Assignment w1 w2 R2H-N 127.162 9.363 A3H-N 125.863 8.337 F4H-N 113.082 8.675 I5H-N 120.369 9.027 A6H-N 131.19 9.55 I7H-N 118.174 8.772 D8H-N 129.221 9.091 V9H-N 109.557 6.666 E11H-N 120.556 8.924 S12H-N 112.69 8.439 V13H-N 123.479 7.204 R14H-N 119.035 8.172 D15H-N 116.399 8.152 A16H-N 123.118 7.647 L17H-N 119.929 8.335 V18H-N 121.004 8.216 R19H-N 118.328 7.532 A20H-N 122.082 7.526 Q21H-N 116.792 7.937 Q21HE21-NE2 113.399 7.647 Q21HE22-NE2 113.399 8.375 D22H-N 118.482 8.431 Y23H-N 120.62 7.893 I24H-N 119.955 8.051 G25H-N 105.64 8.58 S26H-N 113.41 8.423 K27H-N 122.717 8.704 E28H-N 115.744 8.368 A29H-N 121.709 8.07 K30H-N 120.145 8.367 I31H-N 128.719 8.385 K32H-N 127.17 8.682 F33H-N 130.266 9.081 V34H-N 125.102 7.732 E35H-N 127.469 8.64 R36H-N 122.249 8.353 E37H-N 115.732 8.879 N38H-N 116.79 8.063 N38HD21-ND2 109.885 7.528 N38HD22-ND2 109.885 6.473 F39H-N 120.037 6.763 H40H-N 114.081 8.094 I41H-N 119.738 9.242 T42H-N 128.329 9.726 L43H-N 127.575 9.274 K44H-N 115.225 7.221 F45H-N 131.769 9.835 L46H-N 125.319 7.702 G47H-N 105.887 6.74 E48H-N 122.869 8.291 I49H-N 120.652 9.162 T50H-N 111.899 8.854 E51H-N 120.613 9.041 E52H-N 119.353 8.524 Q53H-N 119.022 7.916 Q53HE21-NE2 111.765 7.722 Q53HE22-NE2 111.765 6.78 A54H-N 121.139 8.573 E55H-N 116.189 7.908 E56H-N 119.032 7.664 I57H-N 119.966 8.582 K58H-N 120.148 8.459 K59H-N 115.682 7.059 I60H-N 119.641 7.223 L61H-N 118.773 8.314 E62H-N 118.237 7.572 K63H-N 116.576 6.829 I64H-N 119.419 7.724 A65H-N 119.961 8.335 K66H-N 109.116 6.815 K67H-N 117.464 7.669 Y68H-N 117.271 7.321 K69H-N 118.745 8.313 K70H-N 121.967 8.451 H71H-N 115.94 6.995 E72H-N 123.11 8.792 V73H-N 118.309 8.478 N74H-N 118.495 7.903 N74HD21-ND2 113.174 7.214 N74HD22-ND2 113.174 7.506 V75H-N 126.716 9.022 R76H-N 128.712 8.536 G77H-N 113.524 9.11 I78H-N 118.758 7.083 G79H-N 116.715 8.244 V80H-N 106.993 7.405 F81H-N 118.801 8.645 N83H-N 115.022 7.506 N83HD21-ND2 115.916 6.925 N83HD22-ND2 115.916 7.722 N85H-N 113.847 8.315 N85HD21-ND2 113.625 6.921 N85HD22-ND2 113.625 7.416 Y86H-N 123.396 7.625 V87H-N 122.288 7.789 R88H-N 123.863 8.663 V89H-N 120.844 8.659 I90H-N 123.753 8.234 W91H-N 126.425 8.791 A92H-N 121.599 9.326 G93H-N 110.823 8.389 V94H-N 116.451 7.695 E95H-N 125.777 9.264 N96H-N 117.362 8.906 N96HD21-ND2 112.468 7.737 N96HD22-ND2 112.468 7.027 D97H-N 115.698 8.275 E98H-N 121.111 8.617 I99H-N 118.266 8.104 K101H-N 118.002 8.232 K102H-N 120.655 7.635 I103H-N 120.486 8.069 A104H-N 120.672 8.329 K105H-N 118.561 7.694 E106H-N 120.389 7.992 I107H-N 117.987 8.453 D108H-N 120.653 8.112 D109H-N 118.675 8.585 E110H-N 118.754 8.551 L111H-N 117.972 8.903 A112H-N 125.598 7.907 K113H-N 116.91 7.343 L114H-N 117.38 7.455 G115H-N 105.427 7.62 F116H-N 118.745 7.426 K117H-N 125.697 8.816 K118H-N 124.567 8.533 E119H-N 124.807 9.768 G120H-N 110.111 8.67 N121H-N 118.424 8.257 N121HD21-ND2 112.69 7.505 N121HD22-ND2 112.69 6.802 F122H-N 122.532 8.312 V123H-N 126.964 7.537 A124H-N 131.663 8.853 H125H-N 117.582 7.709 I126H-N 121.107 9.291 T127H-N 127.6 9.342 L128H-N 123.476 9.736 G129H-N 106.951 7.987 R130H-N 120.662 8.072 V131H-N 126.82 8.822 K132H-N 127.984 9.008 F133H-N 114.331 7.31 V134H-N 125.683 8.669 K135H-N 127.574 8.315 D136H-N 119.02 8.161 K137H-N 125.337 8.733 L138H-N 121.53 8.236 G139H-N 108.945 8.496 L140H-N 122.356 8.282 A141H-N 120.392 7.913 M142H-N 117.103 8.2 K143H-N 119.817 7.559 L144H-N 116.154 8.214 K145H-N 120.585 8.108 E146H-N 119.384 7.786 L147H-N 116.437 7.422 A148H-N 121.499 7.4 N149H-N 112.274 8.247 N149HD21-ND2 113.27 7.536 N149HD22-ND2 113.27 6.848 E150H-N 120.882 7.145 D151H-N 124.618 8.303 F152H-N 124.633 8.793 G153H-N 106.333 8.064 S154H-N 112.876 8.17 F155H-N 116.745 8.709 I156H-N 119.961 8.497 V157H-N 129.328 8.65 E158H-N 124.619 8.289 A159H-N 115.872 7.403 I160H-N 116.17 8.512 E161H-N 121.046 9.035 L162H-N 123.954 8.667 K163H-N 126.917 8.958 K164H-N 118.416 8.829 S165H-N 117.088 8.571 T166H-N 123.949 8.876 L167H-N 127.086 8.714 T168H-N 116.18 7.358 K170H-N 113.801 7.528 G171H-N 108.775 7.643 I173H-N 120.434 8.76 Y174H-N 125.33 8.883 E175H-N 121.842 8.77 T176H-N 123.135 9.221 L177H-N 129.234 9.193 A178H-N 117.529 7.621 R179H-N 122.538 8.154 F180H-N 124.514 8.812 E181H-N 125.63 8.782 L182H-N 125.022 8.132 S183H-N 114.509 8.5 E184H-N 120.847 8.358 H185H-N 119.728 8.517 H186H-N 119.87 8.62 H187H-N 120.475 8.628 H188H-N 120.479 8.504 H189H-N 119.424 8.522 H190H-N 125.522 8.325