Assignment w1 w2 M4H-N 121.802 8.377 S5H-N 117.042 8.354 H6H-N 120.939 8.479 D7H-N 121.055 8.285 A8H-N 124.042 8.151 V9H-N 119.664 8.142 R10H-N 125.495 8.297 A12H-N 128.054 8.449 G14H-N 116.224 9.601 E15H-N 123.523 8.228 T17H-N 119.156 8.929 W18H-N 121.501 7.848 W18HE1-NE1 130.322 9.741 V19H-N 116.677 8.443 L22H-N 125.348 7.447 T23H-N 117.617 8.496 D25H-N 118.504 7.967 R26H-N 127.949 9.06 R26HE-NE 81.684 7.442 G27H-N 106.398 8.861 A28H-N 124.026 7.798 A29H-N 122.818 7.909 L30H-N 117.931 8.732 Q31H-N 116.54 7.491 Q31HE21-NE2 111.988 6.878 Q31HE22-NE2 111.988 7.51 F32H-N 121.08 7.753 Y33H-N 115.537 8.659 S34H-N 113.044 8.333 A35H-N 124.317 7.44 L36H-N 116.809 7.433 F37H-N 111.786 7.546 G38H-N 107.445 7.987 W39H-N 116.929 6.361 W39HE1-NE1 129.327 10.473 E40H-N 120.581 9.472 F41H-N 118.759 8.218 S42H-N 116.366 9.047 T43H-N 118.142 8.744 T44H-N 117.195 8.388 S45H-N 117.844 8.509 D46H-N 121.995 8.31 G47H-N 109.282 8.377 T48H-N 112.898 8.29 S49H-N 118.015 8.23 Y51H-N 115.379 7.651 T52H-N 119.65 9.478 M53H-N 127.214 9.043 C54H-N 123.924 8.763 R55H-N 123.351 9.464 R55HE-NE 84.497 7.566 L56H-N 120.564 8.819 R57H-N 126.961 9.802 G58H-N 103.29 8.892 R59H-N 120.006 7.79 R59HE-NE 85.005 7.307 E60H-N 121.994 9.005 V61H-N 123.148 9.022 C62H-N 108.935 7.067 S63H-N 109.875 6.932 I64H-N 119.868 8.679 G65H-N 115.153 9.504 D66H-N 117.987 8.204 L67H-N 124.388 7.652 G68H-N 109.275 8.513 E69H-N 118.926 8.267 N70H-N 118.361 8.444 N70HD21-ND2 114.001 7.617 N70HD22-ND2 114.001 6.924 G72H-N 109.788 8.311 A74H-N 121.775 8.125 L75H-N 118.701 7.667 G76H-N 107.704 8.404 G77H-N 108.756 8.481 W78H-N 122.197 9.414 W78HE1-NE1 127.803 9.853 S79H-N 125.248 10.303 S80H-N 118.894 8.099 Y81H-N 119.645 8.46 L82H-N 125.236 8.896 S83H-N 116.74 8.443 V84H-N 116.318 8.271 D85H-N 121.312 8.875 D86H-N 116.213 7.288 A87H-N 129.289 9.472 D88H-N 118.838 8.256 A89H-N 125.167 8.253 A90H-N 121.434 7.94 A91H-N 118.511 8.237 A92H-N 117.432 7.374 A93H-N 120.222 7.494 V94H-N 115.394 7.788 E96H-N 118.803 6.96 L97H-N 117.747 7.577 G98H-N 105.108 7.616 G99H-N 108.038 8.007 A100H-N 120.583 8.525 V101H-N 123.043 9.186 L102H-N 128.71 9.022 L103H-N 118.857 7.641 G104H-N 112.002 8.843 I106H-N 120.903 9.351 D107H-N 124.072 8.551 I108H-N 124.131 8.511 L109H-N 126.687 8.632 Q111H-N 116.726 8.503 Q111HE21-NE2 110.167 6.364 Q111HE22-NE2 110.167 7.12 G112H-N 106.359 7.693 R113H-N 122.158 8.216 R113HE-NE 83.262 7.507 M114H-N 122.909 9.017 L115H-N 119.336 9.063 L116H-N 120.7 8.814 A117H-N 127.31 9.579 G118H-N 107.111 9.438 D119H-N 122.511 8.058 S121H-N 111.956 7.48 G122H-N 109.107 8.261 H123H-N 120.927 8.164 R124H-N 123.574 8.571 R124HE-NE 84.04 7.174 V125H-N 127.014 9.851 G126H-N 114.519 8.269 L127H-N 124.56 