Assignment w1 w2 D3H-N 126.259 8.399 F5H-N 118.709 8.214 T6H-N 115.281 7.804 A7H-N 127.838 8.148 G9H-N 111.156 8.75 Q10H-N 120.408 7.778 Q10HE21-NE2 114.265 7.998 Q10HE22-NE2 114.265 7.328 L11H-N 121.491 8.638 E12H-N 121.336 9.675 C13H-N 116.93 8.183 E14H-N 119.376 8.251 T15H-N 117.058 8.558 A16H-N 126.028 8.071 I17H-N 119.716 8.428 A18H-N 121.927 7.718 A19H-N 122.265 7.977 L20H-N 121.882 8.522 N21H-N 118.461 8.65 N21HD21-ND2 110.692 6.591 N21HD22-ND2 110.692 7.221 S22H-N 116.746 7.875 C23H-N 120.412 7.971 L24H-N 119.631 8.462 R25H-N 119.954 7.751 D26H-N 121.421 7.89 L27H-N 122.432 8.552 D28H-N 122.527 8.713 Q29H-N 118.601 8.242 A30H-N 122.56 8.095 S31H-N 114.86 8.472 L32H-N 122.111 7.978 A33H-N 122.46 7.882 A34H-N 122.085 8.752 V35H-N 119.028 8.361 S36H-N 113.579 7.416 Q37H-N 116.142 7.997 Q38H-N 115.315 8.483 Q38HE21-NE2 111.51 7.376 Q38HE22-NE2 111.51 6.764 L39H-N 124.533 7.984 A40H-N 132.334 8.292 R42H-N 124.863 8.057 E43H-N 117.199 8.51 I45H-N 118.347 7.384 S46H-N 120.844 8.308 Q47H-N 121.904 9.004 Q47HE21-NE2 110.333 7.294 Q47HE22-NE2 110.333 6.748 E48H-N 118.525 8.903 A49H-N 123.527 7.95 L50H-N 120.192 7.818 H51H-N 119.475 8.637 T52H-N 116.059 8.306 Q53H-N 123.113 8.291 Q53HE21-NE2 108.907 7.262 Q53HE22-NE2 108.907 6.516 M54H-N 118.238 8.307 L55H-N 119.353 8.471 T56H-N 114.249 8.387 A57H-N 122.242 7.449 V58H-N 116.403 8.483 Q59H-N 119.293 8.24 E60H-N 118.472 7.74 I61H-N 119.799 8.02 S62H-N 113.124 8.475 H63H-N 116.424 7.625 L64H-N 118.306 7.718 I65H-N 120.804 7.262 E66H-N 117.17 8.893 L68H-N 120.817 8.081 A69H-N 122.84 8.518 S70H-N 112.422 8.895 A71H-N 124.935 7.925 A72H-N 119.062 8.349 R73H-N 113.271 7.603 A74H-N 117.312 7.34 E75H-N 121.635 8.94 A76H-N 128.433 8.803 S77H-N 111.483 8.707 Q78H-N 119.308 7.741 L79H-N 121.247 7.714 G80H-N 104.664 8.876 H81H-N 119.95 7.92 K82H-N 116.59 7.909 V83H-N 117.071 8.489 S84H-N 115.209 7.98 Q85H-N 120.887 8.0 M86H-N 117.094 7.951 A87H-N 117.3 8.29 Q88H-N 115.46 7.35 Y89H-N 115.061 7.324 F90H-N 117.647 7.614 E91H-N 122.462 8.892 L93H-N 117.535 7.418 T94H-N 116.255 8.16 L95H-N 120.592 8.199 A96H-N 122.059 8.09 A97H-N 122.266 8.781 V98H-N 116.877 8.198 G99H-N 106.312 8.033 A100H-N 127.199 9.772 A101H-N 122.631 9.075 S102H-N 115.093 8.424 K103H-N 119.825 7.07 T104H-N 117.069 7.44 L105H-N 126.801 8.48 S106H-N 113.482 7.686 Q109H-N 117.476 7.253 Q110H-N 122.252 8.33 Q110HE21-NE2 110.815 6.836 Q110HE22-NE2 110.815 7.48 M111H-N 113.437 7.878 A112H-N 122.062 7.973 L113H-N 116.47 7.761 L114H-N 118.963 7.42 D115H-N 120.845 9.185 Q116H-N 117.868 8.834 Q116HE21-NE2 107.071 7.204 Q116HE22-NE2 107.071 6.326 T117H-N 120.489 7.902 K118H-N 124.145 8.63 T119H-N 116.795 8.713 L120H-N 123.658 7.742 A121H-N 123.0 8.497 E122H-N 118.006 9.237 S123H-N 118.002 8.538 A124H-N 128.363 8.48 L125H-N 120.275 8.121 Q126H-N 116.81 7.607 Q126HE21-NE2 111.506 7.71 Q126HE22-NE2 111.506 6.769 L127H-N 121.479 8.148 L128H-N 119.84 8.684 Y129H-N 118.294 8.884 T130H-N 113.99 8.103 A131H-N 125.858 9.21 K132H-N 118.249 8.404 E133H-N 117.938 7.386 A134H-N 122.511 8.071 G135H-N 101.58 8.552 G136H-N 108.583 8.44 N137H-N 117.41 7.646 N137HD21-ND2 112.764 6.986 N137HD22-ND2 112.764 7.726 K139H-N 118.574 8.076 Q140H-N 119.701 7.931 A141H-N 124.095 8.473 A142H-N 122.519 8.401 T144H-N 115.313 7.34 Q145H-N 122.006 7.881 E146H-N 119.686 8.446 A147H-N 122.376 8.031 L148H-N 121.328 8.171 E149H-N 118.256 7.944 E150H-N 119.992 8.205 A151H-N 122.236 8.17 V152H-N 120.247 8.544 Q153H-N 122.386 8.071 M154H-N 118.417 8.487 M155H-N 119.451 8.337 T156H-N 116.362 8.525 E157H-N 122.067 8.055 A158H-N 121.349 7.952 V159H-N 119.876 8.59 E160H-N 124.171 8.177 D161H-N 120.639 8.403 L162H-N 118.985 7.516 T163H-N 115.402 8.469 T164H-N 119.532 8.198 T165H-N 120.971 8.007 L166H-N 121.668 8.467 N167H-N 119.045 8.538 N167HD21-ND2 110.855 7.468 N167HD22-ND2 110.855 6.691 E168H-N 120.466 8.09 A169H-N 122.665 7.945 A170H-N 120.46 7.902 S171H-N 113.72 7.86 A172H-N 125.237 7.932 A173H-N 123.165 8.039 G174H-N 114.223 7.84