Assignment w1 w2 M5H-N 115.671 8.283 L6H-N 117.137 8.686 V7H-N 120.735 9.037 L8H-N 127.265 9.268 D9H-N 121.012 7.994 A11H-N 117.635 7.596 L12H-N 120.438 8.534 A14H-N 123.184 8.455 N15H-N 111.259 8.012 N15HD21-ND2 112.466 7.548 N15HD22-ND2 112.466 6.708 I16H-N 121.194 7.367 T17H-N 117.674 8.577 L18H-N 121.057 8.778 K19H-N 115.813 7.85 D20H-N 116.001 7.498 L21H-N 121.133 7.695 S23H-N 110.815 7.532 L24H-N 121.943 7.348 Y25H-N 116.328 7.966 S27H-N 111.342 8.83 F28H-N 122.984 8.753 H29H-N 116.556 7.451 S30H-N 115.482 8.696 A31H-N 125.327 7.605 S32H-N 115.142 8.949 D33H-N 116.955 7.385 I34H-N 116.837 8.69 F35H-N 121.424 8.404 N36H-N 119.667 8.672 N36HD21-ND2 110.604 6.908 N36HD22-ND2 110.604 7.507 V37H-N 115.079 8.621 A38H-N 125.075 9.006 K39H-N 123.664 8.643 K41H-N 114.666 8.419 N42H-N 115.006 7.729 N42HD21-ND2 112.515 7.483 N42HD22-ND2 112.515 6.93 S44H-N 114.353 7.792 T45H-N 115.368 8.221 N46H-N 117.971 8.367 N46HD21-ND2 112.403 6.81 N46HD22-ND2 112.403 7.249 V47H-N 112.298 9.272 S48H-N 115.257 8.654 V49H-N 125.395 9.252 V50H-N 126.413 9.011 V51H-N 123.363 7.801 F52H-N 121.151 8.161 D53H-N 118.329 9.893 S54H-N 109.05 7.555 T55H-N 118.117 8.995 K56H-N 123.226 8.161 D57H-N 117.82 7.593 V58H-N 120.383 7.281 E59H-N 121.261 7.922 D60H-N 120.765 8.255 A61H-N 123.491 7.935 H62H-N 118.694 8.624 S63H-N 114.19 8.56 G64H-N 106.617 7.738 L65H-N 122.0 7.369 L66H-N 122.177 8.018 K67H-N 120.859 8.029 G68H-N 108.599 8.079 N69H-N 118.693 8.276 N69HD21-ND2 112.102 6.874 N69HD22-ND2 112.102 7.56 S70H-N 116.155 8.28 R71H-N 121.725 8.374 Q72H-N 120.077 7.83 Q72HE21-NE2 112.7 6.615 Q72HE22-NE2 112.7 7.524 T73H-N 120.26 8.737 V74H-N 123.902 7.921 W75H-N 127.148 9.143 W75HE1-NE1 129.191 10.055 R76H-N 121.619 8.86 R76HH21-NH2 70.072 8.427 R76HH22-NH2 70.072 8.279 R76HE-NE 87.287 8.715 G77H-N 110.567 8.122 Y78H-N 116.722 8.867 L79H-N 120.628 8.853 T80H-N 116.583 9.725 T81H-N 113.045 7.32 D82H-N 125.143 8.314 K83H-N 119.224 7.81 E84H-N 119.676 8.167 V85H-N 118.088 6.917 G87H-N 107.536 8.391 L88H-N 118.801 7.177 V89H-N 121.225 8.753 L90H-N 129.266 8.62 M91H-N 126.101 8.29 Q92H-N 122.413 8.73 Q92HE21-NE2 111.568 6.79 Q92HE22-NE2 111.568 7.49 D93H-N 112.856 8.557 L94H-N 117.181 7.141 A95H-N 117.634 8.338 F96H-N 117.026 9.148 L97H-N 125.544 9.727 S98H-N 119.966 9.377 G99H-N 106.873 8.611 F100H-N 113.203 6.247 T103H-N 107.723 7.083 F104H-N 120.962 7.658 K105H-N 121.498 8.578 E106H-N 116.935 7.63 T107H-N 119.621 8.999 N108H-N 118.158 8.955 N108HD21-ND2 113.208 6.94 N108HD22-ND2 113.208 7.66 Q109H-N 117.945 7.373 Q109HE21-NE2 111.929 7.46 Q109HE22-NE2 111.929 6.795 L110H-N 117.444 6.911 K111H-N 117.394 8.114 T112H-N 107.342 7.261 K113H-N 118.725 7.19 L114H-N 119.469 7.116 E116H-N 125.753 9.13 N117H-N 115.318 8.767 N117HD21-ND2 111.36 6.745 N117HD22-ND2 111.36 7.48 L118H-N 117.316 7.445 S119H-N 113.505 8.545 S120H-N 111.486 7.889 K121H-N 118.294 7.632 V122H-N 110.3 7.308 K123H-N 119.285 8.74 L124H-N 126.921 9.05 L125H-N 126.099 8.681 Q126H-N 113.03 7.044 Q126HE21-NE2 112.306 6.561 Q126HE22-NE2 112.306 7.773 L127H-N 126.206 8.423 Y128H-N 127.886 9.06 S129H-N 120.191 8.673 E130H-N 121.619 9.215 A131H-N 119.654 7.482 S132H-N 112.146 7.971 V133H-N 113.757 7.553 A134H-N 125.522 9.717 L135H-N 124.257 8.939 L136H-N 125.422 9.236 K137H-N 120.142 8.807 L138H-N 128.557 8.717 N139H-N 122.417 8.156 N139HD21-ND2 110.3 7.263 N139HD22-ND2 110.3 6.675 N140H-N 117.053 9.065 N140HD21-ND2 113.23 6.88 N140HD22-ND2 113.23 7.695 K142H-N 116.432 8.096 D143H-N 118.624 8.263 F144H-N 120.181 7.802 Q145H-N 116.568 8.16 Q145HE21-NE2 111.928 7.623 Q145HE22-NE2 111.928 6.924 E146H-N 118.425 7.687 L147H-N 119.274 7.906 N148H-N 115.796 7.831 N148HD21-ND2 111.444 6.514 N148HD22-ND2 111.444 7.234 K149H-N 118.676 7.563 Q150H-N 119.042 7.916 Q150HE21-NE2 111.852 7.454 T151H-N 113.584 8.035 K152H-N 121.773 8.072 K153H-N 119.573 8.035 N154H-N 116.954 8.115 N154HD21-ND2 112.193 7.532 N154HD22-ND2 112.193 6.872 M155H-N 121.588 8.247 T156H-N 112.525 7.868 I157H-N 118.302 8.386 D158H-N 128.218 9.3 G159H-N 102.56 8.469 K160H-N 121.77 8.034 E161H-N 123.15 8.551 L162H-N 123.255 8.332 T163H-N 115.587 8.541 I164H-N 127.058 8.871 S165H-N 122.727 9.327 A167H-N 120.909 8.258 Y168H-N 117.928 8.3 L169H-N 123.466 9.295 L170H-N 126.697 8.66 W171H-N 124.921 8.373 W171HE1-NE1 127.969 9.48 D172H-N 127.951 8.208