Assignment w1 w2 L3H-N 124.428 8.019 E4H-N 122.557 8.188 L5H-N 123.052 8.23 V6H-N 121.389 8.675 E7H-N 126.572 8.813 V8H-N 128.892 8.719 C10H-N 117.279 7.909 N11H-N 115.501 8.644 N11HD21-ND2 112.65 6.625 N11HD22-ND2 112.65 6.625 S12H-N 110.92 7.497 V13H-N 119.681 8.996 V15H-N 125.456 8.829 Q16H-N 125.016 8.4 G17H-N 112.678 8.717 V18H-N 120.705 8.462 M19H-N 125.351 7.63 T20H-N 115.892 7.658 N22H-N 113.766 8.61 N22HD21-ND2 112.581 6.923 N22HD22-ND2 112.581 6.923 Q23H-N 116.58 7.538 M24H-N 117.807 8.939 V25H-N 116.295 8.09 K26H-N 126.778 8.78 V27H-N 126.465 9.34 T28H-N 118.768 9.413 G29H-N 103.721 7.274 A30H-N 122.308 9.017 G31H-N 106.348 7.353 W32H-N 120.519 9.635 W32HE1-NE1 129.1 9.53 D33H-N 118.15 8.515 N34H-N 113.186 7.722 G35H-N 106.757 8.153 V36H-N 121.65 8.238 L37H-N 128.459 7.974 E38H-N 127.069 8.299 F39H-N 129.999 9.188 Y40H-N 123.556 7.849 V41H-N 116.582 8.179 T42H-N 118.511 9.064 R43H-N 116.961 8.594 T45H-N 116.277 8.236 K46H-N 122.4 8.5 T47H-N 113.888 8.01 G48H-N 112.146 8.435 G49H-N 109.24 8.272 D50H-N 120.713 8.149 T51H-N 113.264 8.096 S52H-N 118.667 8.224 R53H-N 121.395 8.171 S54H-N 116.002 8.581 L56H-N 123.071 8.64 A57H-N 117.806 7.781 S58H-N 114.788 9.093 I59H-N 123.353 9.781 M60H-N 125.889 9.356 C61H-N 121.442 9.089 Y62H-N 121.68 8.904 S63H-N 118.82 9.503 K64H-N 122.428 8.914 D65H-N 118.86 8.602 I66H-N 119.288 7.094 D67H-N 127.996 8.6 G68H-N 110.803 8.645 V69H-N 122.149 7.245 S71H-N 120.026 8.896 D72H-N 117.611 8.686 K73H-N 116.54 7.42 A74H-N 119.554 7.121 G75H-N 111.924 7.772 K76H-N 120.134 8.236 C77H-N 115.633 8.333 F78H-N 117.314 9.423 L79H-N 125.001 9.506 K80H-N 128.403 9.579 N81H-N 121.296 8.508 N81HD21-ND2 109.242 7.5 N81HD22-ND2 109.242 7.5 F82H-N 120.713 8.156 S83H-N 116.911 8.831 G84H-N 110.308 8.351 E85H-N 120.362 8.533 D86H-N 118.213 8.232 S87H-N 113.535 8.013 S88H-N 114.923 8.092 E89H-N 123.265 8.324 I90H-N 123.14 8.179 D91H-N 124.945 8.118 E92H-N 122.401 8.31 K93H-N 123.294 8.804 E94H-N 126.272 8.96 V95H-N 119.312 8.14 S96H-N 119.167 8.469 L97H-N 125.505 8.21 I99H-N 118.729 5.743 K100H-N 125.316 9.142 S101H-N 112.093 8.002 N103H-N 115.814 7.568 D104H-N 121.759 7.41 A105H-N 120.909 7.769 F106H-N 114.099 8.315 M107H-N 115.099 8.874 F108H-N 122.006 9.609 V109H-N 123.891 9.406 C110H-N 126.465 9.345 S111H-N 114.252 9.18 S112H-N 114.194 9.305 N113H-N 124.943 8.913 N113HD21-ND2 111.297 6.83 N113HD22-ND2 111.297 6.83 D114H-N 116.477 8.249 G115H-N 109.844 8.034 S116H-N 114.224 8.378 A117H-N 125.138 8.867 L118H-N 121.989 8.433 Q119H-N 122.289 8.861 C120H-N 115.343 8.971 D121H-N 125.683 9.375 V122H-N 124.277 8.816 F123H-N 124.876 9.304 A124H-N 119.636 9.154 L125H-N 125.444 8.102 D126H-N 125.911 8.13 N127H-N 123.715 8.594 N127HD21-ND2 112.605 6.612 N127HD22-ND2 112.605 6.612 T128H-N 112.323 8.496 N129H-N 120.909 7.885 N129HD21-ND2 112.067 7.532 N129HD22-ND2 112.067 7.532 S130H-N 117.077 8.243 S131H-N 117.57 8.303 D132H-N 120.909 7.871 G133H-N 106.126 7.712 W134H-N 119.836 8.191 W134HE1-NE1 129.1 10.1 K135H-N 124.161 8.932 V136H-N 118.667 8.23 N137H-N 121.395 8.204 T138H-N 118.581 8.361 V139H-N 124.995 9.333 D140H-N 128.523 8.507 L141H-N 123.606 8.155 G142H-N 106.037 8.939 V143H-N 112.058 7.226 S144H-N 118.581 8.361 V145H-N 120.026 8.487 S146H-N 119.542 6.862 D148H-N 116.313 8.46 L149H-N 117.994 7.561 A150H-N 118.843 7.941 F151H-N 117.045 8.538 G152H-N 107.829 7.546 L153H-N 116.664 7.933 T154H-N 122.745 9.61 A155H-N 125.911 8.104 D156H-N 123.464 9.069 G157H-N 113.184 8.723 V158H-N 119.742 8.117 K159H-N 129.878 8.494 V160H-N 122.308 8.988 K162H-N 122.71 8.353 L163H-N 122.39 8.474 Y164H-N 116.766 9.426 A165H-N 120.465 8.974 S166H-N 117.319 8.69 S167H-N 117.695 8.78 G168H-N 111.116 8.375 L169H-N 120.884 7.766 T170H-N 114.923 8.1 A171H-N 127.031 8.313 I172H-N 122.113 8.203 N173H-N 121.65 8.228 D174H-N 117.736 8.023 D175H-N 123.119 8.115 S177H-N 116.575 8.76 L178H-N 121.089 7.437 G179H-N 108.064 7.97 C180H-N 116.942 7.524 K181H-N 124.083 8.206 A182H-N 131.82 7.915