Assignment w1 w2 A2H-N 118.303 7.967 H3H-N 125.322 8.008 W5H-N 120.662 7.549 G6H-N 110.307 8.078 Y7H-N 120.652 8.588 G8H-N 111.348 8.286 K9H-N 120.028 8.693 G12H-N 109.424 7.481 E14H-N 119.504 8.754 H15H-N 116.411 8.736 W16H-N 122.721 7.427 H17H-N 115.301 8.877 K18H-N 120.674 6.955 D19H-N 115.767 7.184 I22H-N 121.301 8.04 A23H-N 123.963 8.698 K24H-N 115.664 7.268 G25H-N 109.678 8.325 E26H-N 118.563 9.316 R27H-N 120.817 8.029 Q28H-N 116.312 7.672 S29H-N 118.953 8.141 V31H-N 108.007 6.33 D32H-N 119.277 8.324 I33H-N 129.3 8.728 D34H-N 129.126 7.463 T35H-N 123.029 10.321 H36H-N 119.644 8.832 T37H-N 109.739 7.686 A38H-N 128.109 7.482 K39H-N 123.646 8.224 Y40H-N 127.817 8.691 D41H-N 129.758 7.731 S43H-N 116.062 8.52 L44H-N 124.078 7.071 K45H-N 126.925 8.706 L47H-N 126.381 8.952 S48H-N 120.512 8.495 V49H-N 128.114 8.372 S50H-N 123.661 8.407 Y51H-N 123.88 8.9 D52H-N 121.795 8.846 Q53H-N 115.338 8.033 A54H-N 121.18 7.455 T55H-N 121.451 9.406 S56H-N 127.201 9.942 L57H-N 118.487 8.946 R58H-N 115.508 7.237 R58HE-NE 84.0 7.349 I59H-N 123.104 9.08 L60H-N 124.89 8.776 N61H-N 117.612 8.025 N62H-N 118.439 7.059 G63H-N 111.404 9.787 A64H-N 123.474 8.348 A65H-N 121.55 8.568 F66H-N 111.1 7.181 N67H-N 121.536 9.083 N67HD21-ND2 106.754 5.868 N67HD22-ND2 106.754 7.442 V68H-N 123.1 8.705 E69H-N 124.891 8.508 F70H-N 120.097 8.648 D71H-N 118.022 8.432 D72H-N 132.368 9.006 S73H-N 116.59 8.738 Q74H-N 125.667 8.99 D75H-N 122.01 8.421 K76H-N 124.922 7.982 A77H-N 124.308 8.231 V78H-N 116.884 8.418 L79H-N 124.598 9.033 K80H-N 115.2 8.03 G81H-N 107.396 8.988 G82H-N 109.503 7.1 L84H-N 121.199 7.783 D85H-N 125.969 9.066 G86H-N 110.22 7.839 T87H-N 117.428 8.472 Y88H-N 127.2 8.537 R89H-N 123.637 8.616 R89HE-NE 86.2 7.83 L90H-N 125.042 8.545 I91H-N 123.771 8.907 Q92H-N 116.215 7.369 F93H-N 114.564 8.65 H94H-N 114.101 8.228 F95H-N 118.252 8.953 H96H-N 115.486 8.712 W97H-N 120.164 9.638 G98H-N 108.709 8.162 S99H-N 113.016 8.479 L100H-N 119.872 7.397 D101H-N 121.484 8.853 G102H-N 103.705 7.656 Q103H-N 115.768 7.854 G104H-N 107.216 8.238 S105H-N 108.623 7.356 E106H-N 119.548 8.307 H107H-N 118.656 10.689 T108H-N 110.096 7.396 V109H-N 119.442 7.684 D110H-N 133.026 9.702 K111H-N 110.652 9.865 K112H-N 125.309 8.279 K113H-N 122.707 7.936 Y114H-N 122.026 8.172 A115H-N 121.897 7.636 A116H-N 112.986 8.178 E117H-N 121.717 9.414 L118H-N 131.388 9.906 L120H-N 124.708 9.05 V121H-N 127.399 9.24 H122H-N 125.321 8.561 W123H-N 120.11 9.091 N124H-N 120.666 9.046 T125H-N 118.152 8.181 K126H-N 123.892 7.982 Y127H-N 116.235 7.614 G128H-N 108.309 7.842 D129H-N 117.394 7.511 F130H-N 120.805 7.566 G131H-N 104.65 8.08 K132H-N 