Assignment w1 w2 A2H-N 127.112 8.63 A3H-N 123.779 8.295 E4H-N 121.155 8.175 V6H-N 120.424 8.121 E7H-N 124.684 8.41 D8H-N 122.079 8.283 N9H-N 118.758 8.374 N9HD21-ND2 112.175 7.444 N9HD22-ND2 112.175 6.79 C10H-N 118.078 7.804 I11H-N 125.267 8.343 N12H-N 125.787 8.704 N12HD21-ND2 114.172 7.441 N12HD22-ND2 114.172 6.688 F13H-N 122.408 9.001 V14H-N 113.727 8.809 A15H-N 122.244 7.998 M16H-N 117.467 8.288 K17H-N 118.681 8.836 F18H-N 127.376 8.626 I19H-N 126.477 8.335 D20H-N 126.766 8.958 N21H-N 113.077 8.407 N21HD21-ND2 112.81 7.514 N21HD22-ND2 112.81 6.966 T22H-N 113.808 6.882 L23H-N 126.409 7.686 Y24H-N 122.782 8.612 F25H-N 117.56 9.367 I26H-N 120.891 8.097 A27H-N 130.071 9.244 E28H-N 120.464 8.433 D29H-N 122.237 8.434 D30H-N 121.41 8.264 E31H-N 121.755 8.518 N32H-N 118.284 8.432 N32HD21-ND2 113.886 7.673 N32HD22-ND2 113.886 6.87 L33H-N 121.665 8.022 E34H-N 119.836 8.242 S35H-N 115.694 8.064 D36H-N 121.732 8.32 Y37H-N 119.841 7.91 F38H-N 119.249 8.043 G39H-N 108.92 7.899 K40H-N 120.169 7.865 L41H-N 122.28 8.174 E42H-N 120.56 8.315 S43H-N 115.708 8.074 K44H-N 120.964 8.166 L45H-N 119.143 7.794 S46H-N 115.786 7.713 V47H-N 120.435 7.931 I48H-N 122.792 7.291 R49H-N 126.996 8.347 N50H-N 121.791 9.075 N50HD21-ND2 110.039 7.787 N50HD22-ND2 110.039 6.865 L51H-N 124.662 7.294 N52H-N 118.906 9.057 N52HD21-ND2 113.823 7.62 N52HD22-ND2 113.823 6.888 D53H-N 113.24 8.46 Q54H-N 112.649 7.369 Q54HE21-NE2 107.681 7.902 Q54HE22-NE2 107.681 6.577 V55H-N 120.811 7.806 L56H-N 128.028 8.892 F57H-N 122.854 8.596 I58H-N 121.989 9.111 D59H-N 125.606 8.651 Q60H-N 121.973 8.309 Q60HE21-NE2 111.172 7.2 Q60HE22-NE2 111.172 6.682 G61H-N 108.014 8.485 N62H-N 119.154 7.829 N62HD21-ND2 112.239 7.578 N62HD22-ND2 112.239 6.81 R63H-N 122.081 8.094 L65H-N 120.244 7.989 F66H-N 119.803 7.943 E67H-N 121.048 8.417 D68H-N 120.423 8.135 M69H-N 120.662 8.146 T70H-N 114.303 8.089 D71H-N 122.548 8.268 S72H-N 116.055 8.169 D73H-N 122.129 8.332 C74H-N 119.192 8.146 R75H-N 123.165 8.327 D76H-N 120.152 8.216 N77H-N 117.851 8.106 N77HD21-ND2 112.939 7.507 N77HD22-ND2 112.939 6.825 A78H-N 124.394 8.081 R80H-N 122.228 8.343 T81H-N 119.53 8.106 I82H-N 125.84 8.611 F83H-N 130.525 9.123 I84H-N 126.816 8.834 I85H-N 129.292 8.866 S86H-N 123.379 8.751 M87H-N 122.592 8.737 Y88H-N 123.252 8.448 K89H-N 121.955 8.593 D90H-N 119.274 8.235 S91H-N 118.144 8.482 Q92H-N 122.101 8.325 Q92HE21-NE2 113.246 7.518 Q92HE22-NE2 113.246 6.826 R94H-N 113.298 7.625 G95H-N 107.057 7.592 M96H-N 