Assignment w1 w2 S2H-N 116.017 8.388 A3H-N 126.122 8.505 Q4H-N 117.453 8.099 Q4HE21-NE2 111.996 7.008 Q4HE22-NE2 111.996 7.557 A5H-N 122.211 8.277 D6H-N 117.56 7.689 F7H-N 119.871 8.888 D8H-N 124.512 8.873 I9H-N 124.093 9.065 A11H-N 120.426 8.062 G12H-N 107.841 8.065 L14H-N 124.0 8.412 A15H-N 120.429 9.364 A17H-N 120.84 6.736 L18H-N 118.968 8.438 A19H-N 122.188 7.68 H20H-N 118.562 8.051 F21H-N 122.76 9.168 G22H-N 105.139 8.848 Q23H-N 119.272 7.717 Q23HE21-NE2 111.656 6.643 Q23HE22-NE2 111.656 7.56 S24H-N 115.613 8.31 A25H-N 119.117 8.284 H26H-N 113.979 7.526 I27H-N 110.447 7.783 L28H-N 123.855 8.585 L29H-N 125.573 8.445 S30H-N 118.426 8.758 Y31H-N 120.515 7.616 T33H-N 120.209 8.565 A34H-N 121.801 8.753 L35H-N 115.949 7.698 T36H-N 131.821 7.48 E37H-N 124.83 7.353 G38H-N 112.999 8.942 R39H-N 117.588 7.448 S40H-N 117.718 8.958 T41H-N 113.079 8.842 S42H-N 124.91 9.059 G43H-N 110.404 8.641 L44H-N 118.382 8.664 A45H-N 129.654 8.62 G46H-N 111.572 8.77 R47H-N 122.316 7.818 F48H-N 122.242 8.595 D49H-N 120.664 8.696 I50H-N 122.834 8.527 D51H-N 117.843 8.143 Q52H-N 121.535 8.334 Q52HE21-NE2 111.486 6.707 Q52HE22-NE2 111.486 7.476 G53H-N 106.913 9.052 L54H-N 122.42 8.147 A55H-N 119.33 7.267 I56H-N 119.361 7.637 L57H-N 122.652 8.203 L58H-N 111.329 7.747 A59H-N 128.803 7.577 G60H-N 112.462 8.939 T61H-N 109.143 8.142 G62H-N 110.302 8.807 L63H-N 119.215 7.932 E64H-N 116.559 8.914 A65H-N 123.446 8.687 S66H-N 115.813 8.796 R67H-N 126.622 8.729 G68H-N 115.222 8.37 A69H-N 123.485 8.392 N70H-N 116.669 8.726 N70HD21-ND2 113.486 7.628 N70HD22-ND2 113.486 6.939 A71H-N 118.665 8.393 S72H-N 112.81 7.319 Y73H-N 121.99 8.948 S74H-N 116.549 8.874 L75H-N 120.355 8.002 Q76H-N 115.728 8.574 Q76HE21-NE2 111.742 6.833 Q76HE22-NE2 111.742 7.469 A77H-N 123.859 8.83 S78H-N 118.149 8.43 A79H-N 126.918 8.575 S80H-N 115.305 8.3 T81H-N 115.268 8.153 G82H-N 117.146 7.982