Assignment w1 w2 D4H-N 122.517 8.577 H7H-N 122.356 8.395 F14H-N 117.31 8.358 Y16H-N 116.09 7.957 K17H-N 119.301 9.064 I18H-N 123.087 8.585 V19H-N 130.001 9.048 D20H-N 125.762 9.004 D21H-N 117.082 8.482 V22H-N 120.862 8.285 V23H-N 125.703 8.361 I24H-N 127.998 9.282 L25H-N 125.762 9.224 M26H-N 120.748 8.744 N28H-N 119.59 9.19 N28HD21-ND2 112.062 6.832 N28HD22-ND2 112.062 7.567 K29H-N 119.622 9.197 E34H-N 119.961 8.025 N35H-N 114.624 8.182 N35HD21-ND2 107.658 7.645 N35HD22-ND2 107.658 7.382 A36H-N 125.937 9.069 H37H-N 116.276 8.97 L38H-N 121.742 7.393 F39H-N 128.82 8.293 K40H-N 119.038 8.553 K41H-N 117.678 7.878 W42H-N 119.798 8.262 V43H-N 115.953 8.236 F44H-N 119.438 8.475 D45H-N 117.985 9.169 E46H-N 112.661 8.168 F47H-N 110.959 6.67 L48H-N 122.221 8.391 N49H-N 116.27 9.442 N49HD21-ND2 109.887 7.62 N49HD22-ND2 109.887 6.939 K50H-N 116.407 7.169 G51H-N 105.302 7.597 Y52H-N 119.929 7.769 N53H-N 117.971 8.432 N53HD21-ND2 108.229 7.265 N53HD22-ND2 108.229 6.559 K54H-N 118.979 7.663 I55H-N 122.604 8.816 F56H-N 123.54 9.285 L57H-N 125.221 9.004 V58H-N 128.641 9.064 L59H-N 127.136 9.04 S60H-N 115.558 7.228 D61H-N 119.495 8.711 V62H-N 119.25 6.985 E63H-N 125.805 8.724 S64H-N 107.537 7.165 I65H-N 118.674 8.072 D66H-N 122.926 7.79 S67H-N 115.108 8.736 F68H-N 123.623 8.33 S69H-N 117.422 8.901 L70H-N 122.333 8.269 G71H-N 105.424 7.827 V72H-N 122.115 7.572 I73H-N 120.295 8.086 V74H-N 119.345 8.374 N75H-N 118.877 8.044 N75HD21-ND2 111.439 7.543 N75HD22-ND2 111.439 6.923 I76H-N 121.508 8.353 L77H-N 120.558 8.161 K78H-N 119.739 8.606 S79H-N 115.943 7.87 I80H-N 121.25 8.3 S81H-N 117.064 8.678 S82H-N 117.02 8.052 S83H-N 114.806 7.74 G84H-N 109.779 7.978 G85H-N 107.355 7.947 F86H-N 120.938 8.907 F87H-N 127.37 8.09 A88H-N 125.762 7.696 L89H-N 119.298 8.459 V90H-N 119.813 8.422 S91H-N 118.818 9.069 E94H-N 117.901 8.724 K95H-N 119.856 7.99 V96H-N 120.32 8.38 E97H-N 120.631 8.999 R98H-N 117.707 7.804 V99H-N 118.862 7.436 L100H-N 120.874 8.448 S101H-N 112.939 8.076 L102H-N 122.639 8.255 T103H-N 106.547 7.632 N104H-N 115.503 8.011 N104HD21-ND2 111.678 6.882 N104HD22-ND2 111.678 7.574 L105H-N 121.683 8.246 D106H-N 116.843 8.474 R107H-N 116.759 7.553 I108H-N 114.481 7.747 V109H-N 119.63 7.849 K110H-N 125.718 8.583 I111H-N 122.473 7.73 Y112H-N 124.431 8.646 D113H-N 121.66 9.416 T114H-N 104.399 7.342 I115H-N 121.333 8.864 S116H-N 114.946 8.135 E117H-N 121.566 7.684 A118H-N 122.331 6.917 M119H-N 115.347 8.405 E120H-N 117.839 7.663 E121H-N 116.864 7.285 V122H-N 116.638 7.584 R123H-N 119.036 7.5 R123HE-NE 85.112 7.295 R124H-N 120.733 7.64 K125H-N 127.647 7.761