Assignment w1 w2 I2H-N 123.415 7.988 E3H-N 126.626 8.64 E4H-N 124.204 8.633 G5H-N 111.365 8.983 K6H-N 118.91 7.582 L7H-N 116.121 8.237 V8H-N 125.47 10.153 I9H-N 128.221 9.117 W10H-N 126.71 9.032 W10HE1-NE1 129.337 10.61 I11H-N 122.081 8.7 N12H-N 122.99 8.922 G13H-N 106.791 8.287 D14H-N 117.008 7.99 K15H-N 118.724 7.576 G16H-N 108.204 8.739 Y17H-N 120.664 8.287 N18H-N 123.757 8.109 G19H-N 111.78 9.023 L20H-N 121.835 8.336 A21H-N 121.302 8.143 E22H-N 120.559 7.825 V23H-N 123.306 7.842 G24H-N 106.853 8.723 K25H-N 122.996 8.342 K26H-N 123.048 7.69 F27H-N 120.127 8.129 E28H-N 124.241 8.864 K29H-N 122.179 8.152 D30H-N 116.49 7.615 T31H-N 107.255 7.93 G32H-N 112.891 8.6 I33H-N 124.535 7.752 K34H-N 125.011 7.92 V35H-N 124.422 8.348 T36H-N 125.315 9.176 V37H-N 127.53 8.92 E38H-N 127.167 9.643 H39H-N 115.302 8.297 D41H-N 121.163 8.215 K42H-N 119.241 8.774 L43H-N 120.02 7.385 E44H-N 123.847 10.448 E45H-N 120.295 7.326 K46H-N 120.581 8.285 F47H-N 116.931 8.657 Q49H-N 115.257 6.833 V50H-N 111.081 7.73 A51H-N 125.689 8.347 A52H-N 118.252 7.395 T53H-N 106.054 7.229 G54H-N 109.258 7.751 D55H-N 119.703 7.395 G56H-N 105.503 8.332 D58H-N 117.791 8.698 I59H-N 114.107 7.631 I60H-N 124.531 8.897 F61H-N 126.191 8.602 W62H-N 121.352 9.18 W62HE1-NE1 129.552 10.321 A63H-N 125.965 6.297 H64H-N 115.783 7.999 H64HE2-ND1 133.6 13.18 D65H-N 119.219 7.721 R66H-N 116.099 6.911 F67H-N 116.978 7.687 G68H-N 107.291 7.273 G69H-N 107.542 7.65 Y70H-N 119.254 6.974 A71H-N 122.642 8.625 Q72H-N 122.857 8.71 S73H-N 112.177 7.362 G74H-N 109.4 8.083 L75H-N 113.934 7.814 L76H-N 115.904 7.432 A77H-N 125.955 9.006 E78H-N 120.937 8.229 I79H-N 122.869 8.176 T80H-N 112.789 8.786 D82H-N 123.842 9.117 A84H-N 119.536 8.192 F85H-N 118.632 7.959 Q86H-N 117.282 8.512 D87H-N 116.918 8.052 K88H-N 117.287 7.815 L89H-N 120.004 7.661 Y90H-N 116.751 7.62 F92H-N 112.62 8.01 T93H-N 111.501 7.1 W94H-N 120.085 6.595 W94HE1-NE1 129.101 10.57 D95H-N 115.56 7.311 A96H-N 118.728 6.989 V97H-N 106.208 7.002 R98H-N 121.682 7.048 Y99H-N 127.48 9.706 G101H-N 102.271 8.648 K102H-N 121.247 7.76 L103H-N 123.231 8.966 I104H-N 112.821 8.774 A105H-N 117.404 7.668 Y106H-N 113.914 8.976 I108H-N 115.372 8.516 A109H-N 118.152 7.855 V110H-N 121.414 8.781 E111H-N 123.136 9.596 A112H-N 117.074 6.355 L113H-N 123.255 8.456 S114H-N 108.167 7.494 L115H-N 122.337 7.308 I116H-N 129.613 8.666 Y117H-N 121.829 9.061 N118H-N 121.191 9.303 K119H-N 125.523 8.805 D120H-N 115.406 8.153 L121H-N 117.839 7.121 L122H-N 