Assignment w1 w2 L3H-N 122.43 8.745 I4H-N 125.237 8.824 T5H-N 124.237 8.802 F6H-N 124.358 9.239 I7H-N 126.251 9.509 S8H-N 124.211 8.88 D10H-N 113.865 7.667 G11H-N 109.808 8.538 S12H-N 118.381 8.233 R13H-N 119.429 8.386 K14H-N 122.872 8.313 T15H-N 119.577 8.058 Y16H-N 124.739 9.192 E17H-N 120.492 8.485 A18H-N 127.314 8.394 Y19H-N 118.845 8.588 D20H-N 121.106 8.28 G21H-N 115.001 9.011 E22H-N 121.98 7.856 T23H-N 110.39 8.234 L24H-N 120.243 8.41 L25H-N 116.005 6.645 S26H-N 115.141 7.847 L27H-N 122.244 7.869 A28H-N 120.875 8.002 H29H-N 117.818 8.587 R30H-N 118.408 8.264 N31H-N 114.401 6.906 N32H-N 114.697 7.637 N32HD21-ND2 112.385 6.709 N32HD22-ND2 112.385 7.439 V33H-N 119.649 8.003 D34H-N 128.347 8.469 L35H-N 127.456 7.864 V50H-N 119.554 9.21 I51H-N 121.739 8.279 I52H-N 126.048 8.454 D53H-N 127.679 7.698 S55H-N 113.47 8.853 W56H-N 120.568 8.656 W56HE1-NE1 121.969 10.605 Y57H-N 121.686 7.329 D58H-N 119.983 9.033 I59H-N 122.534 7.894 V60H-N 118.811 8.265 E61H-N 121.332 8.036 Q62H-N 117.653 7.912 Q62HE21-NE2 111.062 7.264 Q62HE22-NE2 111.062 6.594 H63H-N 113.347 6.929 N64H-N 121.506 7.875 E65H-N 126.101 8.791 I66H-N 125.274 8.973 S67H-N 125.487 8.585 D68H-N 122.043 8.929 E69H-N 118.225 8.852 E70H-N 121.051 7.923 N71H-N 118.461 7.988 D72H-N 118.807 8.129 M73H-N 117.61 7.523 L74H-N 123.258 8.85 D75H-N 115.491 7.439 L76H-N 116.66 7.039 A77H-N 123.914 7.736 F78H-N 122.688 8.31 G79H-N 112.822 8.383 L80H-N 118.988 6.978 T81H-N 118.057 9.176 D82H-N 118.08 8.679 T83H-N 107.059 7.893 S84H-N 121.526 6.993 R85H-N 118.632 9.358 L86H-N 120.203 9.122 I90H-N 117.06 6.736 I91H-N 128.173 8.157 L92H-N 127.403 8.979 T93H-N 110.385 6.27 K94H-N 120.484 9.071 E95H-N 118.365 8.422 L96H-N 116.407 7.727 D97H-N 116.722 7.046 G98H-N 117.545 8.957 L99H-N 122.555 7.239 C100H-N 121.421 5.355 V101H-N 121.51 8.691 I102H-N 126.427 9.582 L103H-N 127.589 8.321 T105H-N 113.257 8.108 E106H-N 122.035 8.291 T107H-N 115.185 8.308 R108H-N 122.789 8.289 N109H-N 120.177 8.365 I110H-N 120.936 7.983 S111H-N 118.751 8.176 F112H-N 122.536 8.118 V113H-N 122.561 7.907 K114H-N 125.629 8.283 N115H-N 121.24 8.452 N115HD21-ND2 112.801 7.54 N115HD22-ND2 112.801 6.816 S116H-N 121.26 7.838