120.502 8.704 A97H-N 129.858 8.841 V98H-N 114.926 9.528 T99H-N 110.881 8.689 I100H-N 126.939 10.368 S101H-N 120.341 9.09 V102H-N 118.761 8.924 K103H-N 127.077 8.944 C104H-N 127.819 7.899 E105H-N 124.533 9.039 K106H-N 117.398 7.938 I107H-N 121.833 8.312 S108H-N 121.784 8.577 T109H-N 121.878 9.556 L110H-N 131.094 8.938 S111H-N 117.822 8.63 C112H-N 120.239 8.695 E113H-N 123.422 7.963 N114H-N 118.9 8.641 N114HD21-ND2 114.166 7.522 N114HD22-ND2 114.166 6.865 K115H-N 110.463 8.172 I116H-N 118.757 7.012 I117H-N 122.906 8.326 S118H-N 124.161 8.916 F119H-N 118.35 8.502 K120H-N 121.95 8.949 E121H-N 125.688 8.912 M122H-N 125.103 7.983 N123H-N 122.862 8.679 N123HD21-ND2 112.142 7.512 N123HD22-ND2 112.142 6.792 D126H-N 120.547 8.616 N127H-N 114.25 7.637 N127HD21-ND2 114.139 7.649 N127HD22-ND2 114.139 6.87 I128H-N 119.999 8.499 K129H-N 122.835 8.193 D130H-N 117.819 7.762 T131H-N 114.03 7.405 K132H-N 123.571 8.018 S133H-N 115.197 8.132 I135H-N 108.724 6.952 I136H-N 121.661 7.085 F137H-N 128.552 9.288 F138H-N 117.924 9.906 Q139H-N 123.13 9.084 Q139HE21-NE2 107.586 6.637 Q139HE22-NE2 107.586 6.496 R140H-N 125.327 8.898 S141H-N 117.467 8.551 V142H-N 124.922 8.473 G144H-N 113.235 8.665 H145H-N 120.203 8.033 D146H-N 122.181 8.553 N147H-N 114.508 8.056 N147HD21-ND2 111.745 7.603 N147HD22-ND2 111.745 6.891 K148H-N 117.155 7.56 M149H-N 118.674 8.713 Q150H-N 117.489 8.552 Q150HE21-NE2 110.894 7.223 Q150HE22-NE2 110.894 6.642 F151H-N 117.029 9.919 E152H-N 125.176 9.156 S153H-N 120.506 8.866 S154H-N 119.982 7.442 S155H-N 115.894 7.651 Y156H-N 121.429 7.505 E157H-N 122.455 8.115 G158H-N 113.933 10.297 Y159H-N 119.695 8.274 F160H-N 120.834 9.24 L161H-N 118.034 8.303 A162H-N 127.532 9.151 C163H-N 113.786 9.291 E164H-N 120.628 8.965 K165H-N 126.309 8.797 E166H-N 129.191 8.832 R167H-N 123.914 8.896 D168H-N 119.015 8.75 L169H-N 120.057 7.748 F170H-N 117.199 8.52 K171H-N 122.105 9.308 L172H-N 124.196 8.345 I173H-N 121.506 9.136 L174H-N 122.237 8.209 K175H-N 127.195 9.361 K176H-N 126.663 8.746 E177H-N 123.801 8.466 D178H-N 114.28 8.16 E179H-N 117.952 7.712 L180H-N 121.449 7.397 G181H-N 108.718 8.167 D182H-N 120.022 8.333 R183H-N 117.85 8.316 S184H-N 113.224 7.7 I185H-N 118.157 8.81 M186H-N 124.451 8.509 F187H-N 127.515 8.07 T188H-N 118.576 6.66 V189H-N 111.959 7.86 Q190H-N 124.889 8.704 Q190HE21-NE2 111.609 7.554 Q190HE22-NE2 111.609 6.7 N191H-N 124.01 8.562 N191HD21-ND2 110.422 7.092 N191HD22-ND2 110.422 6.486 E192H-N 121.742 7.984 D193H-N 126.829 7.947