 119.325 8.92 Q11HE21-NE2 110.156 7.074 Q11HE22-NE2 110.156 6.69 I12H-N 124.679 8.268 D13H-N 130.512 9.884 G14H-N 101.663 8.665 V15H-N 121.637 7.785 Q17H-N 119.254 9.403 K18H-N 120.137 8.436 I19H-N 120.022 8.251 T20H-N 112.214 8.193 L21H-N 122.5 8.465 R22H-N 117.339 8.106 E23H-N 118.237 7.368 L24H-N 121.337 8.487 Y25H-N 118.548 8.032 E26H-N 111.954 7.127 L27H-N 120.345 7.879 F28H-N 119.355 7.544 E29H-N 118.96 9.58 D30H-N 118.069 8.478 E31H-N 122.428 8.18 R32H-N 127.0 9.528 Y33H-N 123.877 8.509 E34H-N 127.203 8.555 N35H-N 122.073 8.859 N35HD21-ND2 113.302 6.739 N35HD22-ND2 113.302 7.449 M36H-N 106.082 7.718 V37H-N 115.552 7.33 Y38H-N 120.94 8.861 V39H-N 120.601 9.058 R40H-N 123.244 8.879 R40HE-NE 86.32 6.716 K41H-N 116.905 7.631 K42H-N 121.344 8.482 K44H-N 118.908 8.719 R45H-N 114.464 7.106 E46H-N 121.034 8.288 I47H-N 128.537 8.248 K48H-N 125.466 8.744 V49H-N 118.865 9.102 Y50H-N 124.29 6.934 S51H-N 116.945 8.805 D53H-N 125.141 8.409 L54H-N 126.485 8.434 E55H-N 117.119 8.279 T56H-N 105.028 7.174 G57H-N 112.264 8.788 K58H-N 118.511 7.383 V59H-N 122.15 8.08 V60H-N 123.76 8.671 L61H-N 122.179 7.896 T62H-N 116.711 8.83 D63H-N 122.789 7.713 I64H-N 120.112 9.061 E65H-N 127.496 9.235 D66H-N 111.476 7.595 V67H-N 111.539 7.934 I68H-N 121.104 8.377 K69H-N 126.446 9.166 A70H-N 128.47 8.992 A72H-N 124.566 7.812 T73H-N 111.093 7.436 D74H-N 117.911 8.179 H75H-N 114.725 7.995 L76H-N 120.372 8.943 I77H-N 119.521 8.894 R78H-N 125.146 8.844 F79H-N 126.774 8.919 E80H-N 121.18 8.778 L81H-N 124.125 9.384 E82H-N 117.357 8.515 D83H-N 117.09 7.585 G84H-N 107.697 8.059 R85H-N 120.996 7.605 R85HE-NE 86.44 9.033 S86H-N 112.987 8.339 F87H-N 115.739 8.854 E88H-N 120.234 8.762 T89H-N 106.224 8.77 T90H-N 108.638 8.328 V91H-N 117.802 8.91 D92H-N 112.856 8.065 H93H-N 123.01 7.388 V95H-N 124.325 9.378 L96H-N 124.577 6.633 V97H-N 123.895 9.304 Y98H-N 123.887 8.775 E99H-N 129.272 8.741 N100H-N 124.096 9.089 N100HD21-ND2 111.855 7.434 N100HD22-ND2 111.855 6.759 G101H-N 101.219 7.007 R102H-N 116.982 6.912 F103H-N 118.371 8.489 I104H-N 121.419 9.488 E105H-N 121.78 8.163 K106H-N 123.867 8.685 R107H-N 121.523 8.682 A108H-N 125.118 8.677 F109H-N 111.0 7.888 E110H-N 119.497 8.054 V111H-N 123.241 7.282 K112H-N 126.742 8.531 E113H-N 121.25 8.922 G114H-N 114.037 9.123 D115H-N 122.479 8.085 K116H-N 118.748 8.459 V117H-N 116.096 8.96 L118H-N 126.128 9.182 V119H-N 122.624 8.631 S120H-N 117.761 8.165 E121H-N 125.422 8.423 L122H-N 123.302 7.782 E123H-N 123.1 8.412 L124H-N 123.444 8.096 V125H-N 118.847 7.805 E126H-N 123.76 8.414 Q127H-N 121.128 8.31 S128H-N 116.594 8.295 S129H-N 117.431 8.296 S130H-N 117.258 8.246 S131H-N 117.427 8.181 Q132H-N 121.418 8.251 D133H-N 119.999 8.144 N134H-N 118.775 8.05 N134HD21-ND2 112.031 6.853 N134HD22-ND2 112.031 7.518 K136H-N 120.399 8.222 N137H-N 119.287 8.215 E138H-N 120.92 8.335 N139H-N 118.748 8.326 N139HD21-ND2 112.017 7.51 N139HD22-ND2 112.017 6.818 L140H-N 122.247 8.102 G141H-N 108.612 8.251 S142H-N 116.388 8.073 E144H-N 120.028 8.354 H145H-N 117.219 8.123 D146H-N 121.46 8.194 Q147H-N 118.926 8.517 Q147HE21-NE2 110.397 7.311 Q147HE22-NE2 110.397 6.699 L148H-N 121.167 7.884 L149H-N 124.241 9.125 E150H-N 120.5 9.654 I151H-N 122.691 8.998 K152H-N 130.884 9.152 N153H-N 114.605 7.925 N153HD21-ND2 112.211 6.711 N153HD22-ND2 112.211 7.685 I154H-N 124.832 8.528 K155H-N 126.186 8.524 Y156H-N 123.426 8.585 V157H-N 118.598 8.827 R158H-N 122.908 8.397 A159H-N 126.397 8.08 N160H-N 119.368 8.573 D161H-N 117.691 7.57 D162H-N 118.599 8.499 F163H-N 116.943 7.791 V164H-N 112.967 8.986 F165H-N 115.552 9.424 S166H-N 113.051 9.098 L167H-N 119.627 9.495 N168H-N 117.468 8.348 A169H-N 129.769 9.362 K170H-N 120.949 8.596 K171H-N 124.684 8.268 H173H-N 118.476 9.321 V175H-N 122.238 7.574 I176H-N 121.57 9.289 I177H-N 119.988 9.342 N178H-N 118.529 9.109 E179H-N 125.894 8.088 N180H-N 116.507 7.843 N180HD21-ND2 112.424 6.765 N180HD22-ND2 112.424 7.359 I181H-N 118.843 8.66 V182H-N 127.778 8.637 T183H-N 122.85 9.11 H184H-N 120.0 7.69