Assignment w1 w2 R3H-N 124.008 8.518 L4H-N 124.389 8.424 A5H-N 124.548 8.418 N6H-N 116.484 8.287 N6HD21-ND2 111.608 7.597 N6HD22-ND2 111.608 6.79 G7H-N 108.453 8.351 I8H-N 120.848 7.868 V9H-N 125.805 8.22 L10H-N 127.757 8.437 D11H-N 121.539 8.506 K12H-N 123.635 8.578 D13H-N 120.448 8.523 T14H-N 113.711 7.964 T15H-N 116.71 7.921 F16H-N 117.124 8.191 G17H-N 109.951 8.11 E18H-N 121.64 8.304 L19H-N 127.101 8.799 K20H-N 118.828 8.494 F21H-N 124.322 9.658 S22H-N 120.109 7.199 A23H-N 114.102 7.269 L24H-N 120.865 8.819 R25H-N 130.455 9.473 R25HE-NE 84.853 8.327 R26H-N 113.305 7.711 E27H-N 121.934 8.848 V28H-N 125.545 8.603 R29H-N 128.327 8.735 I30H-N 121.957 8.358 Q31H-N 126.348 8.56 Q31HE21-NE2 112.189 7.561 Q31HE22-NE2 112.189 6.808 N32H-N 122.834 8.994 N32HD21-ND2 113.808 7.544 N32HD22-ND2 113.808 6.749 E33H-N 122.736 9.18 D34H-N 115.921 7.969 G35H-N 108.874 8.083 S36H-N 117.428 8.274 V37H-N 119.189 8.508 S38H-N 121.629 8.461 D39H-N 120.305 8.512 E40H-N 120.68 8.311 I41H-N 123.665 8.465 K42H-N 125.597 9.556 E43H-N 115.292 7.809 R44H-N 118.233 8.879 R44HE-NE 85.385 8.844 T45H-N 118.457 8.892 Y46H-N 125.916 9.625 D47H-N 122.109 9.006 L48H-N 121.879 9.066 K49H-N 122.218 9.401 S50H-N 117.388 8.266 K51H-N 130.55 9.276 G52H-N 107.053 8.32 Q53H-N 115.482 7.859 Q53HE21-NE2 113.837 7.505 Q53HE22-NE2 113.837 6.844 G54H-N 110.111 7.992 R55H-N 114.214 7.652 R55HE-NE 84.379 7.215 M56H-N 121.27 8.593 I57H-N 120.811 9.393 Q58H-N 122.281 8.218 Q58HE21-NE2 111.625 7.673 Q58HE22-NE2 111.625 6.545 V59H-N 122.421 9.188 S60H-N 124.709 9.022 I61H-N 121.648 9.226 A63H-N 123.695 7.803 S64H-N 110.001 7.719 V65H-N 126.142 7.79 L67H-N 124.236 8.578 K68H-N 124.053 7.994 E69H-N 123.876 8.347 F70H-N 117.781 5.549 D71H-N 120.385 8.791 Y72H-N 121.876 8.701 N73H-N 121.726 8.819 N73HD21-ND2 110.987 7.527 N73HD22-ND2 110.987 6.802 A74H-N 122.292 8.059 R75H-N 122.871 8.5 V76H-N 116.22 7.965 E77H-N 116.413 9.166 L78H-N 117.927 8.67 I79H-N 121.667 7.9 N80H-N 123.831 9.412 N80HD21-ND2 113.668 7.984 N80HD22-ND2 113.668 6.83 I82H-N 121.658 9.374 A83H-N 127.933 8.819 D84H-N 122.009 8.71 T85H-N 114.986 8.349 V86H-N 122.275 8.188 A87H-N 126.609 8.194 T88H-N 112.328 7.914 A89H-N 124.632 8.076 T90H-N 112.047 7.976 Y91H-N 121.184 7.959 Q92H-N 121.631 8.31 Q92HE21-NE2 112.421 7.479 Q92HE22-NE2 112.421 6.836 G93H-N 109.847 8.052 A94H-N 123.424 8.162 D95H-N 118.814 8.457 V96H-N 118.395 7.776 D97H-N 123.905 8.315 W98H-N 120.34 8.21 W98HE1-NE1 128.965 10.09 Y99H-N 123.319 8.76 I100H-N 123.281 8.936 K101H-N 126.21 8.987 A102H-N 121.424 8.531 D103H-N 117.773 8.339 D104H-N 110.673 7.482 I105H-N 121.38 9.267 V106H-N 116.356 8.592 L107H-N 121.368 8.36 T108H-N 118.728 7.977 L109H-N 124.847 8.378 E110H-N 120.886 8.145