Assignment w1 w2 S6H-N 113.84 7.609 G7H-N 110.438 8.342 W8H-N 120.945 7.931 W8HE1-NE1 129.264 10.088 I9H-N 122.829 7.866 L10H-N 126.208 8.079 A11H-N 125.333 8.222 S12H-N 114.892 8.251 T13H-N 115.492 8.173 T14H-N 115.62 8.17 E15H-N 123.537 8.373 G16H-N 109.677 8.364 A17H-N 124.508 8.082 S19H-N 114.123 8.833 V20H-N 116.824 7.457 A21H-N 127.225 8.413 L23H-N 119.277 7.758 N24H-N 116.14 8.815 N24HD21-ND2 112.417 7.188 N24HD22-ND2 112.417 6.909 V25H-N 119.432 8.053 T26H-N 120.732 9.323 V27H-N 120.154 8.253 F28H-N 123.261 8.814 L29H-N 125.874 8.764 E31H-N 123.112 8.95 S33H-N 117.955 8.341 N35H-N 115.775 7.906 N35HD21-ND2 112.39 7.089 N35HD22-ND2 112.39 6.713 V36H-N 119.229 9.302 D37H-N 127.397 9.116 I38H-N 125.75 9.007 R39H-N 125.565 9.023 W40H-N 116.011 7.408 W40HE1-NE1 124.088 6.484 M41H-N 117.621 8.837 K42H-N 125.944 8.475 T45H-N 114.434 8.089 K46H-N 123.218 8.786 Q48H-N 116.721 8.661 Q48HE21-NE2 112.544 7.666 Q48HE22-NE2 112.544 6.834 D49H-N 120.255 7.788 G50H-N 106.265 7.858 E51H-N 119.701 8.286 L52H-N 124.184 8.436 V53H-N 118.221 8.975 G54H-N 107.711 7.419 Y55H-N 113.555 8.645 R56H-N 121.855 9.222 R56HE-NE 83.722 8.098 I57H-N 123.94 9.337 S58H-N 122.987 9.329 H59H-N 125.692 8.857 V60H-N 123.929 8.419 W61H-N 131.599 9.473 W61HE1-NE1 144.357 14.392 Q62H-N 122.154 8.854 Q62HE21-NE2 112.579 7.481 Q62HE22-NE2 112.579 6.836 S63H-N 120.205 8.785 A64H-N 126.963 8.953 G65H-N 107.972 8.632 I66H-N 121.487 8.003 S67H-N 121.484 8.45 K68H-N 125.07 8.967 E69H-N 125.787 8.771 L70H-N 127.604 8.461 L71H-N 122.021 8.242 E72H-N 124.343 9.375 E73H-N 125.081 8.937 V74H-N 120.393 8.713 G75H-N 110.381 8.695 Q76H-N 116.187 8.365 Q76HE21-NE2 111.719 7.538 Q76HE22-NE2 111.719 6.888 N77H-N 118.065 8.681 N77HD21-ND2 113.431 7.678 N77HD22-ND2 113.431 7.007 G78H-N 109.765 8.199 S79H-N 111.528 8.259 R80H-N 117.516 6.676 A81H-N 123.981 9.382 R82H-N 121.966 8.463 I83H-N 122.127 8.816 S84H-N 121.307 8.779 V85H-N 122.607 7.785 Q86H-N 125.546 4.276 Q86HE21-NE2 115.738 7.481 Q86HE22-NE2 115.738 6.831 V87H-N 116.478 5.951 H88H-N 120.399 8.004 N89H-N 120.537 7.715 N89HD21-ND2 110.949 7.724 N89HD22-ND2 110.949 6.919 A90H-N 120.652 7.871 T91H-N 110.345 8.634 C92H-N 124.972 8.727 T93H-N 125.173 8.849 V94H-N 129.725 9.346 R95H-N 125.8 8.903 R95HE-NE 83.618 7.02 I96H-N 120.997 9.081 A97H-N 129.7 8.811 A98H-N 123.529 9.4 V99H-N 120.034 8.105 T100H-N 116.906 8.696 R101H-N 120.068 9.24 G102H-N 104.072 8.081 G103H-N 107.724 7.401 V104H-N 120.17 8.259 G105H-N 115.086 8.839 F107H-N 118.768 8.634 S108H-N 116.375 9.163 D109H-N 122.798 8.712 V111H-N 122.06 8.089 K112H-N 126.786 8.614 I113H-N 119.311 8.687 F114H-N 124.117 8.592 I115H-N 128.718 8.655 A117H-N 121.432 8.485 H118H-N 119.975 8.356 S119H-N 118.831 8.292 G120H-N 110.901 8.234