119.986 8.337 K127H-N 118.456 8.137 T128H-N 108.742 7.87 W129H-N 123.949 10.181 W129HE1-NE1 126.198 9.198 E130H-N 118.044 10.581 E131H-N 116.717 7.606 I132H-N 121.57 8.202 A134H-N 118.138 7.847 L135H-N 120.079 7.598 D136H-N 118.575 8.838 K137H-N 117.346 8.043 E138H-N 118.649 7.482 L139H-N 121.275 8.415 K140H-N 124.2 9.261 A141H-N 122.088 7.262 K142H-N 115.807 7.643 G143H-N 107.843 7.876 K144H-N 119.918 7.859 S145H-N 109.466 7.568 A146H-N 122.802 9.566 L147H-N 116.872 8.697 M148H-N 121.716 8.178 F149H-N 120.235 8.611 N150H-N 116.069 8.671 L151H-N 122.969 7.287 Q152H-N 113.114 7.94 E153H-N 113.572 6.404 Y155H-N 117.652 7.823 F156H-N 112.213 8.045 T157H-N 106.11 7.59 W158H-N 124.174 8.368 W158HE1-NE1 130.629 9.461 L160H-N 111.643 6.439 I161H-N 119.71 6.956 A162H-N 115.255 8.001 A163H-N 120.835 6.669 D164H-N 114.996 9.57 G165H-N 103.621 7.468 G166H-N 108.121 7.382 Y167H-N 115.906 8.328 A168H-N 124.003 10.208 F169H-N 108.343 6.324 K170H-N 125.705 8.863 Y171H-N 129.711 8.599 E172H-N 126.805 8.241 G174H-N 102.08 7.52 K175H-N 118.703 7.107 Y176H-N 120.13 8.731 D177H-N 124.057 9.043 I178H-N 117.048 7.73 K179H-N 116.085 8.3 D180H-N 123.266 7.755 V181H-N 122.888 7.492 G182H-N 120.861 7.065 V183H-N 114.254 6.758 D184H-N 114.847 7.835 N185H-N 116.303 6.891 G187H-N 109.507 8.385 A188H-N 127.735 8.074 K189H-N 115.246 7.977 A190H-N 124.675 8.224 G191H-N 107.567 8.207 L192H-N 121.237 8.647 T193H-N 116.495 8.544 F194H-N 122.073 7.651 L195H-N 119.614 7.712 V196H-N 117.533 8.589 D197H-N 122.944 8.581 L198H-N 120.212 7.875 I199H-N 119.976 7.434 K200H-N 124.564 9.392 N201H-N 113.965 8.003 K202H-N 111.501 7.933 H203H-N 116.245 8.353 M204H-N 114.045 7.476 N205H-N 118.497 8.71 A206H-N 125.067 9.082 D207H-N 112.749 8.171 T208H-N 116.633 7.342 D209H-N 130.962 6.979 Y210H-N 117.493 7.858 S211H-N 114.684 8.201 I212H-N 124.464 8.959 A213H-N 120.745 7.62 E214H-N 117.544 7.872 A215H-N 119.687 7.951 A216H-N 117.585 7.796 F217H-N 119.437 8.339 K219H-N 116.748 7.713 G220H-N 108.762 7.718 E221H-N 116.381 8.382 T222H-N 110.52 6.856 A223H-N 127.377 8.684 M224H-N 114.198 8.075 T225H-N 113.328 9.152 I226H-N 122.719 7.139 N227H-N 121.902 8.472 G228H-N 110.667 8.192 A231H-N 125.512 6.971 W232H-N 118.541 7.197 W232HE1-NE1 128.275 10.508 Y242H-N 121.813 7.872 G243H-N 107.512 8.493 V244H-N 120.877 8.228 T245H-N 119.803 9.515 V246H-N 123.611 8.158 L247H-N 125.537 8.649 T249H-N 111.705 8.815 F250H-N 121.915 9.579 K251H-N 129.702 10.57 G252H-N 103.626 9.03 