Assignment w1 w2 G2H-N 108.436 8.503 Q4H-N 120.806 8.562 G5H-N 109.951 8.365 G6H-N 108.317 8.144 F7H-N 119.796 8.193 G8H-N 110.431 8.388 A9H-N 123.756 8.137 T10H-N 112.263 8.111 G11H-N 110.732 8.332 G12H-N 108.275 8.204 A13H-N 123.982 8.315 S14H-N 114.073 8.175 A15H-N 124.725 8.154 G16H-N 106.087 8.371 L17H-N 122.802 7.496 I18H-N 118.349 7.499 S19H-N 115.596 8.071 R20H-N 122.994 7.842 R20HE-NE 83.119 7.141 V21H-N 118.317 7.751 A22H-N 121.172 8.293 N23H-N 116.163 8.641 N23HD21-ND2 112.056 7.426 N23HD22-ND2 112.056 6.909 A24H-N 121.152 7.536 L25H-N 114.931 7.811 A26H-N 121.237 8.818 N27H-N 113.027 7.08 N27HD21-ND2 112.975 7.335 N27HD22-ND2 112.975 6.728 T28H-N 109.658 7.398 S29H-N 122.688 9.9 L31H-N 118.581 7.4 R32H-N 114.392 7.614 R32HE-NE 84.279 7.28 T33H-N 111.312 7.783 V34H-N 118.491 7.394 L35H-N 119.716 8.104 R36H-N 116.402 6.272 R36HE-NE 85.482 7.02 T37H-N 117.11 8.306 G38H-N 115.053 8.923 V39H-N 122.72 8.061 S40H-N 123.08 8.416 Q41H-N 123.799 9.054 Q41HE21-NE2 111.974 7.482 Q41HE22-NE2 111.974 6.818 Q42H-N 118.951 8.561 Q42HE21-NE2 109.846 7.224 Q42HE22-NE2 109.846 6.711 I43H-N 121.238 7.468 A44H-N 121.441 8.523 S45H-N 110.08 8.313 S46H-N 117.001 7.633 V47H-N 120.636 8.643 V48H-N 116.271 8.173 Q49H-N 119.77 8.265 R50H-N 117.222 8.008 R50HE-NE 84.712 7.19 A51H-N 122.08 9.002 A52H-N 119.211 8.563 Q53H-N 116.157 7.915 Q53HE21-NE2 111.348 6.804 Q53HE22-NE2 111.348 7.29 S54H-N 116.225 8.3 L55H-N 123.271 8.492 A56H-N 121.835 8.19 S57H-N 112.839 7.994 T58H-N 117.489 8.046 L59H-N 118.16 7.895 G60H-N 108.903 8.006 V61H-N 111.78 7.57 D62H-N 119.73 8.33 G63H-N 115.813 8.869 N64H-N 120.552 8.357 N64HD21-ND2 114.127 7.91 N64HD22-ND2 114.127 6.956 N65H-N 119.328 8.426 N65HD21-ND2 113.885 7.09 N65HD22-ND2 113.885 7.988 L66H-N 118.958 7.926 A67H-N 119.012 8.524 R68H-N 117.646 7.756 R68HE-NE 84.041 7.051 F69H-N 116.907 8.028 A70H-N 123.076 8.728 V71H-N 117.734 8.739 Q72H-N 120.58 8.118 Q72HE21-NE2 111.906 6.827 Q72HE22-NE2 111.906 7.548 A73H-N 119.901 7.851 V74H-N 114.885 8.082 S75H-N 117.049 8.359 R76H-N 117.502 6.951 R76HE-NE 84.728 7.03 L77H-N 121.763 7.321 A79H-N 125.851 8.753 G80H-N 110.483 8.934 S81H-N 116.996 7.535 D82H-N 121.195 8.291 T83H-N 114.936 8.276 S84H-N 115.885 8.604 A85H-N 125.819 7.813 Y86H-N 117.705 7.627 A87H-N 121.803 8.836 Q88H-N 119.126 8.226 Q88HE21-NE2 109.364 7.241 Q88HE22-NE2 109.364 6.526 A89H-N 122.853 7.945 F90H-N 117.479 8.43 S91H-N 111.483 8.402 S92H-N 113.022 8.722 