Assignment w1 w2 M10H-N 121.787 8.245 S11H-N 119.324 9.463 G12H-N 113.655 9.596 T13H-N 119.102 8.591 L14H-N 126.143 8.997 L15H-N 118.018 7.01 A16H-N 122.439 8.661 F17H-N 115.16 8.826 D18H-N 121.026 8.562 F19H-N 126.576 9.86 G20H-N 114.556 5.987 T21H-N 106.402 7.891 S23H-N 114.295 7.054 I24H-N 125.484 9.072 G25H-N 114.583 8.831 V26H-N 120.752 8.76 A27H-N 126.426 8.521 V28H-N 116.347 8.42 G29H-N 112.296 8.502 Q30H-N 118.136 8.027 Q30HE21-NE2 111.58 7.49 Q30HE22-NE2 111.58 6.79 R31H-N 124.839 8.608 I32H-N 115.164 8.477 T33H-N 107.56 6.781 G34H-N 111.273 7.832 T35H-N 110.263 7.344 A36H-N 125.293 9.408 R37H-N 118.755 9.052 L39H-N 122.843 8.315 A41H-N 124.233 8.115 I42H-N 121.003 8.885 K43H-N 127.052 8.583 A44H-N 124.091 7.509 Q45H-N 118.816 7.94 Q45HE21-NE2 112.2 7.55 Q45HE22-NE2 112.2 6.79 G47H-N 106.356 8.84 T48H-N 117.35 7.808 D50H-N 115.77 7.448 W51H-N 128.346 8.049 W51HE1-NE1 129.6 10.308 N52H-N 117.372 8.718 N52HD21-ND2 115.241 7.08 N52HD22-ND2 115.241 8.1 I53H-N 120.929 7.642 I54H-N 118.784 6.969 E55H-N 119.757 8.468 R56H-N 118.007 7.678 L57H-N 120.83 8.101 L58H-N 118.911 8.109 K59H-N 120.178 8.001 E60H-N 118.289 8.159 W61H-N 115.163 7.937 W61HE1-NE1 128.8 10.027 Q62H-N 113.761 8.0 D64H-N 120.232 9.149 E65H-N 111.978 7.302 I66H-N 120.549 8.49 I67H-N 127.044 8.92 V68H-N 126.604 8.914 G69H-N 113.048 8.326 L70H-N 125.728 8.507 L72H-N 123.764 7.899 N73H-N 116.561 8.602 N73HD21-ND2 116.909 7.46 N73HD22-ND2 116.909 6.79 D75H-N 115.789 7.813 G76H-N 108.279 8.209 T77H-N 110.956 7.867 E78H-N 117.751 8.441 Q79H-N 118.826 8.708 Q79HE21-NE2 110.0 6.61 Q79HE22-NE2 110.0 6.99 L81H-N 112.632 8.113 T82H-N 117.937 8.142 A83H-N 121.115 8.457 R84H-N 117.219 7.429 A85H-N 125.328 8.224 R86H-N 116.029 7.892 K87H-N 119.532 7.785 F88H-N 121.38 7.897 A89H-N 120.396 8.107 N90H-N 115.514 7.968 N90HD21-ND2 112.45 6.9 N90HD22-ND2 112.45 7.63 R91H-N 122.298 8.576 I92H-N 119.632 8.126 H93H-N 119.156 7.779 G94H-N 106.229 8.542 R95H-N 118.283 7.788 F96H-N 112.17 7.552 G97H-N 109.281 8.061 V98H-N 115.036 6.568 E99H-N 126.592 8.677 V100H-N 124.581 8.03 K101H-N 126.982 9.098 L102H-N 122.619 8.41 H103H-N 123.77 8.507 D104H-N 129.18 8.175 E105H-N 126.13 8.364 R106H-N 120.418 8.612 L107H-N 119.453 7.894 S108H-N 114.865 8.009 T109H-N 114.578 7.97 V110H-N 121.445 8.062 E111H-N 123.056 8.465 A112H-N 124.237 8.17 G115H-N 110.379 8.261 L116H-N 120.928 7.863 F117H-N 119.265 8.109 E118H-N 121.442 8.244 A133H-N 124.164 7.972 S134H-N 113.681 8.432 A135H-N 124.311 7.624 V136H-N 117.449 7.146 I137H-N 118.599 6.986 I138H-N 120.518 7.856 L139H-N 119.508 7.365 E140H-N 116.692 8.475 S141H-N 114.511 8.146 Y142H-N 124.17 8.142 F143H-N 118.29 8.36 E144H-N 119.069 7.904 Q145H-N 116.649 7.917 Q145HE21-NE2 112.261 6.87 Q145HE22-NE2 112.261 7.6 G146H-N 107.376 7.825 Y147H-N 119.893 7.744