9.379 W128H-N 124.436 9.041 W128HE1-NE1 128.253 9.963 Q129H-N 131.383 9.171 Q129HE21-NE2 112.421 7.155 Q129HE22-NE2 112.421 7.615 A130H-N 130.163 8.761 K131H-N 122.377 8.066 E132H-N 119.685 8.187 H133H-N 120.224 8.645 T134H-N 116.228 8.297 S136H-N 116.477 8.599 G137H-N 111.673 8.713 D139H-N 120.811 8.487 D140H-N 123.149 8.101 G141H-N 107.309 8.039 I142H-N 118.362 8.368 G143H-N 116.829 9.622 A144H-N 118.932 7.468 Y145H-N 119.756 8.394 T146H-N 126.333 8.372 R147H-N 109.298 6.705 S148H-N 110.2 6.384 E149H-N 119.137 8.599 L150H-N 125.099 8.014 L151H-N 130.193 8.3 T152H-N 116.84 8.578 G153H-N 115.202 8.666 A154H-N 130.159 9.143 S155H-N 115.992 8.411 A156H-N 126.187 8.637 T157H-N 115.083 7.879 D158H-N 124.324 8.934 G159H-N 106.849 8.466 A160H-N 121.604 7.512 F161H-N 120.296 7.412 Y162H-N 116.081 7.827 R163H-N 118.577 8.846 R163HE-NE 86.322 7.207 G164H-N 109.876 7.806 L165H-N 120.225 6.853 F166H-N 113.958 8.055 G167H-N 110.611 8.004 A168H-N 119.928 8.328 D169H-N 112.907 8.37 F170H-N 123.951 7.947 A171H-N 126.104 8.716 T172H-N 109.751 7.61 E173H-N 122.828 8.752 S174H-N 116.467 8.327 G175H-N 110.905 8.465 T176H-N 112.752 8.098 D177H-N 122.46 8.368 G178H-N 109.385 8.403 G179H-N 108.906 8.387 G180H-N 108.865 8.23 R181H-N 120.473 8.278 R182H-N 119.764 7.777 R182HE-NE 85.198 7.222 A183H-N 122.495 8.594 A184H-N 117.658 6.877 I185H-N 119.761 8.585 R186H-N 126.563 9.503 R186HE-NE 88.699 8.348 Q187H-N 124.139 8.352 Q187HE21-NE2 113.726 7.425 Q187HE22-NE2 113.726 6.926 V188H-N 121.492 8.151 G189H-N 106.76 8.282 A191H-N 120.398 8.397 A192H-N 122.316 7.197 S194H-N 111.037 8.075 G195H-N 112.622 9.146 W196H-N 118.503 8.917 W196HE1-NE1 128.931 10.359 Y197H-N 123.748 9.462 C199H-N 116.798 8.467 F200H-N 123.824 8.961 R201H-N 124.161 8.216 A202H-N 127.36 8.945 Q203H-N 116.756 8.487 Q203HE21-NE2 113.113 7.851 Q203HE22-NE2 113.113 6.894 E204H-N 121.608 9.304 S205H-N 112.13 8.076 A206H-N 125.929 8.481 V207H-N 114.558 7.628 A209H-N 119.854 7.06 A210H-N 120.733 8.442 V211H-N 120.04 8.156 M212H-N 122.436 8.321 L213H-N 118.279 7.473 G214H-N 105.322 7.925 A215H-N 124.091 8.52 S216H-N 111.747 8.5 V217H-N 123.927 8.803 L218H-N 127.568 9.421 L219H-N 118.029 7.491 R220H-N 124.849 8.388 R220HE-NE 85.49 7.287 Y221H-N 121.661 9.002 D222H-N 118.706 8.566 C223H-N 120.231 8.095 D225H-N 109.313 8.7 G226H-N 109.188 7.316 A228H-N 124.141 8.816 V229H-N 121.399 9.008 V230H-N 129.491 9.332 V231H-N 126.162 9.409 S232H-N 115.301 8.925 A233H-N 128.124 9.268 G235H-N 103.88 8.404 G236H-N 108.776 7.975 E237H-N 123.732 9.758 V238H-N 121.937 8.391 F239H-N 121.706 8.957 T240H-N 116.945 9.048 L241H-N 126.782 9.426 L242H-N 125.469 8.632 L243H-N 125.682 8.666 T244H-N 115.203 8.376 D245H-N 128.186 8.129