Assignment w1 w2 A2H-N 124.724 8.29 D3H-N 119.465 8.125 D4H-N 120.496 8.136 L5H-N 122.352 8.034 D6H-N 121.424 8.176 F7H-N 121.012 7.973 E8H-N 122.868 8.372 T9H-N 115.236 8.179 G10H-N 111.73 8.36 D11H-N 121.424 8.233 A12H-N 125.962 8.392 G13H-N 108.121 8.36 A14H-N 124.208 8.039 S15H-N 115.236 8.206 T17H-N 108.121 7.755 F18H-N 119.362 8.718 M20H-N 120.651 8.949 Q21H-N 126.168 8.7 Q21HE21-NE2 112.916 7.457 Q21HE22-NE2 112.916 6.88 C22H-N 125.704 8.921 S23H-N 109.461 8.043 A24H-N 124.93 8.006 L25H-N 120.702 7.387 R26H-N 117.299 7.985 K27H-N 121.012 8.471 N28H-N 118.846 8.889 N28HD21-ND2 114.102 7.529 N28HD22-ND2 114.102 7.003 G29H-N 107.605 8.113 F30H-N 115.443 8.026 V31H-N 117.608 9.242 V32H-N 128.437 8.71 L33H-N 130.396 8.724 K34H-N 121.424 9.448 G35H-N 128.54 8.196 R36H-N 120.393 7.902 R36HE-NE 110.596 9.059 C38H-N 122.198 9.041 K39H-N 123.538 8.778 I40H-N 128.127 9.015 V41H-N 124.724 9.095 E42H-N 121.012 7.762 M43H-N 123.126 8.53 S44H-N 119.98 8.713 T45H-N 119.671 8.772 S46H-N 121.527 8.945 K47H-N 124.002 8.664 T48H-N 116.474 8.347 H51H-N 109.478 8.15 H53H-N 119.067 8.103 A54H-N 122.043 8.747 K55H-N 121.94 8.748 V56H-N 124.827 9.184 H57H-N 127.818 9.254 L58H-N 128.437 8.958 V59H-N 120.496 8.21 G60H-N 115.546 9.521 I61H-N 119.774 8.798 D62H-N 132.046 9.325 I63H-N 123.899 8.622 F64H-N 118.433 9.385 T65H-N 108.379 8.385 G66H-N 111.318 8.359 K67H-N 121.733 7.552 K68H-N 123.435 8.021 Y69H-N 125.343 9.089 E70H-N 117.815 8.525 D71H-N 118.537 8.795 I72H-N 121.527 8.743 C73H-N 126.323 9.09 S75H-N 119.362 8.644 T76H-N 132.459 7.195 H77H-N 123.641 7.764 N78H-N 123.693 8.478 N78HD21-ND2 112.246 6.739 N78HD22-ND2 112.246 7.433 M79H-N 122.868 8.904 D80H-N 120.805 8.909 V81H-N 124.724 9.096 N83H-N 120.702 7.944 N83HD21-ND2 112.71 7.432 N83HD22-ND2 112.71 6.891 I84H-N 127.715 8.22 K85H-N 128.127 8.712 R86H-N 122.868 8.357 N87H-N 122.198 8.496 N87HD21-ND2 114.412 7.834 N87HD22-ND2 114.412 6.8 D88H-N 121.94 8.42 F89H-N 120.702 9.153 Q90H-N 123.899 9.012 Q90HE21-NE2 110.854 6.754 Q90HE22-NE2 110.854 7.513 L91H-N 128.024 8.398 I92H-N 122.971 8.915 G93H-N 108.946 7.331 I94H-N 118.433 7.177 Q95H-N 126.632 8.788 Q95HE21-NE2 112.865 6.752 Q95HE22-NE2 112.865 7.504 D96H-N 128.024 9.448 G97H-N 129.158 8.482 Y98H-N 120.857 8.232 L99H-N 120.908 8.827 S100H-N 118.949 8.38 L101H-N 126.529 8.699 L102H-N 125.961 9.135 Q103H-N 127.251 8.799 Q103HE21-NE2 111.421 6.689 Q103HE22-NE2 111.421 6.689 D104H-N 124.827 9.181 S105H-N 111.885 7.74 G106H-N 111.421 8.251 E107H-N 120.702 7.669 V108H-N 123.383 8.512 R109H-N 125.446 9.123 R109HE-NE 110.39 8.72 E110H-N 127.251 9.192 D111H-N 116.062 9.053 L112H-N 123.693 8.781 R113H-N 122.868 8.358 R113HE-NE 111.627 7.002 L114H-N 122.713 7.853 E116H-N 119.774 8.314 G117H-N 108.224 8.499 D118H-N 123.59 8.757 L119H-N 121.527 8.742 G120H-N 131.118 6.809 K121H-N 120.702 7.38 E122H-N 121.94 8.194 I123H-N 119.465 8.172 E124H-N 117.815 8.081 Q125H-N 119.001 8.277 Q125HE21-NE2 112.246 7.386 Q125HE22-NE2 112.246 6.835 K126H-N 120.187 8.279 Y127H-N 120.908 8.56 D128H-N 121.837 8.769 C129H-N 114.412 7.639 G130H-N 110.441 7.835 E131H-N 121.424 7.81 E132H-N 124.827 8.541 I133H-N 121.011 8.884 L134H-N 122.352 8.779 I135H-N 122.352 9.439 T136H-N 126.168 8.754 V137H-N 131.118 9.629 L138H-N 132.561 8.924 S139H-N 118.846 9.084 A140H-N 125.704 8.929 M141H-N 119.362 9.978 T142H-N 111.73 8.483 E143H-N 125.137 8.136 E144H-N 120.805 7.937 A145H-N 122.301 8.746 A146H-N 125.033 8.872 V147H-N 111.73 8.778 A148H-N 121.63 7.714 I149H-N 117.712 8.546 K150H-N 126.168 8.908 A151H-N 126.993 8.516 M152H-N 121.424 8.279 A153H-N 131.427 7.84