Assignment w1 w2 A2H-N 123.42 8.614 N3H-N 118.589 8.591 K4H-N 121.74 8.23 T5H-N 121.024 8.466 V6H-N 129.81 8.76 V7H-N 130.37 9.883 V8H-N 130.543 8.705 T9H-N 124.067 9.0 T10H-N 123.86 7.875 I11H-N 119.484 7.873 L12H-N 124.316 7.869 E13H-N 128.198 7.837 S14H-N 130.967 9.794 Y16H-N 124.298 8.167 V17H-N 117.493 8.042 M18H-N 125.231 9.392 M19H-N 119.438 8.815 K20H-N 125.892 8.595 K21H-N 123.318 8.934 N22H-N 116.263 8.795 H23H-N 114.657 7.705 E24H-N 120.327 8.791 M25H-N 115.925 7.908 L26H-N 121.398 7.498 E27H-N 117.579 8.394 G28H-N 108.955 8.895 N29H-N 124.79 9.583 E30H-N 115.807 7.881 R31H-N 113.997 6.929 Y32H-N 113.543 6.94 E33H-N 115.534 9.248 G34H-N 108.473 8.317 Y35H-N 118.658 7.429 C36H-N 113.952 10.278 V37H-N 123.357 6.697 D38H-N 122.432 8.136 L39H-N 120.129 8.432 A40H-N 120.007 8.023 A41H-N 118.051 7.258 E42H-N 117.565 7.774 I43H-N 120.989 8.653 A44H-N 122.746 8.298 K45H-N 117.404 7.643 H46H-N 116.339 7.636 C47H-N 113.887 8.081 G48H-N 109.114 8.0 F49H-N 113.632 7.104 K50H-N 121.208 8.886 Y51H-N 116.844 8.475 K52H-N 122.164 8.927 L53H-N 125.043 8.84 T54H-N 119.154 8.716 I55H-N 122.418 8.174 V56H-N 130.395 8.826 G57H-N 118.466 9.011 D58H-N 116.575 7.917 G59H-N 105.469 7.43 K60H-N 119.474 7.885 Y61H-N 119.015 8.418 G62H-N 102.638 8.036 A63H-N 133.073 9.073 R64H-N 122.211 7.728 D65H-N 129.791 7.862 A66H-N 128.994 8.739 D67H-N 115.552 8.445 T68H-N 109.723 8.619 K69H-N 114.146 7.852 I70H-N 119.339 7.383 W71H-N 129.237 8.682 W71HE1-NE1 129.765 10.069 N72H-N 120.431 8.237 G73H-N 106.584 10.084 M74H-N 123.597 7.666 V75H-N 114.283 7.51 G76H-N 106.313 7.851 E77H-N 118.577 7.655 L78H-N 116.278 7.303 V79H-N 119.385 8.204 Y80H-N 114.662 8.193 G81H-N 106.459 7.227 K82H-N 118.328 8.629 A83H-N 119.136 7.468 D84H-N 117.588 8.732 I85H-N 114.308 7.626 A86H-N 128.278 9.259 I87H-N 122.886 7.343 A88H-N 130.284 9.151 L90H-N 125.962 7.858 T91H-N 124.316 9.139 I92H-N 127.564 8.16 T93H-N 116.879 6.354 L94H-N 124.135 8.55 V95H-N 116.33 8.031 R96H-N 118.349 7.479 E97H-N 118.863 8.277 E98H-N 115.896 7.236 V99H-N 106.587 7.614 I100H-N 117.706 8.066 D101H-N 115.153 8.326 F102H-N 115.913 9.001 S103H-N 116.295 8.828 K104H-N 119.17 8.508 F106H-N 115.188 8.335 M107H-N 119.953 6.873 S108H-N 119.402 8.165 L109H-N 119.397 8.157 G110H-N 104.654 7.956 I111H-N 123.813 9.305 S112H-N 121.546 8.929 I113H-N 118.114 8.388 M114H-N 130.247 9.408 I115H-N 117.101 8.455 K116H-N 122.545 8.72 K117H-N 130.047 8.692 G118H-N 112.775 8.768 A124H-N 123.21 9.332 E125H-N 117.775 8.631 D126H-N 119.447 7.989 S128H-N 111.431 8.051 K129H-N 120.117 7.078 Q130H-N 116.035 7.742 T131H-N 106.427 8.611 E132H-N 124.801 7.415 I133H-N 121.886 9.777 A134H-N 129.904 7.916 Y135H-N 111.492 6.425 G136H-N 100.434 6.847 T137H-N 105.264 