Assignment w1 w2 M3H-N 122.159 8.379 K4H-N 125.749 8.499 K5H-N 124.269 8.817 Y6H-N 116.413 9.283 T7H-N 108.889 8.677 K8H-N 116.172 8.502 T9H-N 104.659 7.412 H10H-N 111.477 7.543 E11H-N 115.599 7.783 W12H-N 115.549 8.196 W12HE1-NE1 131.885 9.49 V13H-N 114.348 8.757 S14H-N 121.119 9.36 I15H-N 127.689 9.211 E16H-N 127.939 8.452 D17H-N 126.719 9.037 K18H-N 116.889 8.196 V19H-N 119.079 7.905 A20H-N 131.352 9.562 T21H-N 122.419 9.379 V22H-N 125.259 8.397 G23H-N 112.867 6.411 I24H-N 113.016 9.447 T25H-N 108.109 7.944 N26H-N 118.789 9.979 N26HD21-ND2 114.234 7.672 N26HD22-ND2 114.234 6.946 H27H-N 116.869 8.776 A28H-N 120.102 7.691 Q29H-N 117.229 8.4 Q29HE21-NE2 109.847 7.334 Q29HE22-NE2 109.847 6.849 E30H-N 120.379 7.844 Q31H-N 114.679 7.109 Q31HE21-NE2 111.943 7.108 Q31HE22-NE2 111.943 6.648 L32H-N 119.359 7.504 G33H-N 105.729 7.638 D34H-N 117.589 7.785 V35H-N 126.589 9.294 V36H-N 119.921 8.892 Y37H-N 120.419 7.896 V38H-N 124.589 7.672 D39H-N 127.249 8.713 L40H-N 124.069 8.068 E42H-N 117.659 7.924 V43H-N 122.769 8.234 G44H-N 116.049 8.718 R45H-N 121.299 7.402 R45HE-NE 85.146 7.66 E46H-N 127.676 8.685 V47H-N 118.169 9.202 K48H-N 124.199 8.865 K49H-N 122.72 8.033 G50H-N 115.188 9.223 E51H-N 121.679 8.239 V52H-N 124.796 8.791 V53H-N 120.569 8.641 A54H-N 120.739 7.788 S55H-N 111.899 8.04 I56H-N 123.959 9.109 E57H-N 126.219 9.113 S58H-N 124.001 9.376 V59H-N 113.889 8.608 K60H-N 115.979 7.972 A61H-N 123.519 7.936 A62H-N 120.689 7.935 A63H-N 124.21 9.134 D64H-N 121.909 8.249 V65H-N 120.249 8.196 Y66H-N 127.409 8.54 A67H-N 126.808 9.644 L69H-N 112.923 6.958 S70H-N 117.02 10.907 G71H-N 111.629 8.646 K72H-N 121.309 8.129 I73H-N 125.999 8.98 V74H-N 121.719 9.074 E75H-N 121.019 7.82 V76H-N 118.309 9.041 N77H-N 119.289 7.215 N77HD21-ND2 108.662 7.53 N77HD22-ND2 108.662 5.662 E78H-N 125.349 8.101 K79H-N 118.709 7.706 L80H-N 114.249 7.307 D81H-N 116.297 7.385 T82H-N 105.679 7.119 E83H-N 122.279 8.218 E85H-N 115.279 9.457 L86H-N 125.719 8.21 I87H-N 116.969 7.894 N88H-N 110.16 6.823 N88HD21-ND2 108.27 8.312 N88HD22-ND2 108.27 7.289 K89H-N 116.449 7.971 D90H-N 115.166 8.217 E92H-N 114.019 8.373 G93H-N 110.989 7.302 E94H-N 129.789 9.364 G95H-N 104.749 8.538 L97H-N 115.429 8.854 F98H-N 109.729 7.428 K99H-N 118.009 9.478 M100H-N 119.409 9.766 E101H-N 124.269 9.077 I102H-N 123.519 8.554 S103H-N 117.799 7.994 D104H-N 124.799 9.712 E105H-N 124.759 9.126 G106H-N 110.239 8.868 E107H-N 118.579 7.711 L108H-N 116.316 7.564 E109H-N 116.489 7.252 D110H-N 115.309 7.373 L111H-N 118.859 7.138 L112H-N 121.049 9.276 D113H-N 119.389 8.25 E114H-N 118.999 8.829 Q115H-N 118.549 8.397 Q115HE21-NE2 112.073 7.388 Q115HE22-NE2 112.073 6.727 A116H-N 122.439 8.222 Y117H-N 121.379 8.953 Q118H-N 120.199 8.351 Q118HE21-NE2 112.307 6.782 Q118HE22-NE2 112.307 7.691 E119H-N 119.349 7.946 F120H-N 121.559 8.154 C121H-N 115.919 7.973 A122H-N 120.399 7.304 Q123H-N 116.779 7.315 Q123HE21-NE2 110.823 6.696 Q123HE22-NE2 110.823 7.399 E124H-N 126.729 7.461