Assignment w1 w2 I3H-N 122.328 8.193 E4H-N 123.518 8.425 N5H-N 118.922 8.284 L6H-N 122.237 8.077 K7H-N 121.351 8.171 S8H-N 116.22 8.095 F9H-N 122.235 8.121 D10H-N 124.427 8.166 F12H-N 117.848 8.125 A13H-N 123.816 7.479 D14H-N 119.875 8.305 T15H-N 113.855 8.129 G16H-N 111.08 8.426 D17H-N 120.502 8.213 D18H-N 120.533 8.32 E19H-N 121.73 8.513 T20H-N 114.126 8.217 A21H-N 125.917 8.166 T22H-N 112.224 8.038 N24H-N 120.05 8.162 N24HD21-ND2 113.038 6.889 N24HD22-ND2 113.038 7.452 Y25H-N 119.285 7.865 I26H-N 121.316 8.287 H27H-N 124.87 8.78 I28H-N 126.444 9.372 R29H-N 125.284 8.919 I30H-N 116.683 8.199 Q31H-N 123.308 8.956 Q31HE21-NE2 111.365 7.269 Q31HE22-NE2 111.365 6.67 Q32H-N 123.35 8.851 Q32HE21-NE2 111.29 7.399 Q32HE22-NE2 111.29 6.773 R33H-N 123.844 8.648 K37H-N 120.533 7.962 T38H-N 119.464 8.427 L39H-N 125.917 8.566 T40H-N 118.949 9.593 T41H-N 118.875 9.367 V42H-N 121.802 8.793 Q43H-N 128.678 8.966 Q43HE21-NE2 111.492 6.981 Q43HE22-NE2 111.492 7.634 G44H-N 112.755 9.085 V45H-N 121.866 8.098 E47H-N 121.735 8.683 E48H-N 117.636 8.915 Y49H-N 119.451 7.802 D50H-N 119.436 8.315 L51H-N 127.2 8.926 K52H-N 116.743 8.151 R53H-N 121.515 7.575 I54H-N 119.269 7.898 L55H-N 118.775 8.314 K56H-N 117.287 7.595 V57H-N 119.66 7.774 L58H-N 120.236 8.274 K59H-N 117.047 8.22 K60H-N 118.087 7.734 D61H-N 117.615 8.873 F62H-N 115.925 7.511 A63H-N 121.033 7.727 C64H-N 114.241 7.835 N65H-N 118.933 8.986 N67H-N 115.626 8.903 N67HD21-ND2 113.151 6.747 N67HD22-ND2 113.151 7.425 I68H-N 120.868 8.46 V69H-N 125.231 8.691 K70H-N 124.085 8.531 D71H-N 130.357 8.521 E73H-N 115.145 8.035 M74H-N 116.576 9.216 G75H-N 109.264 8.125 E76H-N 122.298 8.693 I77H-N 121.729 9.143 I78H-N 119.431 7.774 Q79H-N 126.847 9.026 Q79HE21-NE2 111.373 7.447 Q79HE22-NE2 111.373 6.761 L80H-N 123.828 9.581 Q81H-N 120.233 8.368 G82H-N 112.053 8.357 D83H-N 117.347 8.529 Q84H-N 121.393 8.638 Q84HE21-NE2 110.478 6.72 Q84HE22-NE2 110.478 7.731 R85H-N 118.591 7.791 A86H-N 119.242 8.479 K87H-N 118.982 7.641 V88H-N 117.82 8.505 C89H-N 120.185 7.947 E90H-N 117.203 7.858 F91H-N 120.887 8.106 M92H-N 118.724 8.451 I93H-N 117.504 7.821 S94H-N 114.151 8.479 Q95H-N 117.72 8.183 Q95HE21-NE2 112.621 7.553 Q95HE22-NE2 112.621 6.971 L96H-N 114.375 6.668 G97H-N 106.172 6.911 L98H-N 119.974 7.538 Q99H-N 116.511 8.257 Q99HE21-NE2 112.931 7.501 Q99HE22-NE2 112.931 6.842 K100H-N 124.153 8.783 K101H-N 114.187 8.192 N102H-N 116.256 7.742 N102HD21-ND2 110.919 6.926 N102HD22-ND2 110.919 7.526 I103H-N 120.754 7.695 K104H-N 128.288 9.103 I105H-N 124.587 8.4 H106H-N 128.132 8.884 F108H-N 125.028 7.862