Assignment w1 w2 T4H-N 114.607 8.218 H5H-N 121.152 9.076 R6H-N 120.983 9.083 R7H-N 125.886 8.813 V8H-N 126.215 9.257 R9H-N 127.598 8.605 L10H-N 128.544 8.897 L11H-N 122.987 7.945 K12H-N 122.727 8.295 H13H-N 119.897 8.613 G14H-N 110.028 8.506 S15H-N 115.749 8.199 D16H-N 121.837 8.596 K17H-N 121.391 7.828 L19H-N 120.973 8.708 G20H-N 100.202 8.301 F21H-N 116.658 7.317 Y22H-N 119.117 8.3 I23H-N 113.67 8.627 R24H-N 116.528 9.398 D25H-N 120.129 8.668 G26H-N 107.569 8.423 T27H-N 115.396 8.339 S28H-N 120.597 9.304 V29H-N 121.815 8.507 R30H-N 126.419 8.926 V31H-N 123.882 8.619 T32H-N 119.442 8.377 A33H-N 122.523 8.836 S34H-N 110.279 8.105 G35H-N 110.511 7.627 L36H-N 123.108 8.428 E37H-N 124.424 9.083 K38H-N 123.872 8.621 Q39H-N 122.7 8.767 Q39HE21-NE2 111.786 7.592 Q39HE22-NE2 111.786 6.788 G41H-N 108.711 8.469 I42H-N 122.116 8.492 F43H-N 122.95 9.068 I44H-N 120.875 9.005 S45H-N 125.501 9.653 R46H-N 119.702 7.269 L47H-N 124.841 8.948 V48H-N 123.566 7.923 G50H-N 114.459 9.501 G51H-N 105.305 7.957 L52H-N 119.907 8.945 A53H-N 119.748 8.247 E54H-N 121.896 9.503 S55H-N 114.069 8.069 T56H-N 109.555 7.549 G57H-N 108.757 7.544 L58H-N 118.308 7.829 L59H-N 117.92 7.669 A60H-N 126.297 9.071 V61H-N 118.87 8.222 N62H-N 116.677 9.117 N62HD21-ND2 114.611 7.647 N62HD22-ND2 114.611 6.99 D63H-N 122.82 8.2 E64H-N 122.885 8.328 V65H-N 128.099 8.911 I66H-N 123.191 8.958 E67H-N 117.577 7.709 V68H-N 120.315 8.615 N69H-N 128.072 9.877 N69HD21-ND2 110.757 7.498 N69HD22-ND2 110.757 7.323 G70H-N 101.325 8.246 I71H-N 122.468 7.918 E72H-N 126.707 8.892 V73H-N 112.835 7.379 A74H-N 124.971 7.589 G75H-N 111.476 8.853 K76H-N 120.203 8.007 T77H-N 111.142 8.597 L78H-N 121.363 9.031 D79H-N 117.816 8.433 Q80H-N 119.368 7.729 Q80HE21-NE2 110.637 7.575 Q80HE22-NE2 110.637 6.833 V81H-N 121.491 8.498 T82H-N 118.793 8.761 D83H-N 120.89 8.016 M84H-N 119.34 7.836 M85H-N 118.867 8.12 V86H-N 118.143 8.24 A87H-N 122.57 8.227 N88H-N 114.199 7.352 N88HD21-ND2 115.173 7.676 N88HD22-ND2 115.173 7.085 S89H-N 114.923 7.585 S90H-N 115.442 8.454 N91H-N 120.519 7.88 N91HD21-ND2 110.904 7.478 N91HD22-ND2 110.904 6.661 L92H-N 126.642 8.278 I93H-N 126.854 8.929 I94H-N 126.039 9.084 T95H-N 122.895 8.62 V96H-N 120.875 9.402 K97H-N 123.882 9.18 A99H-N 126.577 9.541 N100H-N 115.977 8.548 N100HD21-ND2 112.755 7.63 N100HD22-ND2 112.755 6.915 Q101H-N 120.602 8.241 Q101HE21-NE2 112.701 7.664 Q101HE22-NE2 112.701 6.924 R102H-N 127.635 8.004