Assignment w1 w2 M1H-N 122.158 8.486 T2H-N 115.148 8.222 T3H-N 115.813 8.186 S4H-N 117.789 8.325 G5H-N 110.937 8.381 A6H-N 123.36 8.049 L7H-N 120.798 8.062 F8H-N 120.71 8.08 S10H-N 115.408 8.278 L11H-N 124.082 8.244 V12H-N 122.627 8.116 G14H-N 109.825 8.613 S15H-N 115.443 8.136 R16H-N 122.76 8.455 G17H-N 109.771 8.353 A18H-N 123.733 8.151 S19H-N 114.784 8.275 N20H-N 120.36 8.173 N20HD21-ND2 112.498 6.801 N20HD22-ND2 112.498 7.403 K21H-N 120.793 7.99 Y22H-N 122.247 8.167 L23H-N 123.244 8.62 V24H-N 112.394 7.068 E25H-N 123.276 8.125 F26H-N 115.635 8.358 R27H-N 120.935 9.963 A28H-N 126.264 7.934 G29H-N 108.904 8.87 K30H-N 119.216 9.299 M31H-N 115.539 7.38 S32H-N 116.681 8.668 L33H-N 126.101 8.519 K34H-N 127.511 8.314 G35H-N 116.88 8.919 T36H-N 117.492 8.677 T37H-N 118.649 8.098 T39H-N 120.864 8.676 D41H-N 125.951 8.792 K42H-N 124.558 8.748 R43H-N 119.615 8.38 K44H-N 123.413 8.706 G45H-N 112.736 8.885 L46H-N 124.418 8.02 V47H-N 125.787 8.434 Y48H-N 118.657 7.697 I49H-N 116.493 7.622 Q50H-N 127.459 9.031 Q50HE21-NE2 110.347 6.744 Q50HE22-NE2 110.347 7.219 Q51H-N 127.876 9.141 Q51HE21-NE2 110.141 7.054 Q51HE22-NE2 110.141 7.4 T52H-N 118.431 9.081 D53H-N 120.56 8.798 D54H-N 118.463 7.894 S55H-N 112.231 8.46 L56H-N 123.546 7.954 I57H-N 121.597 8.364 H58H-N 123.186 8.989 F59H-N 126.85 9.634 C60H-N 125.232 8.152 W61H-N 118.31 8.255 W61HE1-NE1 126.949 10.121 K62H-N 126.824 8.323 D63H-N 123.17 7.715 R64H-N 125.405 8.678 T65H-N 116.122 8.879 S66H-N 115.033 7.918 G67H-N 111.759 8.093 N68H-N 118.288 7.94 N68HD21-ND2 112.183 7.019 N68HD22-ND2 112.183 7.635 V69H-N 126.904 8.772 E70H-N 129.218 8.246 D71H-N 117.071 7.979 D72H-N 121.345 8.429 L73H-N 126.398 9.193 I74H-N 123.951 8.246 I75H-N 128.953 8.069 F76H-N 129.669 9.162 D78H-N 119.022 9.033 D79H-N 119.968 8.209 C80H-N 115.835 9.224 E81H-N 116.831 8.108 F82H-N 127.902 9.381 K83H-N 124.895 8.902 R84H-N 123.81 8.722 V85H-N 127.091 8.217 Q87H-N 115.544 8.411 Q87HE21-NE2 112.428 7.002 Q87HE22-NE2 112.428 7.59 C88H-N 119.15 7.443 G91H-N 108.818 7.859 R92H-N 118.39 8.526 V93H-N 121.802 8.128 Y94H-N 127.635 9.561 V95H-N 119.349 9.228 L96H-N 128.196 9.377 K97H-N 126.678 8.975 F98H-N 126.325 8.111 K99H-N 123.548 8.457 A100H-N 121.815 8.958 G101H-N 108.063 8.075 S102H-N 115.478 8.233 K103H-N 123.332 7.922 R104H-N 125.285 8.345 L105H-N 122.636 8.318 F106H-N 120.126 8.516 F107H-N 118.081 9.512 W108H-N 118.098 9.126 W108HE1-NE1 129.425 10.236 M109H-N 120.862 9.074 Q110H-N 117.583 8.313 E111H-N 122.997 7.234 K113H-N 115.693 7.953 T114H-N 113.097 8.587 D115H-N 119.587 8.324 Q116H-N 115.588 8.121 Q116HE21-NE2 112.57 6.781 Q116HE22-NE2 112.57 7.504 D117H-N 122.614 7.666 E118H-N 116.617 8.347 E119H-N 123.075 7.814 H120H-N 118.611 8.366 C121H-N 117.055 7.836 R122H-N 120.309 8.419 K123H-N 118.822 8.482 V124H-N 117.877 8.107 N125H-N 113.782 7.571 N125HD21-ND2 119.871 7.408 N125HD22-ND2 119.871 8.938 E126H-N 119.635 8.363 Y127H-N 115.854 8.138 L128H-N 111.895 7.887 N129H-N 110.823 7.435 N129HD21-ND2 115.151 7.197 N129HD22-ND2 115.151 7.659 N130H-N 119.631 8.258 N130HD21-ND2 112.809 6.827 N130HD22-ND2 112.809 7.629 M133H-N 121.509 8.414 G135H-N 109.582 8.504 A136H-N 123.487 8.086 L137H-N 120.911 8.268 G138H-N 109.339 8.316 A139H-N 123.78 8.161 S140H-N 115.047 8.366 G141H-N 110.701 8.388 S142H-N 115.533 8.231 S143H-N 117.83 8.461 G144H-N 110.487 8.451 H145H-N 118.579 8.22 E146H-N 121.988 8.584 L147H-N 123.032 8.354 S148H-N 116.267 8.218 A149H-N 126.608 8.25 L150H-N 126.935 7.761