Q253H-N 122.357 8.244 S255H-N 117.976 8.002 K256H-N 123.449 7.639 F258H-N 118.347 9.265 V259H-N 121.972 8.776 G260H-N 116.162 8.961 V261H-N 128.975 11.174 L262H-N 134.069 8.835 S263H-N 126.737 8.769 A264H-N 123.799 9.143 G265H-N 110.747 9.417 I266H-N 123.632 10.297 N267H-N 125.881 8.25 A268H-N 131.136 8.845 A269H-N 117.81 8.158 S270H-N 112.93 7.619 N272H-N 119.718 8.881 K273H-N 119.362 7.806 E274H-N 118.293 8.836 L275H-N 120.65 7.385 A276H-N 120.289 8.405 K277H-N 118.272 7.851 E278H-N 118.645 7.592 F279H-N 118.379 8.368 L280H-N 120.026 8.444 E281H-N 112.879 8.415 N282H-N 108.801 7.684 Y283H-N 116.367 7.164 L284H-N 121.495 8.101 L285H-N 119.213 7.831 T286H-N 108.729 8.542 D287H-N 122.214 8.528 E288H-N 115.695 8.443 G289H-N 112.93 8.327 L290H-N 119.524 8.208 E291H-N 120.812 7.744 A292H-N 119.831 7.193 V293H-N 115.882 7.243 N294H-N 117.481 8.758 K295H-N 115.909 8.338 D296H-N 118.993 7.251 K297H-N 115.617 7.653 L299H-N 121.742 8.53 G300H-N 103.347 8.134 A301H-N 123.838 7.522 V302H-N 110.167 8.045 A303H-N 117.959 7.689 L304H-N 114.829 6.348 K305H-N 129.635 8.043 S306H-N 111.863 8.684 Y307H-N 122.102 6.641 E308H-N 122.65 8.473 E309H-N 114.966 7.813 E310H-N 116.959 7.088 L311H-N 120.859 8.02 A312H-N 114.676 8.191 K313H-N 119.326 6.993 D314H-N 121.733 8.311 R316H-N 116.914 8.502 I317H-N 123.536 7.702 A318H-N 123.331 7.906 A319H-N 118.981 8.086 T320H-N 114.576 7.357 M321H-N 118.79 8.186 E322H-N 122.177 8.267 N323H-N 115.26 8.207 A324H-N 119.875 8.199 Q325H-N 116.348 8.25 K326H-N 117.706 7.079 G327H-N 106.643 7.292 E328H-N 121.098 8.442 I329H-N 127.521 9.146 M330H-N 124.382 8.501 N332H-N 117.308 7.579 I333H-N 108.582 6.383 Q335H-N 116.301 8.368 M336H-N 118.456 7.898 S337H-N 113.543 7.922 A338H-N 122.864 7.349 F339H-N 118.848 7.541 W340H-N 118.274 8.855 W340HE1-NE1 130.128 10.424 Y341H-N 114.829 7.514 A342H-N 121.918 8.402 V343H-N 118.565 8.63 R344H-N 120.767 8.191 T345H-N 113.734 7.565 A346H-N 122.931 7.804 V347H-N 115.982 8.157 I348H-N 118.391 7.771 N349H-N 121.104 8.83 A350H-N 122.788 8.519 A351H-N 121.117 9.165 S352H-N 108.006 7.879 G353H-N 109.918 7.614 R354H-N 121.091 8.227 Q355H-N 113.628 7.33 T356H-N 111.81 8.567 V357H-N 121.378 8.731 D358H-N 115.258 8.121 E359H-N 118.661 7.605 A360H-N 121.539 8.697 L361H-N 116.237 8.077 K362H-N 121.554 7.701 D363H-N 120.036 8.148 A364H-N 121.437 7.736 Q365H-N 118.228 8.24 T366H-N 115.346 8.154 R367H-N 120.129 7.974 I368H-N 117.405 8.005 T369H-N 107.054 7.633 K370H-N 128.247 7.4