Assignment w1 w2 A2H-N 123.051 7.299 W3H-N 119.501 8.571 W3HE1-NE1 124.705 8.728 E4H-N 127.116 8.533 R5H-N 116.844 8.081 H6H-N 124.842 8.909 L7H-N 121.198 7.998 Q8H-N 118.797 7.949 D9H-N 122.142 8.433 V10H-N 120.775 8.689 T11H-N 123.707 8.366 L12H-N 127.151 8.657 K13H-N 118.915 8.161 E14H-N 119.236 8.005 G15H-N 113.351 9.568 Q16H-N 119.529 7.653 Q16HE21-NE2 112.909 7.733 Q16HE22-NE2 112.909 6.891 T17H-N 115.766 8.561 C18H-N 128.692 9.104 T19H-N 125.1 8.589 M20H-N 126.969 9.341 T21H-N 112.006 8.017 C22H-N 118.277 9.321 Q23H-N 119.724 9.188 Q23HE21-NE2 114.766 8.259 Q23HE22-NE2 114.766 6.991 F24H-N 134.043 10.005 S25H-N 114.783 7.451 V26H-N 122.095 6.55 N28H-N 112.675 8.414 N28HD21-ND2 114.737 7.149 N28HD22-ND2 114.737 7.744 V29H-N 110.738 7.471 K30H-N 120.483 8.434 S31H-N 118.56 8.165 E32H-N 119.355 8.701 W33H-N 122.436 8.846 W33HE1-NE1 130.611 10.595 F34H-N 117.513 9.496 R35H-N 119.286 8.88 N36H-N 129.086 9.99 N36HD21-ND2 112.534 7.119 N36HD22-ND2 112.534 7.653 G37H-N 101.974 8.621 R38H-N 121.514 8.025 V39H-N 125.999 8.744 L40H-N 130.243 8.739 K41H-N 125.83 8.42 R45H-N 122.085 8.021 V46H-N 120.873 7.758 K47H-N 126.937 8.943 T48H-N 112.552 7.929 E49H-N 119.79 8.922 V50H-N 124.977 8.721 E51H-N 130.177 9.37 H52H-N 126.744 9.273 K53H-N 127.529 9.038 V54H-N 122.288 8.419 H55H-N 130.926 9.489 K56H-N 122.79 8.773 L57H-N 130.577 8.674 T58H-N 122.012 8.783 I59H-N 124.565 8.96 A60H-N 129.185 8.55 D61H-N 118.659 7.896 V62H-N 112.544 8.309 R63H-N 122.795 9.288 A64H-N 124.571 9.259 E65H-N 114.442 8.933 D66H-N 117.609 8.346 Q67H-N 120.078 7.697 Q67HE21-NE2 111.317 7.586 Q67HE22-NE2 111.317 6.988 G68H-N 110.378 8.61 Q69H-N 120.267 8.315 Q69HE21-NE2 111.68 7.484 Q69HE22-NE2 111.68 6.771 Y70H-N 131.099 9.855 T71H-N 116.864 8.935 C72H-N 127.286 8.611 K73H-N 128.687 9.134 H74H-N 124.307 8.609 E75H-N 124.527 8.717 D76H-N 119.775 8.571 L77H-N 122.624 8.582 E78H-N 125.481 9.14 T79H-N 118.997 8.137 S80H-N 121.251 8.149 A81H-N 123.962 9.258 E82H-N 119.507 9.038 L83H-N 126.368 9.113 R84H-N 128.41 9.114 I85H-N 121.883 8.497 E86H-N 127.917 8.775 A87H-N 129.048 8.558 I90H-N 120.391 8.39 Q91H-N 121.044 7.722 Q91HE21-NE2 111.937 6.883 Q91HE22-NE2 111.937 7.531 F92H-N 118.115 8.976 T93H-N 119.846 8.421 K94H-N 121.782 7.921 R95H-N 126.013 8.738 I96H-N 112.879 7.237 Q97H-N 120.782 8.537 Q97HE21-NE2 113.114 7.46 Q97HE22-NE2 113.114 6.927 N98H-N 117.442 8.474 I99H-N 120.224 8.609 V100H-N 126.429 8.207 V101H-N 123.22 8.425 S102H-N 120.303 8.417 E103H-N 121.985 8.308 H104H-N 115.334 9.524 Q105H-N 119.597 7.842 Q105HE21-NE2 113.084 7.554 Q105HE22-NE2 113.084 6.944 S106H-N 113.798 8.203 A107H-N 125.493 8.711 T108H-N 117.797 8.294 F109H-N 126.383 9.116 E110H-N 118.952 8.512 C111H-N 116.435 8.935 E112H-N 122.153 9.274 V113H-N 119.67 8.64 S114H-N 111.697 8.331 F115H-N 115.315 6.625 D116H-N 120.201 8.722 D117H-N 112.898 8.633 A118H-N 119.18 7.535 I119H-N 122.6 8.858 V120H-N 129.468 8.659 T121H-N 122.479 8.714 W122H-N 125.752 8.897 W122HE1-NE1 131.135 10.585 Y123H-N 117.811 9.432 K124H-N 121.073 8.512 G125H-N 120.246 8.47 T127H-N 120.265 7.974 E128H-N 130.094 8.774 L129H-N 129.014 8.659 T130H-N 112.054 7.772 E131H-N 123.706 8.492 S132H-N 123.563 9.714 Q133H-N 116.338 8.583 Q133HE21-NE2 112.585 7.568 Q133HE22-NE2 112.585 6.859 K134H-N 119.304 7.966 Y135H-N 113.72 6.697 N136H-N 119.561 8.751 N136HD21-ND2 113.761 7.728 N136HD22-ND2 113.761 7.007 F137H-N 125.438 9.944 R138H-N 120.271 8.507 D140H-N 123.975 8.827 G141H-N 116.072 9.038 R142H-N 127.4 9.097 C143H-N 118.942 8.089 H144H-N 122.502 8.613 Y145H-N 119.402 9.203 M146H-N 123.166 8.277 T147H-N 124.704 8.921 I148H-N 126.661 9.134 H149H-N 124.674 8.591 N150H-N 118.141 8.726 N150HD21-ND2 112.755 7.594 N150HD22-ND2 112.755 7.018 V151H-N 118.183 8.143 T152H-N 121.025 9.33 D154H-N 114.883 7.781 D155H-N 115.197 8.401 E156H-N 120.86 7.536 G157H-N 109.363 8.706 V158H-N 119.775 8.017 Y159H-N 128.078 9.483 S160H-N 112.525 9.149 V161H-N 120.681 8.666 I162H-N 125.731 8.844 A163H-N 128.382 8.995 R164H-N 120.534 8.885 R164HE-NE 85.528 7.267 L165H-N 122.879 7.798 E166H-N 128.868 9.094 R168H-N 122.673 9.275 G169H-N 108.41 8.191 E170H-N 119.399 8.112 A171H-N 125.041 8.806 R172H-N 120.814 8.791 S173H-N 119.705 8.636 T174H-N 117.117 8.061 A175H-N 125.382 9.187 E176H-N 117.064 8.673 L177H-N 124.714 9.091 K178H-N 127.79 9.053 G179H-N 109.39 8.626 E180H-N 121.814 8.045 L181H-N 124.623 8.511 R182H-N 123.279 8.516 S183H-N 117.446 8.406 G184H-N 111.586 8.539 C185H-N 122.951 7.909