Assignment w1 w2 D1H-N 121.997 8.1 Y2H-N 121.476 7.971 G3H-N 111.048 8.185 H5H-N 120.031 8.828 A6H-N 127.871 8.739 D7H-N 120.567 8.337 S8H-N 115.332 7.422 V10H-N 122.899 8.294 L11H-N 126.786 9.201 M12H-N 121.215 9.176 V13H-N 124.622 8.89 Y14H-N 124.35 9.107 G15H-N 109.422 8.302 L16H-N 118.402 8.612 D17H-N 122.627 8.38 Q18H-N 128.181 8.993 Q18HE21-NE2 112.942 7.764 Q18HE22-NE2 112.942 6.833 S19H-N 115.934 8.559 K20H-N 119.982 7.827 M21H-N 113.49 7.478 N22H-N 116.065 6.75 N22HD21-ND2 111.992 7.945 N22HD22-ND2 111.992 6.74 C23H-N 117.284 9.222 D24H-N 121.44 8.164 R25H-N 120.003 8.44 R25HE-NE 87.386 6.518 V26H-N 118.524 7.967 F27H-N 124.155 8.461 N28H-N 117.586 8.693 V29H-N 117.383 7.222 F30H-N 115.236 8.287 C31H-N 116.153 8.692 L32H-N 121.113 6.719 Y33H-N 113.76 7.73 G34H-N 109.503 7.118 N35H-N 121.056 8.481 N35HD21-ND2 112.935 7.649 N35HD22-ND2 112.935 6.995 V36H-N 126.223 8.857 E37H-N 124.47 9.338 K38H-N 115.326 7.81 V39H-N 121.09 8.508 K40H-N 127.023 9.05 F41H-N 129.505 9.592 M42H-N 120.497 8.307 K43H-N 129.902 8.802 S44H-N 110.3 8.184 K45H-N 122.936 7.167 G47H-N 113.675 9.094 A48H-N 121.606 8.173 A49H-N 122.079 8.994 M50H-N 119.337 8.762 V51H-N 122.914 8.722 E52H-N 129.875 9.021 M53H-N 126.786 9.228 A54H-N 119.257 7.985 D55H-N 107.011 7.209 G56H-N 105.277 8.917 Y57H-N 123.334 7.829 A58H-N 123.419 8.296 V59H-N 118.058 6.991 D60H-N 119.734 7.868 R61H-N 119.532 8.158 A62H-N 123.487 8.386 I63H-N 118.836 8.597 T64H-N 114.867 8.05 H65H-N 115.806 7.261 L66H-N 115.437 7.971 N67H-N 116.87 7.567 N68H-N 118.139 8.463 N68HD21-ND2 111.07 6.623 N68HD22-ND2 111.07 7.2 N69H-N 116.585 7.283 N69HD22-ND2 112.402 6.468 F70H-N 121.142 8.532 M71H-N 119.185 8.66 F72H-N 127.24 10.359 G73H-N 105.391 9.045 Q74H-N 120.249 7.924 K75H-N 125.281 8.366 M76H-N 128.315 8.75 N77H-N 123.957 8.486 V78H-N 124.599 8.662 C79H-N 123.121 9.274 V80H-N 120.628 8.381 S81H-N 120.242 8.292 K82H-N 124.05 8.423 Q83H-N 121.802 8.267 A85H-N 117.676 7.026 I86H-N 121.648 8.593 M87H-N 128.853 8.57 G89H-N 107.924 7.711 Q90H-N 122.738 8.471 S91H-N 120.345 8.375 Y92H-N 121.373 9.163 G93H-N 108.073 8.499 L94H-N 125.352 8.914 E95H-N 123.5 8.878 D96H-N 116.411 7.825 G97H-N 110.096 8.214 S98H-N 119.444 8.255 C99H-N 120.114 8.44 S100H-N 122.857 8.644 Y101H-N 124.84 7.516 K102H-N 128.413 8.173 D103H-N 125.174 7.919 F104H-N 126.973 8.878 S105H-N 120.412 8.995 E106H-N 120.68 8.492 S107H-N 116.008 7.979 R108H-N 120.855 8.083 N109H-N 115.696 8.346 N110H-N 