Assignment w1 w2 A3H-N 123.511 8.322 V4H-N 119.471 7.889 A5H-N 123.084 7.858 V6H-N 103.608 7.12 Y7H-N 123.524 7.829 H8H-N 127.881 9.11 G9H-N 105.598 5.555 K10H-N 128.623 8.545 I11H-N 116.797 7.457 S12H-N 117.826 8.685 R13H-N 121.663 8.879 R13HE-NE 142.665 7.674 E14H-N 119.313 9.096 T15H-N 119.6 8.152 G16H-N 107.881 8.179 E17H-N 118.169 7.902 K18H-N 117.563 7.994 L19H-N 119.918 8.191 L20H-N 117.114 7.496 L21H-N 121.712 8.985 A22H-N 119.032 7.686 T23H-N 109.333 7.419 G24H-N 106.409 7.356 L25H-N 120.797 7.295 D26H-N 127.752 8.888 G27H-N 108.486 9.979 S28H-N 121.801 8.33 Y29H-N 118.412 8.279 L30H-N 112.084 8.751 L31H-N 121.318 8.972 R32H-N 119.531 8.989 R32HE-NE 145.595 8.258 D33H-N 124.715 8.607 S34H-N 117.67 8.501 E35H-N 130.648 11.13 S36H-N 113.938 8.204 V37H-N 124.476 7.968 G39H-N 111.055 8.469 V40H-N 118.99 7.264 Y41H-N 123.98 8.893 C42H-N 118.062 10.077 L43H-N 129.375 9.619 C44H-N 127.021 9.114 V45H-N 123.988 9.509 L46H-N 129.672 8.714 Y47H-N 126.68 9.735 H48H-N 126.916 9.841 G49H-N 103.141 8.552 Y50H-N 116.181 7.798 I51H-N 121.303 8.917 Y52H-N 134.39 9.568 T53H-N 120.789 8.773 Y54H-N 126.801 9.405 R55H-N 126.007 9.729 R55HE-NE 145.528 8.083 V56H-N 126.814 9.678 S57H-N 119.797 8.929 Q58H-N 122.774 8.686 Q58HE21-NE2 111.385 6.772 Q58HE22-NE2 111.385 6.772 T59H-N 116.362 8.857 E60H-N 120.568 9.277 T61H-N 106.864 7.532 G62H-N 110.534 7.84 S63H-N 115.524 7.195 W64H-N 122.067 9.69 W64HE1-NE1 129.233 10.097 S65H-N 113.608 9.069 A66H-N 125.772 9.629 E67H-N 123.772 8.737 T68H-N 115.154 7.99 A69H-N 123.643 8.466 G71H-N 110.988 8.816 V72H-N 120.213 7.554 H73H-N 126.238 8.629 K74H-N 126.34 8.487 R75H-N 122.201 7.925 Y76H-N 120.124 8.158 F77H-N 119.094 9.463 R78H-N 123.466 9.582 K79H-N 112.774 7.497 I80H-N 127.082 8.993 K81H-N 119.638 8.748 N82H-N 116.28 6.902 N82HD21-ND2 111.588 7.231 N82HD22-ND2 111.588 8.023 L83H-N 125.417 6.78 I84H-N 117.739 7.627 S85H-N 111.494 7.506 A86H-N 124.228 7.602 F87H-N 113.762 7.49 Q88H-N 119.499 7.465 Q88HE21-NE2 109.754 6.45 Q88HE22-NE2 109.754 6.836 K89H-N 119.426 7.308 D91H-N 117.893 8.777 Q92H-N 115.841 8.609 Q92HE21-NE2 114.434 6.954 Q92HE22-NE2 114.434 6.705 G93H-N 106.603 8.455 I94H-N 111.928 7.209 V95H-N 118.995 7.242 I96H-N 118.591 6.793 L98H-N 118.422 7.562 Q99H-N 123.161 8.58 Q99HE21-NE2 110.012 7.183 Q99HE22-NE2 110.012 6.792 Y100H-N 118.841 7.753 V102H-N 126.437 8.214 E103H-N 126.156 8.39 K104H-N 123.005 7.863 K105H-N 126.34 8.514 S106H-N 117.934 8.383 S107H-N 118.044 8.315 A108H-N 126.653 8.239 R109H-N 125.474 7.857 T114H-N 113.782 8.161 T115H-N 116.195 8.221 G116H-N 111.633 8.401 I117H-N 120.498 7.96 R118H-N 125.767 8.394 E119H-N 123.428 8.467 D120H-N 123.481 8.38 D122H-N 120.098 8.396 V123H-N 119.767 7.806 C124H-N 122.66 8.317 L125H-N 125.302 8.239 K126H-N 122.86 8.118 A127H-N 128.309 8.259