Assignment w1 w2 D6H-N 121.733 8.22 L8H-N 123.064 7.447 L9H-N 121.734 8.953 H10H-N 128.669 8.863 V11H-N 125.8 9.152 E12H-N 126.016 8.932 V13H-N 124.675 8.594 S14H-N 118.993 8.525 N15H-N 120.244 8.606 N15HD21-ND2 111.855 6.915 N15HD22-ND2 111.855 7.284 E16H-N 123.648 8.553 D17H-N 123.207 9.147 N18H-N 115.204 8.843 N18HD21-ND2 112.659 6.974 N18HD22-ND2 112.659 7.695 S19H-N 111.733 7.825 L20H-N 119.526 9.253 H21H-N 122.51 8.7 F22H-N 124.343 8.949 I23H-N 120.477 8.759 L24H-N 128.655 8.973 Y25H-N 119.541 9.475 N26H-N 122.002 8.979 N26HD21-ND2 111.776 6.608 N26HD22-ND2 111.776 8.268 K27H-N 129.83 8.009 T28H-N 109.768 7.707 N29H-N 112.948 8.422 N29HD21-ND2 112.846 7.014 N29HD22-ND2 112.846 7.603 I30H-N 112.207 8.606 I31H-N 122.376 8.07 I32H-N 130.793 8.374 G34H-N 103.284 8.449 N35H-N 112.632 8.762 N35HD21-ND2 114.339 6.939 N35HD22-ND2 114.339 7.476 C36H-N 115.122 8.978 T37H-N 114.787 9.487 F38H-N 126.352 9.151 E39H-N 126.682 8.901 F40H-N 118.606 8.98 S41H-N 112.493 8.659 S42H-N 119.732 9.072 Q43H-N 118.414 8.588 Q43HE21-NE2 112.101 6.872 Q43HE22-NE2 112.101 7.539 I44H-N 112.35 7.701 S45H-N 115.228 7.6 E46H-N 119.979 7.713 V47H-N 122.088 8.068 F48H-N 130.181 8.239 S49H-N 113.86 8.489 I50H-N 123.747 9.534 K51H-N 127.813 9.113 M52H-N 122.494 8.4 G53H-N 107.201 8.379 H55H-N 119.195 7.939 E56H-N 122.491 8.832 I57H-N 121.453 8.941 G58H-N 112.842 8.805 I59H-N 122.853 8.567 K60H-N 117.852 8.862 G61H-N 107.144 8.398 Q62H-N 117.023 8.407 Q62HE21-NE2 110.896 6.797 Q62HE22-NE2 110.896 7.109 K63H-N 122.785 8.691 E64H-N 125.671 8.778 L65H-N 120.177 8.94 W66H-N 121.269 8.902 F67H-N 121.777 9.304 F68H-N 127.435 7.569 S70H-N 108.009 7.404 L71H-N 121.509 6.302 T73H-N 109.997 7.734 L75H-N 128.05 9.401 S76H-N 116.102 7.921 N77H-N 116.397 8.759 N77HD21-ND2 114.323 7.074 N77HD22-ND2 114.323 7.6 Y78H-N 119.444 8.396 T79H-N 118.448 9.123 M80H-N 126.876 9.051 K81H-N 118.157 8.985 V82H-N 118.653 8.292 V83H-N 129.774 9.226 N84H-N 123.912 8.962 Q85H-N 118.583 9.269 Q85HE21-NE2 111.513 6.791 Q85HE22-NE2 111.513 7.649 D86H-N 117.792 7.471 G87H-N 107.646 8.269 E88H-N 121.792 7.964 T89H-N 123.41 9.079 I90H-N 121.807 8.938 L91H-N 120.612 7.513 V92H-N 119.624 9.508 G93H-N 116.438 9.042 K94H-N 120.208 8.868 C95H-N 126.11 8.954 A96H-N 136.057 9.113 D97H-N 118.402 8.115 S98H-N 111.433 7.351 N99H-N 119.202 8.572 N99HD21-ND2 110.578 6.547 N99HD22-ND2 110.578 7.311 E100H-N 118.223 7.97 I101H-N 124.725 9.263 T102H-N 118.022 8.483 L103H-N 125.104 9.344 K104H-N 117.693 8.397 S105H-N 117.693 8.775 L107H-N 126.937 7.718