Assignment w1 w2 E3H-N 123.654 8.995 E4H-N 119.237 8.837 R5H-N 120.052 7.884 K6H-N 119.327 7.998 K7H-N 117.908 7.917 L8H-N 120.724 7.686 L9H-N 118.886 8.158 E10H-N 119.0 8.069 K11H-N 119.446 7.676 L12H-N 120.017 8.378 E13H-N 117.914 8.458 K14H-N 117.629 7.365 I15H-N 119.583 7.726 L16H-N 118.601 8.372 D17H-N 120.008 8.192 E18H-N 119.362 7.86 V19H-N 118.483 8.416 T20H-N 112.904 7.985 D21H-N 120.51 7.935 G22H-N 106.73 7.939 A23H-N 124.286 7.531 D25H-N 122.828 8.779 E26H-N 117.055 9.324 A27H-N 120.789 7.474 R28H-N 118.872 7.803 E29H-N 117.512 8.49 R30H-N 119.24 7.789 I31H-N 120.92 8.256 E32H-N 120.281 8.697 K33H-N 119.737 7.764 L34H-N 120.133 7.79 A35H-N 119.492 8.634 K36H-N 118.47 7.704 D37H-N 120.075 8.203 V38H-N 118.202 8.215 K39H-N 119.236 7.78 D40H-N 118.227 8.273 E41H-N 119.896 7.875 L42H-N 119.906 7.952 E43H-N 117.735 8.02 E44H-N 116.308 8.128 G45H-N 109.45 8.156 D46H-N 120.995 8.467 A47H-N 124.626 8.483 K48H-N 118.214 8.349 N49H-N 116.387 8.184 N49HD21-ND2 112.902 6.949 N49HD22-ND2 112.902 7.866 M50H-N 118.627 8.189 I51H-N 120.778 8.475 E52H-N 120.715 8.372 K53H-N 118.426 7.766 F54H-N 120.522 7.99 R55H-N 120.87 8.774 D56H-N 119.776 8.491 E57H-N 120.418 7.894 M58H-N 119.674 8.352 E59H-N 119.77 8.717 Q60H-N 117.895 7.613 Q60HE21-NE2 114.568 6.833 Q60HE22-NE2 114.568 7.621 M61H-N 118.464 7.943 Y62H-N 119.118 8.313 K63H-N 117.899 7.806 D64H-N 116.931 7.771 A65H-N 121.417 7.536 V69H-N 119.699 7.968 M70H-N 119.158 8.195 E71H-N 119.109 8.122 Q72H-N 118.471 7.662 Q72HE21-NE2 111.865 6.806 Q72HE22-NE2 111.865 7.569 L73H-N 120.88 8.17 L74H-N 119.628 8.396 E75H-N 119.588 7.622 E76H-N 118.75 8.127 I77H-N 121.044 8.715 E78H-N 121.847 8.161 K79H-N 118.842 7.756 L80H-N 120.44 7.805 L81H-N 119.519 8.423 K82H-N 119.07 7.804 K83H-N 119.647 7.737 A84H-N 122.121 8.259 G85H-N 105.518 8.191 S86H-N 114.68 7.884 L87H-N 122.3 7.806 V88H-N 120.869 7.849 R90H-N 121.893 8.528 G91H-N 109.932 8.551 S92H-N 115.612 8.183 Y93H-N 122.14 8.206 L94H-N 123.025 8.007 E95H-N 120.848 8.141 H96H-N 119.288 8.144 H97H-N 125.622 8.017