Assignment w1 w2 E2H-N 123.736 8.716 A3H-N 125.784 8.571 G4H-N 108.365 8.49 G5H-N 108.403 8.277 R6H-N 121.465 8.285 G8H-N 109.714 8.671 A9H-N 123.98 8.21 D10H-N 119.649 8.269 V13H-N 117.28 7.046 F17H-N 120.772 9.121 L18H-N 115.833 8.511 N19H-N 117.708 8.405 N19HD21-ND2 112.543 7.691 N19HD22-ND2 112.543 7.045 R20H-N 122.847 8.312 R20HE-NE 83.343 7.557 F21H-N 121.792 8.439 Y22H-N 120.028 8.707 K23H-N 116.431 7.938 S24H-N 113.941 7.661 L25H-N 119.734 7.566 I26H-N 119.672 8.086 D27H-N 122.442 9.082 R28H-N 115.375 7.584 R28HE-NE 84.909 6.626 G29H-N 110.023 7.907 V30H-N 118.743 7.698 N31H-N 123.326 8.497 N31HD21-ND2 113.24 7.7 N31HD22-ND2 113.24 7.068 F32H-N 126.17 8.794 S33H-N 116.015 7.699 L34H-N 124.403 8.938 D35H-N 115.371 8.572 T36H-N 116.848 7.589 I37H-N 120.728 8.433 E38H-N 118.859 8.121 K39H-N 116.992 7.591 E40H-N 117.929 8.688 L41H-N 125.924 8.974 I42H-N 119.902 7.884 S43H-N 114.093 7.788 F44H-N 125.103 9.051 C45H-N 112.885 8.253 L46H-N 123.927 7.773 D47H-N 116.91 7.857 T48H-N 108.105 7.141 K49H-N 118.361 8.754 G50H-N 109.09 8.892 K51H-N 126.155 9.31 E52H-N 116.565 8.23 N53H-N 119.063 6.847 N53HD21-ND2 111.978 7.214 N53HD22-ND2 111.978 7.0 R54H-N 118.553 7.471 L55H-N 118.727 7.848 C56H-N 115.995 7.751 Y57H-N 121.867 7.918 Y58H-N 122.003 8.336 L59H-N 114.5 8.078 G60H-N 102.642 7.561 A61H-N 120.391 7.996 T62H-N 106.938 7.156 K63H-N 121.357 8.628 D64H-N 116.498 8.447 A65H-N 122.578 7.368 A66H-N 124.269 8.309 T67H-N 111.751 7.734 K68H-N 121.777 8.494 V73H-N 114.771 7.801 M77H-N 117.629 7.689 S78H-N 114.579 8.281 V79H-N 111.333 6.999 H80H-N 116.748 8.282 M81H-N 121.069 8.003 A83H-N 126.626 9.188 M84H-N 114.741 9.31 K85H-N 116.52 6.985 I86H-N 120.617 7.876 C87H-N 117.368 8.643 E88H-N 118.115 8.032 K89H-N 119.71 7.526 L90H-N 119.641 8.42 K91H-N 119.157 8.217 K92H-N 113.688 6.975 L93H-N 119.142 7.448 D94H-N 116.828 7.908 S95H-N 122.474 8.902 Q96H-N 120.807 8.603 Q96HE21-NE2 113.114 7.976 Q96HE22-NE2 113.114 6.692 I97H-N 117.402 7.467 C98H-N 113.576 7.403 E99H-N 119.261 7.31 L100H-N 115.779 6.502 Y102H-N 120.448 8.744 E103H-N 121.906 8.943 K104H-N 122.902 8.584 T105H-N 116.439 8.29 L106H-N 125.258 8.493 D107H-N 123.915 8.499 L108H-N 125.168 8.62 A109H-N 120.553 8.252 S110H-N 112.098 7.989 V111H-N 118.877 7.55 D112H-N 122.432 8.193 L113H-N 125.638 8.646 R114H-N 112.467 8.046 K115H-N 116.345 7.365 M116H-N 119.387 7.185 R117H-N 118.93 8.83 V118H-N 123.41 9.089 A119H-N 119.201 8.673 E120H-N 115.782 6.951 L121H-N 121.387 7.651 K122H-N 117.133 8.463 Q123H-N 118.698 7.325 Q123HE21-NE2 111.646 7.429 Q123HE22-NE2 111.646 6.84 I124H-N 121.589 7.388 L125H-N 117.304 7.026 H126H-N 117.688 8.583 S127H-N 118.736 8.276 W128H-N 121.861 7.309 W128HE1-NE1 125.855 9.718 G129H-N 107.591 8.041 E130H-N 119.182 7.865 E131H-N 119.382 8.601 C135H-N 118.731 7.566 A136H-N 125.625 9.208 E137H-N 117.468 8.234 T139H-N 110.622 8.491 D140H-N 120.061 7.61 Y141H-N 117.478 7.309 V142H-N 118.707 8.029 N143H-N 116.067 8.45 L144H-N 120.933 7.478 I145H-N 119.268 8.498 Q146H-N 115.897 8.364 Q146HE21-NE2 110.153 7.298 Q146HE22-NE2 110.153 6.841 E147H-N 118.858 7.882 L148H-N 117.562 8.333 A149H-N 122.298 8.53 K151H-N 115.877 7.544 Y152H-N 116.471 7.124 A153H-N 123.305 7.906 A154H-N 121.421 8.1 T155H-N 111.673 7.904 H156H-N 121.254 8.359 K158H-N 122.066 8.597 T159H-N 115.855 8.267 E160H-N 123.954 8.409 L161H-N 128.97 7.97