Assignment w1 w2 I17H-N 123.708 8.059 E18H-N 125.458 8.444 G19H-N 110.618 8.382 R20H-N 120.507 8.133 H21H-N 119.799 7.957 M22H-N 119.17 8.809 L23H-N 125.664 9.121 L24H-N 125.678 8.747 T25H-N 119.44 8.416 V26H-N 127.426 8.956 Y27H-N 127.513 8.693 C28H-N 124.214 8.931 V29H-N 127.025 8.619 R30H-N 124.574 8.626 R31H-N 121.981 8.6 D32H-N 115.829 7.618 L33H-N 113.26 8.031 S34H-N 116.989 8.226 E35H-N 118.423 8.278 V36H-N 120.536 8.591 T37H-N 120.039 8.286 F38H-N 121.867 8.37 S39H-N 114.737 8.637 L40H-N 123.08 9.007 Q41H-N 123.739 8.479 Q41HE21-NE2 111.281 7.168 Q41HE22-NE2 111.281 6.573 V42H-N 118.873 8.846 D43H-N 121.269 6.289 A44H-N 126.066 8.468 D45H-N 112.7 8.342 F46H-N 121.605 7.806 E47H-N 120.745 8.452 L48H-N 123.653 8.395 H49H-N 116.073 8.911 N50H-N 118.835 6.621 N50HD21-ND2 111.17 6.985 N50HD22-ND2 111.17 6.727 F51H-N 121.265 7.787 R52H-N 119.461 8.896 A53H-N 121.581 7.396 L54H-N 119.857 7.583 C55H-N 115.57 7.861 E56H-N 124.038 7.791 L57H-N 120.552 7.44 E58H-N 114.58 7.363 S59H-N 110.577 7.731 G60H-N 112.37 7.997 I61H-N 123.665 8.039 A63H-N 128.827 9.166 A64H-N 118.038 8.494 E65H-N 114.118 7.722 S66H-N 113.079 7.335 Q67H-N 121.084 8.729 Q67HE21-NE2 112.207 7.382 Q67HE22-NE2 112.207 6.655 I68H-N 125.168 8.883 V69H-N 128.681 9.54 Y70H-N 126.782 8.531 A71H-N 133.938 8.859 E72H-N 106.551 8.234 R73H-N 122.088 7.94 L75H-N 125.156 8.886 T76H-N 111.734 8.0 D77H-N 121.645 7.662 H79H-N 116.116 8.422 R80H-N 120.591 7.092 S81H-N 118.074 8.658 L82H-N 119.816 8.404 A83H-N 119.775 8.637 S84H-N 116.587 8.14 Y85H-N 120.891 7.635 G86H-N 106.365 7.868 L87H-N 119.882 6.595 K88H-N 119.566 8.57 D89H-N 116.485 8.054 G90H-N 114.942 9.146 D91H-N 122.11 8.001 V92H-N 117.379 7.962 V93H-N 122.434 8.931 I94H-N 124.245 8.647 L95H-N 129.949 8.906 R96H-N 124.11 8.995 Q97H-N 127.785 7.954 Q97HE21-NE2 112.213 7.636 Q97HE22-NE2 112.213 6.961