Assignment w1 w2 L8H-N 121.686 8.037 K9H-N 122.335 8.309 D11H-N 120.563 8.293 F12H-N 118.808 7.961 I13H-N 122.19 8.167 I14H-N 125.55 8.287 L15H-N 127.408 8.398 G16H-N 109.546 8.347 N17H-N 124.057 7.974 N17HD21-ND2 112.856 7.596 N17HD22-ND2 112.856 6.907 G18H-N 113.988 8.15 R20H-N 120.839 8.414 L21H-N 123.561 8.306 Q22H-N 120.835 8.406 Q22HE21-NE2 112.13 7.557 Q22HE22-NE2 112.13 6.874 T25H-N 114.185 7.806 Y26H-N 121.326 8.598 Q27H-N 123.045 8.528 Q27HE21-NE2 113.655 7.818 Q27HE22-NE2 113.655 6.478 C28H-N 129.276 8.682 K29H-N 127.445 8.454 H30H-N 121.657 9.625 C31H-N 118.457 8.086 D32H-N 116.82 8.135 S33H-N 119.488 8.667 K34H-N 122.954 8.389 L35H-N 126.489 8.825 Q36H-N 116.41 8.883 Q36HE21-NE2 112.405 7.666 Q36HE22-NE2 112.405 6.814 S37H-N 110.125 7.345 T38H-N 121.696 8.099 E40H-N 118.475 7.881 L41H-N 121.715 8.096 T42H-N 115.801 8.599 S43H-N 115.657 7.833 H44H-N 122.271 8.415 L45H-N 118.289 8.854 N46H-N 117.155 7.73 N46HD21-ND2 113.208 7.653 N46HD22-ND2 113.208 6.976 I47H-N 119.392 7.67 H48H-N 116.931 6.999 N49H-N 118.208 8.059 N49HD21-ND2 112.523 7.771 N49HD22-ND2 112.523 6.981 E50H-N 121.316 8.336 E51H-N 120.058 7.932 F52H-N 119.698 8.345 Q53H-N 118.967 8.197 Q53HE21-NE2 111.951 7.447 Q53HE22-NE2 111.951 6.928 K54H-N 119.791 8.008 R55H-N 119.619 7.978 A56H-N 122.85 8.008 K57H-N 118.986 8.014 R58H-N 120.747 8.039 Q59H-N 121.145 8.195 Q64H-N 120.299 8.261 Q64HE21-NE2 112.144 7.514 Q64HE22-NE2 112.144 6.877 L65H-N 122.723 8.19 L66H-N 121.812 8.165 S67H-N 115.632 8.104 K70H-N 121.417 8.255 Y71H-N 120.561 8.142 A72H-N 125.192 8.237 D73H-N 119.269 8.22 G74H-N 109.209 8.269 A75H-N 123.382 8.048 F76H-N 118.54 8.126 A77H-N 124.826 8.017 D78H-N 119.019 8.061 F79H-N 120.449 8.023 K80H-N 123.309 8.161 Q81H-N 121.944 8.329 Q81HE21-NE2 112.26 7.534 Q81HE22-NE2 112.26 6.862 E82H-N 122.687 8.542 S83H-N 116.897 8.418 G84H-N 110.673 8.276 S86H-N 114.681 8.331 S87H-N 115.469 8.121