Assignment w1 w2 R3H-N 123.994 8.776 R3HE-NE 84.231 7.877 V4H-N 113.582 9.006 K5H-N 122.493 9.091 T6H-N 119.186 9.477 I7H-N 118.874 8.988 Y8H-N 116.652 7.439 D9H-N 119.38 8.307 C10H-N 120.538 8.403 Q11H-N 129.178 8.947 A12H-N 126.406 7.999 D13H-N 120.488 8.961 N14H-N 114.345 7.037 N14HD21-ND2 118.076 8.073 N14HD22-ND2 118.076 6.983 D15H-N 119.794 8.903 D16H-N 116.091 8.153 E17H-N 120.018 7.662 L18H-N 122.907 8.203 T19H-N 124.904 8.377 F20H-N 121.901 8.904 I21H-N 116.291 9.389 E22H-N 123.254 8.88 G23H-N 114.797 8.259 E24H-N 120.53 8.019 V25H-N 121.223 8.519 I26H-N 127.242 8.855 I27H-N 126.748 8.964 V28H-N 127.299 8.524 T29H-N 120.13 9.736 G30H-N 110.915 8.068 E31H-N 116.278 8.547 E32H-N 126.595 8.964 D33H-N 119.226 9.075 Q34H-N 111.481 8.272 E35H-N 116.21 8.584 W36H-N 123.895 8.165 W36HE1-NE1 127.838 9.069 W37H-N 126.191 8.461 W37HE1-NE1 127.619 9.366 I38H-N 118.586 8.31 G39H-N 113.06 8.87 H40H-N 113.373 8.321 I41H-N 122.663 8.389 E42H-N 132.666 9.259 G43H-N 117.827 9.433 Q44H-N 119.433 8.253 E46H-N 116.928 9.191 R47H-N 124.379 8.397 R47HE-NE 83.757 7.789 K48H-N 120.344 7.83 G49H-N 107.761 9.149 V50H-N 118.762 8.751 F51H-N 125.73 9.859 V53H-N 127.475 7.799 S54H-N 113.844 8.651 F55H-N 121.145 7.939 V56H-N 111.306 7.83 H57H-N 117.638 9.053 I58H-N 126.154 8.881 L59H-N 128.725 8.209 S60H-N 118.095 8.645 D61H-N 122.866 8.619 I2H-N 124.996 8.36 I3H-N 127.292 8.523 S4H-N 121.329 8.521 A5H-N 125.929 8.208 M6H-N 122.308 8.342 T8H-N 114.363 8.305 K9H-N 127.61 9.075 S10H-N 121.001 8.91 S11H-N 117.856 8.754 R12H-N 125.8 8.634 R12HH11-NH1 76.808 9.647 R12HH12-NH1 76.808 6.42 R12HH21-NH2 75.327 9.663 R12HH22-NH2 75.327 6.42 R12HE-NE 82.181 7.799 K13H-N 124.313 9.04 A14H-N 123.601 8.581 K15H-N 120.342 7.892 K16H-N 125.078 8.402 A18H-N 124.8 8.554 Q19H-N 120.579 8.518