Assignment w1 w2 S6H-N 117.919 8.505 G7H-N 110.754 8.4 E8H-N 120.44 8.295 G9H-N 109.889 8.499 L10H-N 121.136 8.057 D11H-N 120.154 8.324 Y12H-N 118.796 7.833 L13H-N 123.092 7.903 T14H-N 115.296 7.775 A15H-N 126.129 8.32 N17H-N 119.392 8.951 N17HD21-ND2 115.35 6.987 N17HD22-ND2 115.35 8.422 S20H-N 113.352 8.594 I21H-N 127.536 9.003 R22H-N 128.753 8.4 E23H-N 127.446 8.95 E24H-N 118.349 10.121 L25H-N 118.799 7.533 C26H-N 117.033 7.216 T27H-N 113.793 8.333 A28H-N 122.653 8.506 S29H-N 117.582 8.696 H30H-N 119.078 8.624 D31H-N 115.312 7.318 T32H-N 111.025 6.979 I33H-N 120.584 7.815 T34H-N 125.003 9.031 V35H-N 126.765 8.494 H36H-N 124.774 7.184 W37H-N 119.137 8.243 W37HE1-NE1 124.908 5.768 I38H-N 115.817 8.838 S39H-N 121.131 8.672 D40H-N 124.188 8.866 D41H-N 120.156 8.776 E42H-N 120.124 7.932 F43H-N 116.277 7.944 S44H-N 114.452 7.989 I45H-N 122.799 7.566 S46H-N 122.707 9.122 S47H-N 113.266 7.815 Y48H-N 114.064 9.168 E49H-N 119.03 8.895 L50H-N 127.507 8.626 Q51H-N 124.654 9.208 Q51HE21-NE2 107.738 6.286 Q51HE22-NE2 107.738 6.222 Y52H-N 119.191 9.351 T53H-N 112.496 7.964 I54H-N 125.329 7.687 F55H-N 128.016 8.703 T56H-N 118.032 8.069 G57H-N 107.298 6.065 A59H-N 123.256 8.312 N60H-N 116.04 8.134 F61H-N 120.852 8.269 I62H-N 119.81 8.101 S63H-N 116.269 7.929 L64H-N 123.099 7.966 Y65H-N 119.348 8.31 N66H-N 116.557 7.816 N66HD21-ND2 112.516 6.904 N66HD22-ND2 112.516 7.557 S67H-N 115.617 7.832 V68H-N 121.634 7.888 D69H-N 120.157 8.275 S70H-N 113.634 8.131 W71H-N 123.914 8.041 W71HE1-NE1 129.753 9.88 M72H-N 122.794 8.858 I73H-N 120.485 8.164 V74H-N 129.449 9.476 N76H-N 113.024 8.837 N76HD21-ND2 113.016 6.921 N76HD22-ND2 113.016 7.672 I77H-N 120.479 8.888 K78H-N 127.785 8.953 Q79H-N 116.381 7.35 Q79HE21-NE2 112.32 6.836 Q79HE22-NE2 112.32 7.448 N80H-N 114.533 7.772 N80HD21-ND2 110.86 7.209 N80HD22-ND2 110.86 6.83 H81H-N 110.303 6.136 Y82H-N 117.602 8.468 T83H-N 124.428 7.465 V84H-N 126.747 8.86 H85H-N 122.664 8.289 G86H-N 107.632 8.681 L87H-N 119.362 8.13 Q88H-N 118.678 8.157 Q88HE21-NE2 112.678 7.588 Q88HE22-NE2 112.678 6.92 S89H-N 119.852 8.719 G90H-N 115.862 7.9 T91H-N 115.901 8.293 R92H-N 125.281 8.491 Y93H-N 122.6 9.262 I94H-N 119.737 8.88 F95H-N 121.905 8.88 I96H-N 119.403 9.283 V97H-N 125.946 8.348 K98H-N 130.286 9.252 A99H-N 128.342 8.871 I100H-N 121.479 8.32 N101H-N 123.719 8.965 N101HD21-ND2 108.779 7.44 N101HD22-ND2 108.779 7.343 Q102H-N 114.907 8.585 A103H-N 119.957 8.081 G104H-N 106.237 7.758 S105H-N 111.805 8.295 R106H-N 120.178 8.649 N107H-N 124.558 8.705 N107HD21-ND2 109.361 7.292 N107HD22-ND2 109.361 6.634 S108H-N 116.361 9.028 E109H-N 119.215 8.735 T111H-N 119.068 9.105 R112H-N 127.658 8.783 L113H-N 125.405 9.136 K114H-N 120.204 8.429 T115H-N 114.206 8.85 N116H-N 118.558 7.796 N116HD21-ND2 112.097 6.962 N116HD22-ND2 112.097 7.745 S117H-N 115.442 8.668 Q118H-N 121.475 8.533 Q118HE21-NE2 112.036 6.85 Q118HE22-NE2 112.036 7.451 F120H-N 120.663 8.231 K121H-N 123.876 8.197 S122H-N 117.794 8.292 G123H-N 110.733 8.273 S125H-N 116.381 8.528 S126H-N 117.776 8.311