Assignment w1 w2 M4H-N 122.572 8.393 A5H-N 125.572 8.098 Y6H-N 120.73 8.402 F7H-N 118.436 8.958 L8H-N 122.81 8.711 D9H-N 124.57 9.145 F10H-N 123.156 9.884 D11H-N 123.103 8.986 E12H-N 128.73 9.685 R13H-N 117.93 9.626 A14H-N 122.063 7.268 L15H-N 121.956 8.773 K16H-N 118.25 7.515 E17H-N 118.33 7.416 W18H-N 121.77 9.095 R19H-N 113.396 8.06 K20H-N 116.232 7.274 L21H-N 119.903 7.359 G22H-N 108.063 8.455 S23H-N 117.509 8.711 T24H-N 116.047 8.273 V25H-N 122.543 7.075 R26H-N 118.49 7.781 E27H-N 116.756 8.107 Q28H-N 118.41 7.76 Q28HE21-NE2 111.134 7.337 Q28HE22-NE2 111.134 6.822 L29H-N 119.716 8.631 K30H-N 120.836 9.183 K31H-N 116.783 7.58 K32H-N 116.383 7.3 L33H-N 121.77 8.722 V34H-N 118.116 8.067 E35H-N 116.57 6.825 V36H-N 120.618 7.785 L37H-N 115.476 7.956 E38H-N 114.356 7.042 S39H-N 109.796 7.125 R41H-N 120.882 8.356 I42H-N 127.866 5.973 E43H-N 129.498 8.86 A44H-N 119.919 8.827 N45H-N 114.675 8.184 N45HD21-ND2 110.744 7.445 N45HD22-ND2 110.744 7.078 K46H-N 122.167 7.515 L47H-N 127.544 8.184 R48H-N 128.641 8.706 G49H-N 110.474 8.543 M50H-N 118.742 7.404 D52H-N 116.361 8.703 C53H-N 114.086 7.456 Y54H-N 120.722 8.939 K55H-N 117.297 8.665 I56H-N 122.006 9.272 K57H-N 125.752 8.745 L58H-N 124.173 8.543 S61H-N 112.447 7.605 G62H-N 108.976 8.214 Y63H-N 117.859 7.283 R64H-N 117.912 9.296 L65H-N 123.59 9.077 V66H-N 123.237 8.729 Y67H-N 124.227 8.976 Q68H-N 122.541 9.696 Q68HE21-NE2 107.947 7.192 Q68HE22-NE2 107.947 6.377 V69H-N 127.437 9.05 I70H-N 129.296 9.385 D71H-N 128.749 9.343 E72H-N 118.929 9.718 K73H-N 114.113 6.653 V74H-N 119.223 7.832 V75H-N 117.19 7.732 V76H-N 128.347 9.026 F77H-N 128.802 9.629 V78H-N 128.588 9.535 I79H-N 126.287 8.515 S80H-N 111.625 7.18 V81H-N 126.742 8.641 G82H-N 111.223 8.658 K83H-N 121.257 8.569 A84H-N 126.662 8.334 E85H-N 121.819 8.638 A86H-N 125.35 8.462 S87H-N 115.397 8.309 E88H-N 122.947 8.443 V89H-N 120.884 8.098 Y90H-N 124.634 8.313 S91H-N 118.447 8.14 E92H-N 122.947 8.4 A93H-N 124.404 8.224 V94H-N 119.33 7.971 K95H-N 124.941 8.271 R96H-N 122.918 8.317 I97H-N 123.301 8.251 L98H-N 132.344 7.934 K4H-N 123.119 8.389 Q5H-N 122.121 8.533 Q5HE21-NE2 112.633 7.589 Q5HE22-NE2 112.633 6.917 T6H-N 116.639 8.281 L7H-N 125.001 8.328 L8H-N 123.073 8.264 S9H-N 117.15 8.499 D10H-N 122.632 8.416 E11H-N 121.842 8.486 D12H-N 120.309 8.301 A13H-N 122.864 8.114 E14H-N 117.931 8.105 L15H-N 119.867 7.813 V16H-N 118.357 8.491 E17H-N 117.103 7.411 I18H-N 120.727 7.574 V19H-N 119.635 8.294 K20H-N 118.009 8.78 E21H-N 117.452 7.567 R22H-N 119.635 8.156 L23H-N 115.686 8.436 R24H-N 118.427 7.404 N25H-N 114.083 7.322 N25HD21-ND2 112.28 7.635 N25HD22-ND2 112.28 6.914 K27H-N 121.21 8.672 V29H-N 124.322 9.036 R30H-N 129.461 8.437 V31H-N 123.375 8.822 T32H-N 109.507 7.855 L33H-N 121.099 8.841 D34H-N 113.851 7.983 E35H-N 117.508 7.561 L36H-N 126.929 7.219