Assignment w1 w2 F3H-N 124.43 8.653 T4H-N 121.816 7.065 V5H-N 122.959 7.967 S6H-N 125.411 9.654 T7H-N 113.904 9.584 T8H-N 115.068 8.783 E9H-N 121.18 8.312 D10H-N 119.868 7.234 L11H-N 118.084 8.118 Q12H-N 116.291 7.986 Q12HE21-NE2 111.837 7.408 Q12HE22-NE2 111.837 6.935 R13H-N 120.946 7.256 R13HE-NE 84.358 7.48 Y14H-N 120.228 8.515 R15H-N 121.07 9.278 R15HE-NE 85.011 8.891 T16H-N 114.519 7.7 E17H-N 121.652 8.619 C18H-N 119.918 9.045 V19H-N 121.165 9.253 S20H-N 112.3 7.883 S21H-N 116.574 8.537 L22H-N 118.611 7.932 N23H-N 118.781 7.784 N23HD21-ND2 112.268 6.771 N23HD22-ND2 112.268 7.52 I24H-N 120.439 8.075 A26H-N 124.624 8.696 D27H-N 114.676 8.887 Y28H-N 118.776 7.421 V29H-N 117.633 6.832 E30H-N 114.563 7.272 K31H-N 119.156 6.737 F32H-N 120.87 8.325 K33H-N 116.178 7.849 K34H-N 117.787 7.502 W35H-N 119.245 8.283 W35HE1-NE1 129.564 10.294 E36H-N 121.285 7.577 F37H-N 119.303 8.102 E39H-N 122.594 8.485 D40H-N 122.172 7.95 D41H-N 120.19 8.821 T42H-N 118.03 8.113 T43H-N 119.806 8.219 M44H-N 119.235 8.711 C45H-N 113.581 8.289 Y46H-N 126.093 7.832 I47H-N 119.923 7.979 K48H-N 117.224 7.534 C49H-N 117.831 7.658 V50H-N 121.402 8.021 F51H-N 118.862 8.635 N52H-N 121.013 9.533 N52HD21-ND2 107.617 7.163 N52HD22-ND2 107.617 7.916 K53H-N 121.952 7.905 M54H-N 114.285 7.831 Q55H-N 112.952 7.852 Q55HE21-NE2 111.544 7.56 Q55HE22-NE2 111.544 6.671 L56H-N 111.354 8.323 F57H-N 118.384 7.034 D58H-N 132.851 7.888 D59H-N 124.99 8.643 T60H-N 112.253 8.151 E61H-N 120.924 9.14 G62H-N 112.358 8.238 L64H-N 126.293 7.738 V65H-N 123.197 7.636 D66H-N 117.841 8.405 N67H-N 121.139 7.359 N67HD21-ND2 110.014 7.065 N67HD22-ND2 110.014 8.181 L68H-N 121.183 8.335 V69H-N 117.927 8.347 H70H-N 117.924 7.736 Q71H-N 118.119 8.636 Q71HE21-NE2 109.784 6.484 Q71HE22-NE2 109.784 7.496 L72H-N 114.666 8.179 A73H-N 119.668 8.628 H74H-N 118.24 8.257 G75H-N 109.59 8.842 R76H-N 120.149 7.79 R76HE-NE 84.694 7.356 D77H-N 120.309 8.423 A78H-N 126.337 8.266 E79H-N 119.478 8.505 E80H-N 120.759 8.327 V81H-N 119.028 7.63 R82H-N 120.986 8.579 R82HE-NE 83.666 7.772 T83H-N 114.082 8.104 E84H-N 119.575 7.536 V85H-N 121.43 8.657 L86H-N 117.733 8.535 K87H-N 117.215 7.361 C88H-N 114.268 8.038 V89H-N 125.093 7.505 D90H-N 129.266 8.374 K91H-N 119.285 8.325 N92H-N 117.305 7.783 N92HD21-ND2 107.437 6.23 N92HD22-ND2 107.437 7.408 T93H-N 116.106 7.885 D94H-N 118.396 8.077 N95H-N 114.606 7.439 N95HD21-ND2 112.627 7.523 N95HD22-ND2 112.627 6.773 N96H-N 116.148 7.74 N96HD21-ND2 114.448 7.457 N96HD22-ND2 114.448 6.941 A97H-N 128.43 9.269 C98H-N 113.881 8.197 H99H-N 118.575 7.865 W100H-N 121.118 8.73 W100HE1-NE1 128.998 9.709 A101H-N 120.858 7.924 F102H-N 116.45 7.912 R103H-N 119.732 8.844 R103HE-NE 87.035 9.414 G104H-N 105.715 7.571 F105H-N 121.868 7.416 K106H-N 120.136 8.846 C107H-N 117.495 8.015 F108H-N 123.179 8.606 Q109H-N 116.099 8.668 Q109HE21-NE2 108.312 6.479 Q109HE22-NE2 108.312 6.075 K110H-N 118.717 6.972 N111H-N 109.757 7.395 N111HD21-ND2 114.375 6.921 N111HD22-ND2 114.375 7.822 N112H-N 115.375 7.321 N112HD21-ND2 117.08 7.205 N112HD22-ND2 117.08 6.167 L113H-N 122.931 7.922 S114H-N 112.274 8.844 L115H-N 123.548 7.288 I116H-N 118.889 7.717 K117H-N 117.321 8.044 A118H-N 118.861 7.971 S119H-N 114.087 7.812 I120H-N 112.678 6.869 K121H-N 123.268 7.497 K122H-N 125.113 8.648 D123H-N 128.208 8.143