Assignment w1 w2 I35H-N 119.173 7.744 F36H-N 120.4 7.764 A37H-N 121.973 7.566 E39H-N 125.257 10.774 G40H-N 108.859 8.964 N41H-N 117.206 7.966 Y42H-N 122.835 8.251 R43H-N 127.889 12.166 Y44H-N 120.566 10.476 L45H-N 117.362 7.173 T46H-N 114.096 8.446 Y47H-N 119.162 8.056 G48H-N 107.125 8.587 A49H-N 122.814 8.627 E50H-N 121.551 8.829 K51H-N 126.165 8.697 L52H-N 128.672 8.655 G55H-N 107.253 8.083 S56H-N 113.757 7.184 Y57H-N 118.122 8.856 A58H-N 122.64 9.081 R60H-N 123.164 8.832 V61H-N 122.516 8.358 Q62H-N 125.615 8.488 Q62HE21-NE2 110.785 7.276 Q62HE22-NE2 110.785 6.679 G63H-N 107.847 8.111 E64H-N 122.887 8.522 A66H-N 124.108 8.218 K67H-N 121.227 8.407 G68H-N 112.822 8.838 E69H-N 118.085 9.484 M70H-N 116.787 7.703 L71H-N 120.522 6.891 A72H-N 125.708 7.631 G73H-N 109.201 8.892 T74H-N 111.224 8.148 A75H-N 124.773 9.161 V76H-N 121.304 8.488 Y77H-N 122.993 9.166 N78H-N 116.891 8.313 N78HD21-ND2 114.509 7.944 N78HD22-ND2 114.509 6.849 G79H-N 109.813 8.789 E80H-N 123.088 9.421 V81H-N 118.356 7.145 L82H-N 130.274 8.877 H83H-N 126.75 8.826 F84H-N 121.708 8.616 H85H-N 116.079 7.878 N88H-N 124.352 7.879 G89H-N 112.768 8.345 R90H-N 120.996 7.839 Y92H-N 122.337 8.979 T94H-N 112.246 9.379 R95H-N 119.707 8.474 G96H-N 111.364 8.682 R97H-N 121.898 9.192 F98H-N 122.01 8.007 A99H-N 128.288 7.924 A100H-N 118.833 8.614 K101H-N 122.644 8.877 V102H-N 127.834 9.288 D103H-N 125.821 8.394 F104H-N 123.086 8.921 G105H-N 108.704 8.617 S106H-N 115.57 7.697 K107H-N 116.935 7.829 S108H-N 114.388 8.363 V109H-N 121.671 8.268 D110H-N 127.616 8.444 G111H-N 110.005 7.611 I112H-N 118.543 8.76 I113H-N 124.393 8.75 D114H-N 126.961 8.788 S115H-N 118.197 7.57 G116H-N 107.871 8.378 D117H-N 120.507 7.877 D118H-N 123.221 8.322 L119H-N 115.534 7.872 H120H-N 116.581 6.978 G122H-N 103.468 7.674 T123H-N 124.166 8.37 Q124H-N 122.562 8.631 K127H-N 121.482 8.356 A128H-N 123.792 9.117 A129H-N 123.347 8.069 I130H-N 123.126 7.951 D131H-N 128.004 8.776 G132H-N 116.402 9.012 N133H-N 122.568 8.274 N133HD21-ND2 111.027 8.074 N133HD22-ND2 111.027 7.118 G134H-N 105.523 7.902 F135H-N 112.644 8.237 K136H-N 118.932 8.139 G137H-N 114.895 9.41 T138H-N 112.666 8.263 W139H-N 123.88 7.599 W139HE1-NE1 128.06 10.587 T140H-N 115.632 8.646 G145H-N 107.989 8.385 D146H-N 118.435 8.421 V147H-N 118.089 7.592 S148H-N 120.356 8.887 G149H-N 105.988 7.249 R150H-N 118.922 8.509 F151H-N 119.478 8.248 Y152H-N 120.988 9.467 G153H-N 107.655 8.014 A155H-N 120.664 9.726 G156H-N 107.907 7.855 E157H-N 121.965 10.154 E158H-N 117.704 9.207 V159H-N 119.358 8.805 A160H-N 124.73 8.351 G161H-N 107.426 7.545 K162H-N 114.513 8.607 Y163H-N 115.145 8.582 S164H-N 113.345 9.218 Y165H-N 127.656 9.594 G173H-N 102.624 8.499 G174H-N 106.817 9.226 F175H-N 118.097 8.283 G176H-N 105.271 7.475 V177H-N 109.078 8.733 F178H-N 115.493 8.006 A179H-N 119.683 8.548 G180H-N 104.964 9.241 K181H-N 116.149 8.671 K182H-N 125.656 8.72 E183H-N 128.02 8.997 Q184H-N 122.798 8.533 Q184HE21-NE2 111.719 7.605 Q184HE22-NE2 111.719 6.904 L186H-N 118.909 7.506