Assignment w1 w2 D2H-N 126.335 8.405 F4H-N 119.092 8.226 T5H-N 115.191 7.755 A6H-N 126.537 8.153 D7H-N 119.016 8.128 A8H-N 124.593 8.084 G9H-N 107.549 8.416 H10H-N 118.299 8.049 T11H-N 113.438 8.571 E12H-N 121.398 8.156 F13H-N 123.347 9.059 T14H-N 123.455 7.565 D15H-N 129.242 8.52 E16H-N 113.473 8.371 V17H-N 120.817 8.863 Y18H-N 123.324 9.273 Q19H-N 124.452 9.03 Q19HE21-NE2 111.95 7.09 Q19HE22-NE2 111.95 7.506 N20H-N 123.647 9.19 N20HD21-ND2 116.951 6.704 N20HD22-ND2 116.951 6.704 E21H-N 121.609 9.232 S22H-N 114.765 9.49 R23H-N 117.285 8.457 R23HE-NE 85.623 6.011 Y24H-N 121.006 7.677 G26H-N 113.505 8.445 G27H-N 109.695 8.4 D28H-N 118.362 8.051 W29H-N 121.719 7.895 W29HE1-NE1 130.803 10.272 K30H-N 124.029 8.933 A32H-N 126.945 7.955 E33H-N 122.131 8.584 D34H-N 116.66 7.995 T35H-N 118.874 8.11 Y36H-N 119.236 8.395 T37H-N 112.524 9.114 D38H-N 117.602 8.573 A39H-N 121.583 9.016 N40H-N 114.187 7.9 N40HD21-ND2 115.356 6.893 N40HD22-ND2 115.356 8.031 G41H-N 107.122 7.881 D42H-N 122.905 8.274 K43H-N 122.09 8.496 A44H-N 129.892 8.211 A45H-N 121.721 7.883 S46H-N 112.99 7.791 S48H-N 109.343 7.455 E49H-N 120.24 7.659 L50H-N 123.081 7.293 T51H-N 116.345 8.183 C52H-N 122.11 8.492 G55H-N 112.159 8.857 W56H-N 120.09 7.914 W56HE1-NE1 132.401 10.353 E57H-N 118.019 8.979 W58H-N 123.647 8.688 W58HE1-NE1 128.932 10.056 E59H-N 124.118 9.495 D60H-N 117.194 7.068 D61H-N 123.738 8.866 A62H-N 118.895 7.296 W63H-N 120.499 8.167 W63HE1-NE1 128.016 9.579 S64H-N 117.419 8.77 Y65H-N 117.24 7.718 D66H-N 122.572 8.79 I67H-N 120.563 8.196 N68H-N 125.841 8.383 N68HD21-ND2 113.629 6.811 N68HD22-ND2 113.629 7.581 R69H-N 117.091 7.934 R69HE-NE 83.984 7.234 A70H-N 125.443 8.371 V71H-N 114.593 7.447 D72H-N 121.938 9.357 E73H-N 114.747 8.671 K74H-N 118.19 8.047 G75H-N 105.677 8.077 W76H-N 121.209 7.912 W76HE1-NE1 127.89 9.652 E77H-N 116.135 8.728 Y78H-N 118.377 9.679 G79H-N 107.044 9.223 I80H-N 116.889 8.658 T81H-N 119.592 8.036 I82H-N 129.227 8.758 D85H-N 126.32 8.42 H86H-N 115.778 8.79 K87H-N 119.043 7.48 K89H-N 119.945 8.59 S90H-N 111.712 7.08 W91H-N 121.837 8.218 W91HE1-NE1 128.019 9.58 V92H-N 115.379 9.683 A93H-N 120.968 8.299 A94H-N 116.093 6.935 E95H-N 125.583 7.804 K96H-N 130.238 10.727 M97H-N 119.311 8.528 Y98H-N 107.889 6.054 H99H-N 121.123 7.294 T100H-N 110.64 8.394 H101H-N 123.251 8.687 R102H-N 119.259 8.993 R103H-N 119.266 9.086 R103HE-NE 85.749 6.66 R104H-N 118.215 8.631 R104HE-NE 83.405 5.348 R105H-N 126.505 8.896 R105HE-NE 85.014 7.519 L106H-N 129.621 9.181 V107H-N 111.553 8.997 R108H-N 120.223 7.657 R108HE-NE 83.171 5.162 K109H-N 128.187 9.002 R110H-N 121.565 9.59 R110HE-NE 88.487 9.335 K111H-N 117.916 9.435 K112H-N 124.886 7.866 D113H-N 124.784 8.262 L114H-N 125.138 8.382 T115H-N 114.083 8.26 Q116H-N 121.874 8.047 Q116HE21-NE2 112.83 6.783 Q116HE22-NE2 112.83 7.535 T117H-N 115.407 8.053 A118H-N 126.637 8.303 S119H-N 115.096 8.247 S120H-N 117.999 8.308 T121H-N 115.608 8.067 A122H-N 127.402 8.154 R123H-N 126.034 7.88 R123HE-NE 85.287 7.118