Assignment w1 w2 D4H-N 122.202 8.409 M6H-N 121.236 8.491 N7H-N 119.0 8.125 N7HD21-ND2 112.06 7.356 N7HD22-ND2 112.06 6.85 H8H-N 117.439 7.811 Y9H-N 120.301 8.948 V10H-N 120.865 9.434 Y11H-N 123.489 8.875 I12H-N 116.799 8.211 L13H-N 128.373 9.673 E14H-N 125.575 9.66 C15H-N 125.445 9.086 K16H-N 123.993 8.526 D17H-N 114.91 7.871 G18H-N 109.525 8.355 S19H-N 117.782 8.489 W20H-N 123.048 8.919 W20HE1-NE1 130.2 11.16 Y21H-N 126.705 9.617 T22H-N 123.78 7.33 G23H-N 109.999 7.745 Y24H-N 118.855 8.118 T25H-N 122.404 8.903 T26H-N 113.378 7.873 D27H-N 122.793 8.076 V28H-N 126.3 8.274 D29H-N 119.778 8.023 R30H-N 119.008 7.882 R31H-N 120.521 7.951 I32H-N 120.165 8.565 K33H-N 120.235 7.518 K34H-N 121.257 7.849 H35H-N 119.257 8.332 A36H-N 122.528 8.546 S37H-N 112.63 7.876 G38H-N 109.525 8.046 K39H-N 119.244 7.937 G40H-N 110.115 8.503 A41H-N 123.659 8.057 K42H-N 119.645 8.262 R45H-N 124.038 7.501 R47H-N 119.057 8.162 R47HE-NE 84.425 7.447 G48H-N 110.417 8.306 F50H-N 117.417 8.511 R51H-N 121.381 8.843 R51HE-NE 83.725 7.26 L52H-N 129.093 9.103 V53H-N 129.166 8.716 A54H-N 116.562 7.139 T55H-N 109.868 7.663 W56H-N 122.746 9.614 W56HE1-NE1 131.1 10.8 A57H-N 124.219 8.221 F58H-N 117.395 9.074 S60H-N 110.067 7.078 K61H-N 122.714 8.313 E62H-N 117.962 8.821 E63H-N 118.103 7.569 A64H-N 121.625 7.176 M65H-N 115.683 8.65 R66H-N 120.75 7.564 W67H-N 121.31 7.369 W67HE1-NE1 130.2 11.16 E68H-N 119.589 8.88 Y69H-N 117.245 7.718 E70H-N 120.162 7.695 V71H-N 118.683 8.293 K72H-N 117.535 8.245 H73H-N 113.757 7.005 L74H-N 121.569 7.294 S75H-N 118.374 8.355 R76H-N 123.085 8.865 R77H-N 117.552 8.492 K78H-N 119.056 7.662 K79H-N 122.45 9.039 E80H-N 118.55 8.509 Q81H-N 119.617 7.91 Q81HE21-NE2 111.42 7.503 Q81HE22-NE2 111.42 6.872 L82H-N 121.096 8.034 V83H-N 117.326 8.344 S84H-N 116.639 8.29 L85H-N 121.252 7.808 K86H-N 120.081 7.932 G87H-N 108.579 8.422 G88H-N 108.392 8.165 Y90H-N 118.861 8.197 E91H-N 121.954 8.001 N92H-N 120.023 8.564 N92HD21-ND2 112.97 7.663 N92HD22-ND2 112.97 6.95 T93H-N 114.202 8.205 T94H-N 116.656 8.171 K95H-N 123.952 8.287 L96H-N 123.581 8.276 S97H-N 116.693 8.398 T98H-N 115.695 8.203 T99H-N 116.419 8.127 L100H-N 124.213 8.206 E101H-N 121.31 8.277 H102H-N 119.823 8.29