A93H-N 123.557 7.921 L94H-N 116.508 8.047 F95H-N 117.278 7.771 N96H-N 122.243 9.205 N96HD21-ND2 111.155 6.892 N96HD22-ND2 111.155 7.236 A97H-N 117.281 8.103 G98H-N 104.785 7.505 V99H-N 118.999 7.634 L100H-N 112.862 6.399 N101H-N 114.619 8.68 N101HD21-ND2 115.486 7.509 N101HD22-ND2 115.486 6.755 A102H-N 118.573 8.863 S103H-N 111.368 8.414 N104H-N 118.61 7.995 N104HD21-ND2 105.958 7.148 N104HD22-ND2 105.958 6.356 I105H-N 121.406 7.678 D106H-N 119.418 8.324 T107H-N 110.504 7.591 L108H-N 122.324 8.73 G109H-N 107.566 7.941 S110H-N 115.723 8.806 R111H-N 123.815 7.761 R111HE-NE 84.846 7.159 V112H-N 120.357 8.358 L113H-N 119.224 8.523 S114H-N 115.103 8.194 A115H-N 122.671 7.887 L116H-N 121.407 8.838 L117H-N 120.696 8.583 N118H-N 117.268 8.18 N118HD21-ND2 113.215 7.226 N118HD22-ND2 113.215 6.847 G119H-N 109.18 8.204 V120H-N 123.253 8.946 S121H-N 113.698 8.098 S122H-N 117.814 7.949 A123H-N 124.489 8.2 A124H-N 119.444 8.479 Q125H-N 118.401 8.165 G126H-N 106.759 7.885 L127H-N 120.085 7.491 G128H-N 107.554 7.764 I129H-N 122.762 7.949 N130H-N 124.829 8.401 V131H-N 122.825 7.951 D132H-N 126.259 8.59 S133H-N 121.933 8.867 G134H-N 111.219 8.697 S135H-N 118.403 7.883 V136H-N 122.118 7.617 Q137H-N 117.643 7.978 Q137HE21-NE2 110.716 7.372 Q137HE22-NE2 110.716 6.703 S138H-N 115.782 8.046 D139H-N 123.5 8.483 I140H-N 122.88 8.53 S141H-N 116.321 8.044 S142H-N 117.407 8.621 S143H-N 119.257 8.473 S144H-N 115.386 8.399 S145H-N 117.656 7.975 F146H-N 121.86 8.142 L147H-N 119.204 8.016 S148H-N 113.758 7.872 T149H-N 115.003 8.113 S150H-N 117.077 8.095 S153H-N 117.546 8.21 A154H-N 125.715 8.188 S155H-N 114.36 8.087 Y156H-N 121.812 8.002 S157H-N 117.046 8.07 Q158H-N 122.301 8.262 A159H-N 124.864 8.241 S160H-N 114.665 8.176 A161H-N 125.799 8.26 S162H-N 114.35 8.208 S163H-N 117.552 8.281 T164H-N 114.926 8.145 S165H-N 117.534 8.197 G166H-N 110.808 8.346 A167H-N 123.708 8.145 G168H-N 107.777 8.325 Y169H-N 120.738 8.03 T170H-N 117.159 8.09 G171H-N 110.407 7.277 S173H-N 115.983 8.416 G174H-N 110.447 8.13 S176H-N 116.064 8.457 T177H-N 114.85 8.087 G178H-N 110.772 8.16 S180H-N 115.369 8.395 G181H-N 110.452 8.278 Y182H-N 121.167 7.973 G184H-N 108.254 7.52 L186H-N 121.892 8.38 G187H-N 109.537 8.315 G188H-N 108.62 8.276 G189H-N 108.417 8.211 A190H-N 124.614 8.078 F192H-N 119.725 8.161 G193H-N 110.613 8.194 Q194H-N 119.767 8.113 S195H-N 116.798 8.392 G196H-N 110.414 8.315 F197H-N 119.982 8.135 G198H-N 111.732 8.357 G199H-N 114.761 7.478