120.52 7.706 A133H-N 125.267 8.061 V134H-N 109.124 7.408 Q135H-N 114.877 6.65 Q136H-N 119.238 7.589 D138H-N 115.831 7.935 G139H-N 108.594 7.973 L140H-N 116.905 8.858 A141H-N 124.454 9.03 V142H-N 125.197 7.263 L143H-N 128.907 8.504 G144H-N 114.926 9.944 I145H-N 125.321 9.169 F146H-N 129.881 10.129 L147H-N 121.06 8.246 K148H-N 120.396 8.985 V149H-N 122.241 8.431 G150H-N 118.762 9.114 S151H-N 125.206 8.354 A152H-N 122.297 8.357 K153H-N 124.721 8.709 L156H-N 117.725 7.558 Q157H-N 123.083 7.846 K158H-N 123.877 7.076 V159H-N 114.098 7.066 V160H-N 115.349 7.356 D161H-N 118.548 8.355 V162H-N 114.733 7.173 L163H-N 122.41 7.091 D164H-N 116.749 8.196 S165H-N 114.268 8.029 I166H-N 116.956 7.44 K167H-N 118.121 7.341 T168H-N 99.901 6.652 K169H-N 121.765 7.537 G170H-N 117.534 8.976 K171H-N 121.137 7.86 S172H-N 114.501 8.312 A173H-N 124.243 9.033 D174H-N 122.989 8.604 F175H-N 125.898 8.008 T176H-N 115.818 8.084 N177H-N 116.394 9.664 F178H-N 119.863 8.264 D179H-N 129.063 7.943 R181H-N 119.341 8.37 R181HE-NE 84.5 8.27 G182H-N 103.463 7.33 L183H-N 118.261 7.29 L184H-N 114.002 6.659 E186H-N 117.229 8.188 S187H-N 112.233 7.628 L188H-N 126.307 8.611 D189H-N 122.533 7.38 Y190H-N 119.47 8.715 W191H-N 118.144 9.577 T192H-N 116.106 9.709 Y193H-N 126.571 8.122 G195H-N 111.536 9.431 S196H-N 121.176 8.73 L197H-N 116.846 8.189 T198H-N 110.579 8.509 T199H-N 110.006 7.076 L202H-N 120.851 9.138 L203H-N 111.76 6.019 E204H-N 125.592 8.795 C205H-N 115.548 7.639 V206H-N 119.89 7.288 T207H-N 125.955 8.506 W208H-N 130.3 8.282 I209H-N 128.024 8.802 V210H-N 129.356 9.745 L211H-N 127.807 9.007 K212H-N 123.045 7.403 E213H-N 122.039 8.849 I215H-N 113.956 8.898 S216H-N 117.372 8.096 V217H-N 116.558 8.526 S218H-N 116.858 8.425 S219H-N 118.301 9.301 E220H-N 119.26 8.366 Q221H-N 118.801 7.541 V222H-N 115.518 7.351 L223H-N 121.521 7.982 K224H-N 115.995 6.938 F225H-N 119.452 7.148 R226H-N 109.872 6.708 R226HE-NE 86.1 7.01 K227H-N 114.896 6.889 L228H-N 120.359 7.151 N229H-N 119.196 8.925 F230H-N 118.117 8.924 N231H-N 112.035 8.24 G232H-N 105.843 8.711 E233H-N 122.097 8.406 G234H-N 114.742 9.042 E235H-N 120.932 7.377 E237H-N 124.124 8.221 E238H-N 130.576 8.975 L239H-N 119.883 8.645 M240H-N 123.826 7.502 V241H-N 116.116 6.789 D242H-N 115.756 7.164 W244H-N 114.891 6.545 R245H-N 127.207 10.189 R245HE-NE 87.9 6.49 A247H-N 121.627 7.98 Q248H-N 122.786 8.723 L250H-N 126.488 8.679 K251H-N 115.337 8.882 N252H-N 121.815 7.636 R253H-N 119.37 7.347 R253HE-NE 84.7 7.79 Q254H-N 119.101 8.548 I255H-N 125.328 8.894 K256H-N 127.401 8.792 A257H-N 124.578 8.458 S258H-N 117.252 8.943 F259H-N 118.924 6.714 K260H-N 125.124 7.711