Assignment w1 w2 A10H-N 122.892 8.053 I12H-N 121.06 8.178 F13H-N 127.442 8.867 T14H-N 117.108 8.83 F15H-N 123.663 9.028 E16H-N 121.805 10.141 E17H-N 112.482 7.533 V19H-N 119.614 6.845 T20H-N 121.157 8.771 H21H-N 122.988 8.09 V22H-N 117.59 9.123 S23H-N 116.53 8.376 E24H-N 127.904 8.581 S25H-N 109.205 8.024 I26H-N 121.579 7.709 G27H-N 112.964 8.786 I28H-N 125.187 7.855 M29H-N 127.442 9.16 E30H-N 123.471 8.398 V31H-N 122.82 9.043 K32H-N 124.06 8.683 V33H-N 121.831 8.925 L34H-N 125.301 8.881 R35H-N 123.084 8.061 T36H-N 117.972 8.786 S37H-N 112.385 8.72 G38H-N 108.952 7.834 A39H-N 121.692 8.053 R40H-N 119.904 8.097 G41H-N 112.898 8.852 N42H-N 119.324 8.449 N42HD21-ND2 113.06 7.233 N42HD22-ND2 113.06 7.628 V43H-N 124.241 9.123 I44H-N 126.653 8.977 V45H-N 126.653 9.101 Y47H-N 115.266 8.464 K48H-N 115.181 8.757 T49H-N 109.966 8.112 I50H-N 121.128 9.24 E51H-N 125.3 9.042 G52H-N 111.036 7.585 T53H-N 119.422 8.456 A54H-N 123.947 9.365 R55H-N 122.892 10.032 G56H-N 112.964 9.321 G57H-N 111.518 9.218 G58H-N 104.193 7.877 E59H-N 121.128 7.214 D60H-N 113.913 8.544 F61H-N 117.408 7.775 E62H-N 119.807 8.141 D63H-N 125.205 8.361 T64H-N 118.197 8.654 C65H-N 121.446 8.171 G66H-N 108.723 7.233 E67H-N 119.775 8.566 L68H-N 125.108 9.196 E69H-N 124.06 8.72 F70H-N 126.94 9.687 Q71H-N 121.736 9.533 Q71HE21-NE2 112.385 6.793 Q71HE22-NE2 112.385 7.566 N72H-N 121.06 8.214 D73H-N 118.94 9.533 E74H-N 121.354 8.192 I75H-N 115.604 8.727 V76H-N 119.437 7.548 K77H-N 125.012 8.339 T78H-N 110.458 7.929 I79H-N 122.988 8.94 S80H-N 122.025 8.126 V81H-N 123.181 8.779 K82H-N 129.134 9.284 V83H-N 128.457 8.288 I84H-N 130.487 8.002 D85H-N 131.084 8.867 D86H-N 120.867 8.266 E87H-N 119.325 8.53 E88H-N 119.036 7.921 Y89H-N 127.422 8.977 E90H-N 129.246 8.127 K91H-N 117.59 7.841 N92H-N 119.888 8.412 N92HD21-ND2 111.422 7.269 N92HD22-ND2 111.422 7.401 K93H-N 122.313 8.171 T94H-N 111.616 8.134 F95H-N 121.157 8.625 F96H-N 114.724 9.145 L97H-N 121.639 8.815 E98H-N 123.383 9.196 I99H-N 118.535 8.398 G100H-N 108.726 8.258 E101H-N 115.604 7.804 R103H-N 117.408 8.786 L104H-N 125.413 8.779 V105H-N 125.864 8.581 E106H-N 125.494 8.515 M107H-N 122.256 8.537 S108H-N 116.723 8.354 E109H-N 122.795 8.5 K110H-N 122.024 8.251 K111H-N 122.602 8.31 G112H-N 109.976 8.405 G113H-N 108.434 8.214 T115H-N 116.723 8.163 I116H-N 123.47 8.244 T117H-N 117.972 8.149 E118H-N 123.084 8.361 E119H-N 121.354 8.313 Y120H-N 121.016 8.141 D121H-N 122.594 8.207 D122H-N 121.241 8.222 K123H-N 119.904 8.185 Q124H-N 121.354 8.105 L126H-N 122.313 8.39 T127H-N 113.542 8.229 S128H-N 117.494 8.464 E133H-N 119.929 8.28 R134H-N 120.677 8.119 R135H-N 120.114 8.017 I136H-N 119.614 8.017 A137H-N 124.049 7.995 E138H-N 117.783 8.05 M139H-N 118.483 7.951 G140H-N 107.952 8.083 R141H-N 120.677 7.577 I143H-N 112.964 8.412 L144H-N 120.796 8.603 G145H-N 109.398 8.969 E146H-N 120.452 8.376 H147H-N 115.153 8.141 T148H-N 113.687 8.559 K149H-N 123.271 8.053 L150H-N 130.599 9.196 E151H-N 129.349 8.266 V152H-N 128.232 8.61 I153H-N 126.315 8.229 I154H-N 127.555 9.057 E155H-N 128.57 9.467 E156H-N 127.422 8.215 S157H-N 122.699 9.431 Y158H-N 128.193 10.336 E159H-N 121.579 7.98 F160H-N 121.128 7.951 K161H-N 122.892 7.899 S162H-N 116.819 8.178 T163H-N 115.663 8.097 V164H-N 121.06 8.072 D165H-N 129.021 7.933