Assignment w1 w2 A8H-N 126.301 8.519 M9H-N 120.529 8.522 G10H-N 110.151 8.448 T11H-N 114.123 8.108 L12H-N 124.971 8.376 T13H-N 117.98 8.197 H15H-N 118.798 8.602 K16H-N 121.132 8.237 T17H-N 114.933 7.98 I18H-N 120.452 8.63 S19H-N 116.698 7.923 F20H-N 123.045 8.971 G21H-N 111.752 8.814 S22H-N 122.813 8.796 L23H-N 128.813 8.982 T24H-N 123.999 9.53 I25H-N 124.891 9.269 D26H-N 126.66 9.098 V28H-N 123.156 8.083 N29H-N 114.586 7.394 R30H-N 117.52 7.257 Q31H-N 116.816 7.835 V32H-N 126.66 9.237 L33H-N 127.083 9.033 L34H-N 123.737 9.026 G35H-N 119.346 9.741 G36H-N 105.159 8.822 E37H-N 119.816 7.6 N38H-N 122.622 8.859 V39H-N 128.044 8.775 A40H-N 132.042 8.762 L41H-N 123.636 8.298 S42H-N 119.269 9.37 T43H-N 117.304 8.698 A44H-N 121.172 8.208 D45H-N 120.908 7.791 F46H-N 121.968 8.819 D47H-N 119.641 8.362 L48H-N 122.659 7.927 L49H-N 120.034 8.266 W50H-N 118.691 9.087 E51H-N 119.799 7.941 L52H-N 119.561 7.889 A53H-N 119.897 8.586 T54H-N 106.101 7.568 H55H-N 119.755 7.018 A56H-N 121.377 6.843 G57H-N 109.492 9.192 Q58H-N 119.445 8.269 I59H-N 122.694 8.639 M60H-N 128.96 9.378 D61H-N 123.53 8.422 R62H-N 120.426 8.729 D63H-N 117.404 8.325 A64H-N 123.02 7.953 L65H-N 117.184 7.905 L66H-N 117.983 8.052 K67H-N 118.745 7.708 N68H-N 115.653 7.954 N68HD21-ND2 113.523 7.102 N68HD22-ND2 113.523 7.675 L69H-N 120.214 7.733 R70H-N 119.518 8.127 G71H-N 109.421 8.432 V72H-N 117.704 7.758 T73H-N 116.174 8.048 Y74H-N 122.52 8.224 D75H-N 122.09 8.213 G76H-N 108.479 7.861 M77H-N 119.72 8.203 D78H-N 121.106 8.512 R79H-N 121.446 8.399 S80H-N 115.163 8.052 V81H-N 124.322 8.583 D82H-N 119.5 7.957 V83H-N 119.861 7.883 A84H-N 125.237 7.585 I85H-N 118.268 8.394 R87H-N 123.556 7.831 L88H-N 119.608 8.51 R89H-N 116.265 8.661 K90H-N 117.306 7.471 K91H-N 119.013 8.229 L92H-N 114.0 8.062 L93H-N 110.94 7.288 D94H-N 117.184 8.525 A96H-N 125.976 8.599 T97H-N 110.786 7.982 E98H-N 121.955 7.798 Y100H-N 124.724 11.045 R101H-N 124.541 8.333 K103H-N 126.314 9.331 T104H-N 119.999 9.103 V105H-N 129.347 8.609 R106H-N 128.137 8.853 N107H-N 117.544 8.801 K108H-N 117.519 8.267 G109H-N 105.045 7.676 Y110H-N 121.452 8.618 L111H-N 121.973 8.717 F112H-N 130.537 9.832 A113H-N 136.878 8.34 H115H-N 115.69 8.821 A116H-N 121.591 6.585