Assignment w1 w2 S2H-N 115.858 8.303 S3H-N 117.732 8.415 G4H-N 110.551 8.348 V8H-N 120.98 7.836 K9H-N 126.297 8.398 F10H-N 123.29 8.643 L11H-N 116.188 9.45 T12H-N 107.527 7.358 V13H-N 125.508 8.703 N14H-N 128.37 8.266 N14HD21-ND2 113.012 6.3 N14HD22-ND2 113.012 6.602 D15H-N 120.62 8.243 D16H-N 120.856 7.931 I17H-N 115.311 7.328 L18H-N 123.404 8.487 S19H-N 118.552 8.639 M20H-N 120.938 8.333 Q22H-N 115.628 6.934 Q22HE21-NE2 112.501 6.964 Q22HE22-NE2 112.501 7.569 A23H-N 128.048 8.848 R24H-N 119.253 9.175 R24HE-NE 85.288 6.881 N25H-N 118.018 7.589 N25HD21-ND2 111.99 6.863 N25HD22-ND2 111.99 7.636 F26H-N 124.844 8.431 C27H-N 116.999 9.109 A28H-N 123.305 8.163 S29H-N 117.936 8.467 A30H-N 121.766 7.115 G31H-N 106.084 8.037 G32H-N 108.68 8.227 Y33H-N 117.585 8.631 L34H-N 123.059 9.491 A35H-N 122.122 8.215 D36H-N 114.741 7.573 D37H-N 117.952 5.41 L38H-N 120.226 9.0 G39H-N 104.23 7.463 D40H-N 118.281 8.462 D41H-N 118.321 8.585 K42H-N 123.529 7.908 N43H-N 120.505 8.548 N43HD21-ND2 116.578 6.608 N43HD22-ND2 116.578 7.58 N44H-N 117.299 9.0 N44HD21-ND2 113.097 7.089 N44HD22-ND2 113.097 7.651 F45H-N 124.457 7.652 Y46H-N 120.328 8.357 S47H-N 112.644 8.143 S48H-N 115.267 7.702 I49H-N 114.058 7.27 A50H-N 124.027 7.834 A51H-N 120.185 8.292 N52H-N 113.218 8.662 N52HD21-ND2 112.842 6.888 N52HD22-ND2 112.842 7.546 T53H-N 113.829 8.006 Q54H-N 121.783 8.461 Q54HE21-NE2 114.63 6.923 Q54HE22-NE2 114.63 8.166 F55H-N 115.815 7.406 W56H-N 121.589 9.677 W56HE1-NE1 130.061 10.064 I57H-N 110.439 8.126 G58H-N 104.652 9.575 L59H-N 122.552 6.305 F60H-N 122.737 9.588 K61H-N 123.006 9.143 N62H-N 126.242 8.734 N62HD21-ND2 109.23 5.284 N62HD22-ND2 109.23 6.935 S63H-N 116.778 8.638 D64H-N 119.219 7.892 G65H-N 108.098 8.224 Q66H-N 118.731 8.01 Q66HE21-NE2 112.246 6.863 Q66HE22-NE2 112.246 7.396 F67H-N 119.559 8.737 Y68H-N 118.613 8.764 W69H-N 117.468 9.573 W69HE1-NE1 131.232 10.256 D70H-N 121.666 9.358 R71H-N 126.084 8.909 R71HE-NE 87.218 8.263 G72H-N 109.371 8.25 Q73H-N 119.558 8.353 Q73HE21-NE2 111.715 7.506 Q73HE22-NE2 111.715 6.838 G74H-N 114.494 9.054 I75H-N 120.37 7.058 N76H-N 128.828 8.929 N76HD21-ND2 113.268 7.013 N76HD22-ND2 113.268 7.762 D78H-N 120.15 8.008 L79H-N 126.107 8.627 L80H-N 126.029 8.137 N81H-N 129.86 9.634 N81HD21-ND2 110.968 6.801 N81HD22-ND2 110.968 7.611 Q82H-N 120.402 8.588 Q82HE21-NE2 109.219 8.086 Q82HE22-NE2 109.219 8.173 I84H-N 116.189 7.327 T85H-N 115.94 8.106 Y86H-N 114.094 2.575 W87H-N 122.168 7.261 W87HE1-NE1 127.912 10.354 A88H-N 124.57 8.941 N89H-N 117.866 8.643 N89HD21-ND2 113.523 7.09 N89HD22-ND2 113.523 7.722 G90H-N 112.25 8.827 E91H-N 118.702 7.817 S93H-N 117.727 7.437 N94H-N 122.522 8.723 N94HD21-ND2 112.416 6.891 N94HD22-ND2 112.416 7.553 D95H-N 123.546 8.034 T97H-N 108.258 8.682 R98H-N 125.345 7.664 R98HE-NE 84.521 6.989 Q99H-N 118.022 7.418 Q99HE21-NE2 111.82 6.835 Q99HE22-NE2 111.82 7.543 C100H-N 117.382 8.663 V101H-N 122.017 9.991 Y102H-N 121.801 9.299 F103H-N 122.402 9.186 D104H-N 127.093 8.642 G105H-N 114.524 8.448 R106H-N 116.745 8.179 R106HE-NE 84.482 7.201 S107H-N 113.936 7.271 G108H-N 114.15 8.814 D109H-N 119.451 7.776 K110H-N 125.678 8.728 S111H-N 112.318 8.437 K112H-N 125.101 7.661 V113H-N 111.719 7.253 W114H-N 125.051 8.858 W114HE1-NE1 122.988 9.96 T115H-N 122.885 9.05 T116H-N 117.503 8.756 D117H-N 117.293 9.22 T118H-N 116.16 8.862 C119H-N 123.812 8.903 A120H-N 117.95 7.958 T121H-N 116.582 7.83 R123H-N 126.453 8.777 R123HE-NE 83.236 6.128 F125H-N 111.117 7.956 I126H-N 116.934 7.311 C127H-N 122.819 9.231 Q128H-N 124.173 9.721 Q128HE21-NE2 116.504 7.521 Q128HE22-NE2 116.504 7.589 K129H-N 120.961 8.397 H130H-N 120.223 8.014 R131H-N 123.41 8.328 R131HE-NE 84.857 7.346 Y132H-N 122.093 8.404 D133H-N 122.054 8.403 S134H-N 115.413 8.208 D135H-N 121.25 8.29 H136H-N 118.74 8.151 K137H-N 124.219 8.315 N139H-N 119.035 8.595 N139HD21-ND2 112.822 6.935 N139HD22-ND2 112.822 7.63 T140H-N 114.375 8.134 I141H-N 122.905 8.197 G142H-N 112.815 8.425 D143H-N 120.847 8.209 A144H-N 124.789 8.361 S145H-N 114.99 8.332 G146H-N 110.494 8.172 S148H-N 116.414 8.527 S149H-N 117.891 8.349 G150H-N 116.863 8.06