6.488 L138H-N 124.061 8.983 D139H-N 127.259 9.413 S140H-N 111.598 7.884 G141H-N 104.426 7.085 S142H-N 116.276 9.437 T143H-N 128.486 9.153 K144H-N 124.327 9.726 E145H-N 114.05 7.123 F146H-N 119.986 7.995 F147H-N 116.243 7.379 R148H-N 118.82 7.502 R149H-N 111.609 7.074 S150H-N 114.426 6.921 K151H-N 124.92 8.832 I152H-N 124.627 8.113 A153H-N 131.833 8.704 V154H-N 116.454 8.104 F155H-N 119.804 6.297 D156H-N 122.092 8.836 K157H-N 122.42 8.473 M158H-N 118.955 8.132 W159H-N 121.959 9.308 W159HE1-NE1 127.983 10.245 T160H-N 113.828 8.692 Y161H-N 121.271 7.698 M162H-N 119.924 8.592 R163H-N 113.867 8.323 S164H-N 111.375 6.728 A165H-N 126.399 6.83 E166H-N 121.814 8.124 S168H-N 111.808 8.498 F170H-N 121.851 7.943 V171H-N 111.948 7.959 R172H-N 119.803 8.873 T173H-N 106.391 7.272 A174H-N 126.591 9.477 A175H-N 119.241 9.066 E176H-N 119.646 7.893 G177H-N 109.515 7.699 V178H-N 121.335 8.172 A179H-N 120.653 8.06 R180H-N 119.493 7.911 V181H-N 122.327 8.167 R182H-N 117.53 8.044 K183H-N 118.295 8.64 S184H-N 112.203 7.539 K185H-N 119.132 8.62 G186H-N 104.261 8.153 K187H-N 115.245 7.367 Y188H-N 121.571 7.675 A189H-N 133.107 8.721 Y190H-N 119.721 8.286 L191H-N 128.994 8.257 L192H-N 123.71 8.52 E193H-N 124.385 10.122 S194H-N 119.613 9.735 T195H-N 111.147 7.321 M196H-N 122.047 7.371 N197H-N 118.789 8.076 E198H-N 115.656 8.921 Y199H-N 117.868 7.334 I200H-N 118.453 7.966 E201H-N 119.144 8.219 Q202H-N 111.814 6.927 R203H-N 119.889 7.528 K204H-N 122.765 9.134 D207H-N 116.614 8.726 T208H-N 110.871 7.842 M209H-N 115.687 8.951 K210H-N 123.775 8.163 V211H-N 121.879 7.951 G212H-N 112.891 8.62 G213H-N 106.834 8.127 N214H-N 119.976 8.578 L215H-N 121.282 9.342 D216H-N 116.202 7.426 S217H-N 110.834 7.758 K218H-N 125.459 9.021 G219H-N 105.865 7.711 Y220H-N 116.788 7.119 G221H-N 104.074 8.05 I222H-N 120.257 8.808 A223H-N 130.719 7.99 T224H-N 110.997 8.722 K226H-N 123.997 9.392 G227H-N 111.328 9.311 S228H-N 111.962 7.241 S229H-N 126.622 9.395 L230H-N 120.443 8.67 R231H-N 119.301 6.855 T232H-N 116.135 9.142 V234H-N 116.038 8.194 N235H-N 120.048 7.803 L236H-N 116.723 8.231 A237H-N 121.469 8.077 V238H-N 118.635 8.273 L239H-N 119.592 8.032 K240H-N 120.649 8.065 L241H-N 118.446 8.603 S242H-N 113.949 8.446 E243H-N 122.867 8.385 Q244H-N 114.463 8.269 G245H-N 106.916 7.817 V246H-N 121.046 8.042 L247H-N 115.86 7.187 D248H-N 120.49 7.754 K249H-N 120.643 7.758 L250H-N 119.761 8.665 K251H-N 121.64 8.32 N252H-N 117.669 8.293 K253H-N 119.0 8.122 W254H-N 115.347 7.737 W254HE1-NE1 130.085 10.885 W255H-N 120.29 9.037 W255HE1-NE1 127.197 10.289 Y256H-N 118.62 7.282 D257H-N 123.394 8.551 K258H-N 120.222 8.055 G259H-N 108.706 8.293 E260H-N 119.389 8.486 C261H-N 116.793 8.413 G262H-N 110.821 8.278 A263H-N 129.312 7.942