Assignment w1 w2 S3H-N 117.3 8.499 N4H-N 120.836 8.629 N4HD21-ND2 112.135 7.6 N4HD22-ND2 112.135 6.953 V5H-N 119.515 8.09 Q6H-N 122.876 8.485 Q6HE21-NE2 111.932 7.66 Q6HE22-NE2 111.932 6.819 N7H-N 118.907 8.39 N7HD21-ND2 112.11 7.632 N7HD22-ND2 112.11 6.949 D8H-N 119.673 8.168 C9H-N 124.35 9.629 R10H-N 111.693 7.343 R10HE-NE 84.31 6.9 V11H-N 119.042 8.838 T12H-N 119.06 7.981 N13H-N 119.869 8.217 N13HD21-ND2 117.254 7.297 N13HD22-ND2 117.254 9.451 A15H-N 117.316 7.76 T16H-N 102.415 6.743 G17H-N 111.144 8.732 H18H-N 118.884 7.872 L19H-N 128.614 7.807 F20H-N 125.843 9.293 D21H-N 120.399 8.56 L22H-N 124.589 8.195 T23H-N 114.894 8.86 S24H-N 114.224 8.581 L25H-N 118.513 7.91 K26H-N 121.148 7.556 R27H-N 124.003 8.217 R27HE-NE 84.566 6.843 E28H-N 125.448 9.191 S29H-N 109.517 8.205 G30H-N 106.551 7.359 Y31H-N 119.148 9.193 T32H-N 117.585 8.722 I33H-N 121.332 9.343 T34H-N 113.397 8.315 D35H-N 121.21 8.213 S36H-N 112.229 8.147 H37H-N 119.514 8.261 N38H-N 113.868 8.312 N38HD21-ND2 111.95 6.827 N38HD22-ND2 111.95 7.593 R39H-N 117.873 8.399 R39HE-NE 84.572 8.982 K40H-N 122.174 8.164 I41H-N 126.658 9.088 E42H-N 126.408 8.875 L43H-N 118.709 9.36 N44H-N 116.774 8.117 N44HD21-ND2 109.313 7.59 N44HD22-ND2 109.313 7.057 V45H-N 119.629 8.483 C46H-N 117.797 8.299 A47H-N 114.238 7.268 E48H-N 115.214 8.451 A49H-N 123.379 8.684 K50H-N 124.342 8.458 S51H-N 118.688 8.198 S52H-N 113.333 9.112 C53H-N 118.999 8.159 A54H-N 122.523 8.321 N55H-N 113.302 8.393 N55HD21-ND2 113.234 7.004 N55HD22-ND2 113.234 7.78 G56H-N 106.84 8.426 A57H-N 121.234 7.553 A58H-N 126.924 9.643 V59H-N 113.32 6.897 C60H-N 126.968 9.761 I61H-N 131.033 9.764 T62H-N 125.739 9.655 D63H-N 126.613 8.542 G64H-N 117.05 8.977 K66H-N 121.094 7.58 T67H-N 117.352 8.373 L68H-N 127.083 8.997 N69H-N 126.103 8.464 N69HD21-ND2 104.677 7.689 N69HD22-ND2 104.677 7.689 A70H-N 129.561 8.626 G71H-N 107.697 8.438 K72H-N 124.636 8.831 L73H-N 116.192 7.738 S74H-N 115.163 6.923 K75H-N 121.598 8.723 T76H-N 117.511 8.046 L77H-N 128.553 8.888 T78H-N 113.346 8.703 Y79H-N 123.895 8.866 E80H-N 127.001 8.409 D81H-N 124.444 9.08 Q82H-N 103.877 6.831 Q82HE21-NE2 111.682 7.621 Q82HE22-NE2 111.682 6.881 V83H-N 119.987 7.515 L84H-N 122.965 8.293 K85H-N 122.173 9.055 L86H-N 124.779 8.49 V87H-N 124.743 8.759 Y88H-N 127.672 9.214 E89H-N 121.597 9.119 D90H-N 114.581 9.219 G91H-N 102.277 8.517 D92H-N 118.452 8.742 C94H-N 122.803 8.457 T96H-N 108.18 7.086 D97H-N 117.566 7.06 L98H-N 123.543 8.432 K99H-N 117.036 8.242 M100H-N 119.049 8.563 K101H-N 119.572 8.468 K103H-N 119.908 8.477 S104H-N 124.026 9.097 Y105H-N 125.399 9.347 F106H-N 122.736 9.416 S107H-N 115.923 7.671 F108H-N 124.473 9.646 V109H-N 120.34 8.344 C110H-N 122.764 9.134 K111H-N 129.588 6.971 S112H-N 122.743 9.176 D113H-N 117.945 8.296 A114H-N 122.188 7.984 G115H-N 108.823 8.579 D116H-N 120.262 8.569 D117H-N 118.595 8.661 S118H-N 116.521 8.153 Q119H-N 120.136 8.258 Q119HE21-NE2 111.699 6.833 Q119HE22-NE2 111.699 7.571 V121H-N 114.607 8.746 F122H-N 125.155 8.781 L123H-N 127.569 8.546 S124H-N 108.406 6.535 F125H-N 119.445 8.524 D126H-N 126.819 8.868 E127H-N 124.876 8.846 Q128H-N 115.427 8.159 T129H-N 101.452 6.661 C130H-N 115.395 7.755 S132H-N 115.713 7.745 Y133H-N 121.88 8.796 F134H-N 118.008 9.074 S135H-N 115.439 9.081 W136H-N 126.821 8.819 W136HE1-NE1 127.401 9.781 H137H-N 126.806 9.063 T138H-N 118.539 9.096 S139H-N 129.139 9.333 L140H-N 129.802 7.96 A141H-N 116.397 7.098 C142H-N 116.488 7.522 E143H-N 122.883 8.965 E144H-N 120.355 8.178 E145H-N 122.189 8.572 V146H-N 122.371 8.188 R148H-N 120.079 8.371 R148HE-NE 84.375 7.267