121.422 7.062 R111H-N 121.699 10.255 F112H-N 119.24 8.932 S113H-N 117.646 8.493 T114H-N 109.436 7.264 E116H-N 118.551 8.668 Q117H-N 119.548 7.475 A118H-N 121.762 8.714 A119H-N 118.037 7.473 K120H-N 116.309 7.181 N121H-N 117.325 7.062 N121HD21-ND2 119.764 6.236 N121HD22-ND2 119.764 5.774 R122H-N 124.739 8.662 R122HE-NE 85.903 7.199 I123H-N 128.716 8.827 Q124H-N 125.194 7.903 H125H-N 123.528 8.728 S127H-N 119.557 6.531 N128H-N 114.671 8.554 V129H-N 120.745 8.177 L130H-N 124.64 9.695 H131H-N 124.405 9.09 F132H-N 123.734 8.401 F133H-N 117.606 9.051 N134H-N 118.041 9.225 A135H-N 116.291 7.826 L137H-N 124.521 8.096 E138H-N 115.062 8.515 V139H-N 119.598 6.883 T140H-N 114.762 7.999 E141H-N 120.155 9.101 E142H-N 118.253 8.123 N143H-N 116.98 7.608 N143HD21-ND2 110.739 7.592 N143HD22-ND2 110.739 6.946 F144H-N 116.118 7.004 F145H-N 121.727 8.393 E146H-N 118.446 8.092 I147H-N 120.273 7.452 C148H-N 119.173 8.199 D149H-N 120.37 8.336 E150H-N 122.99 7.975 L151H-N 118.019 8.101 G152H-N 108.687 7.987 V153H-N 114.118 7.739 K154H-N 122.608 8.307 R155H-N 124.503 8.429 R155HE-NE 85.022 7.906 T157H-N 117.227 8.864 S158H-N 114.016 7.261 V159H-N 125.585 8.48 K160H-N 129.304 8.927 V161H-N 127.013 8.782 F162H-N 129.367 9.279 S163H-N 119.291 8.699 G164H-N 112.493 8.508 K165H-N 122.505 8.426 S166H-N 116.261 8.317 R168H-N 118.363 8.68 S169H-N 113.642 7.817 S170H-N 117.611 9.115 S171H-N 115.12 8.459 G172H-N 105.514 6.869 L173H-N 120.918 8.752 L174H-N 122.773 9.24 E175H-N 124.462 8.153 W176H-N 126.076 8.878 W176HE1-NE1 131.587 9.68 D177H-N 120.145 9.552 S178H-N 110.789 7.615 K179H-N 123.821 8.96 S180H-N 117.265 8.227 D181H-N 122.482 7.282 A182H-N 122.134 6.946 L183H-N 121.283 8.096 E184H-N 117.646 8.039 T185H-N 114.176 7.33 L186H-N 125.748 8.555 G187H-N 101.916 7.677 F188H-N 118.972 7.628 L189H-N 121.138 9.364 N190H-N 118.212 7.517 N190HD21-ND2 107.537 8.29 N190HD22-ND2 107.537 7.356 H191H-N 118.472 7.944 Y192H-N 123.826 7.908 Q193H-N 126.528 7.629 M194H-N 127.111 9.076 K195H-N 124.569 8.709 N196H-N 122.125 8.79 N198H-N 114.502 7.934 G199H-N 109.477 7.37 Y201H-N 120.256 7.706 Y203H-N 121.877 8.804 T204H-N 120.716 8.283 L205H-N 133.105 8.896 K206H-N 124.507 8.129 L207H-N 118.15 7.544 C208H-N 116.912 8.995 F209H-N 130.672 9.176 S210H-N 114.602 8.459 T211H-N 117.545 8.546 A212H-N 127.491 8.722 Q213H-N 119.531 8.309 Q213HE21-NE2 113.913 7.581 Q213HE22-NE2 113.913 6.857 H214H-N 116.706 7.868 A215H-N 126.673 8.657 S216H-N 121.343 7.589