Assignment w1 w2 V2H-N 120.551 8.478 V3H-N 127.812 8.949 T4H-N 120.998 8.286 Y5H-N 123.527 9.066 D6H-N 124.39 8.533 M7H-N 118.499 8.823 E8H-N 122.785 8.659 S11H-N 112.896 8.659 K12H-N 126.17 8.826 V13H-N 122.429 8.312 V16H-N 116.516 8.145 K17H-N 119.876 6.888 L18H-N 120.034 8.286 Y19H-N 118.209 8.665 K20H-N 120.859 8.086 A21H-N 119.108 8.058 F22H-N 109.306 8.314 I23H-N 113.552 7.662 L24H-N 119.818 7.255 D25H-N 117.199 8.903 G26H-N 107.956 6.343 D27H-N 118.657 8.297 T28H-N 107.346 7.222 L29H-N 123.576 8.568 V30H-N 116.594 8.163 K32H-N 113.23 6.573 V33H-N 113.305 7.71 L34H-N 122.327 8.35 H36H-N 114.095 7.91 A37H-N 122.077 7.416 I38H-N 119.645 7.523 K39H-N 124.331 8.338 C40H-N 112.143 7.576 V41H-N 123.406 8.446 K42H-N 126.98 8.809 I43H-N 125.68 8.91 L44H-N 129.27 9.008 E45H-N 116.412 7.547 G46H-N 110.046 8.477 D47H-N 115.325 7.681 G48H-N 110.279 8.786 C49H-N 116.308 7.97 A50H-N 123.953 8.709 G51H-N 111.89 9.294 T52H-N 119.08 7.829 I53H-N 125.942 8.466 K54H-N 125.13 9.41 E55H-N 123.006 9.423 V56H-N 132.152 9.259 T57H-N 122.496 8.51 F58H-N 126.149 8.659 G59H-N 104.458 7.547 E60H-N 119.761 8.589 G61H-N 110.061 8.851 H64H-N 117.429 7.72 C66H-N 118.089 8.609 V67H-N 117.779 8.652 K68H-N 120.738 8.564 Q69H-N 120.847 9.307 Q69HE21-NE2 106.871 6.362 Q69HE22-NE2 106.871 5.825 R70H-N 123.354 9.501 R70HE-NE 84.806 7.356 V71H-N 126.523 9.139 D72H-N 131.035 9.07 A73H-N 119.948 7.842 I74H-N 118.494 8.446 D75H-N 126.342 7.67 K76H-N 124.289 8.879 D77H-N 117.597 8.106 N78H-N 115.549 7.469 N78HD21-ND2 116.594 6.906 N78HD22-ND2 116.594 8.401 L79H-N 115.914 7.276 T80H-N 104.922 8.036 Y81H-N 127.785 9.023 S82H-N 122.321 8.785 Y83H-N 121.308 8.54 T84H-N 116.552 9.164 I85H-N 127.081 9.648 I86H-N 118.99 8.031 E87H-N 121.238 7.727 G88H-N 110.476 8.85 D89H-N 120.238 8.856 V90H-N 114.925 7.259 L91H-N 117.392 7.397 A92H-N 118.783 7.456 E93H-N 119.334 8.64 K94H-N 117.416 7.764 F95H-N 115.638 7.847 E96H-N 122.613 9.089 S97H-N 106.176 7.502 I98H-N 118.157 6.993 S99H-N 123.031 8.731 Y100H-N 120.248 8.759 H101H-N 120.845 8.99 I102H-N 127.174 9.655 K103H-N 128.332 8.905 I104H-N 126.316 8.399 V105H-N 121.808 8.787 A106H-N 124.387 8.541 C107H-N 121.274 7.844 G110H-N 108.619 7.733 G111H-N 109.987 8.15 S112H-N 116.399 8.955 I113H-N 120.211 8.902 C114H-N 126.031 8.773 K115H-N 130.71 9.47 N116H-N 123.065 8.646 N116HD21-ND2 106.395 6.651 N116HD22-ND2 106.395 5.935 R117H-N 129.725 9.038 R117HE-NE 85.958 9.026 S118H-N 121.722 9.063 I119H-N 122.992 8.955 Y120H-N 130.587 9.732 T121H-N 120.038 8.069 T122H-N 119.779 9.235 K123H-N 121.419 8.336 G124H-N 111.228 8.569 D125H-N 124.907 8.678 C126H-N 118.989 8.015 K127H-N 121.727 8.436 V128H-N 121.994 8.307 S129H-N 124.841 9.119 E130H-N 122.445 8.894 E131H-N 118.885 8.598 E132H-N 120.119 7.709 I133H-N 121.396 7.383 K134H-N 121.391 8.05 L135H-N 119.516 8.046 G136H-N 105.748 7.794 K137H-N 123.505 7.888 E138H-N 119.718 8.236 K139H-N 119.322 8.388 A140H-N 121.105 7.485 A141H-N 119.672 8.241 E142H-N 118.932 8.006 I143H-N 119.954 7.482 F144H-N 118.48 7.902 K145H-N 119.641 8.498 A146H-N 122.237 7.692 L147H-N 119.894 8.472 E148H-N 119.701 8.567 A149H-N 119.212 7.671 Y150H-N 119.671 7.776 L151H-N 120.182 8.566 L152H-N 119.314 8.065 A153H-N 118.801 7.153 N154H-N 116.019 7.18 N154HD21-ND2 117.543 6.712 N154HD22-ND2 117.543 6.663 D156H-N 116.875 8.451 Y157H-N 122.325 7.702 C158H-N 125.56 7.226