Assignment w1 w2 G4H-N 111.003 8.486 S5H-N 115.842 8.301 G7H-N 110.817 8.399 A8H-N 123.895 8.065 I9H-N 119.288 7.965 Y10H-N 124.153 8.226 V11H-N 121.757 7.916 D12H-N 123.433 8.345 L13H-N 123.532 8.062 N15H-N 114.601 8.299 N15HD21-ND2 116.213 7.722 N15HD22-ND2 116.213 6.962 R16H-N 120.474 8.802 Q17H-N 124.379 8.397 Q17HE21-NE2 112.559 7.625 Q17HE22-NE2 112.559 7.061 L18H-N 123.34 8.937 K19H-N 120.032 8.628 V20H-N 123.243 8.97 K21H-N 129.086 9.079 V22H-N 113.765 7.8 A23H-N 122.242 8.359 D24H-N 112.232 7.935 R25H-N 127.236 9.32 R26H-N 117.665 8.341 V27H-N 114.389 7.116 I28H-N 119.776 7.495 S29H-N 120.299 7.816 T30H-N 114.61 8.724 T31H-N 114.393 8.823 A33H-N 123.023 8.307 E34H-N 117.555 8.271 R35H-N 118.695 8.099 Q36H-N 119.75 8.304 Q36HE21-NE2 118.052 8.274 Q36HE22-NE2 118.052 6.998 A37H-N 124.929 8.33 G42H-N 111.143 8.666 L43H-N 122.124 7.39 E45H-N 119.224 9.034 A46H-N 120.922 7.561 I47H-N 121.421 8.355 N48H-N 119.12 8.846 N48HD21-ND2 111.028 7.826 N48HD22-ND2 111.028 7.274 D49H-N 119.131 7.883 L50H-N 120.869 7.637 V51H-N 116.964 8.437 K52H-N 115.189 7.263 K53H-N 117.043 7.678 Y54H-N 118.46 7.633 T55H-N 118.761 8.849 L56H-N 124.272 9.019 A57H-N 118.864 7.469 R58H-N 116.972 8.307 R58HE-NE 84.91 7.288 A59H-N 121.553 8.3 F60H-N 114.52 8.99 V61H-N 113.156 8.278 R62H-N 120.929 8.999 S64H-N 116.535 8.421 G65H-N 112.071 8.836 T66H-N 109.328 8.389 E67H-N 120.394 7.954 D68H-N 123.071 8.845 I69H-N 119.799 8.154 V70H-N 123.435 9.254 R71H-N 126.357 8.434 V72H-N 125.374 9.144 Y73H-N 127.987 8.567 A74H-N 126.574 8.143 E75H-N 117.311 8.768 A76H-N 118.735 8.247 N77H-N 111.272 7.893 N77HD21-ND2 113.574 7.831 N77HD22-ND2 113.574 7.124 S78H-N 110.923 7.442 Q79H-N 124.736 9.541 Q79HE21-NE2 113.028 7.547 Q79HE22-NE2 113.028 6.841 E80H-N 117.959 8.986 S81H-N 116.178 7.923 A82H-N 124.889 8.107 D83H-N 117.303 8.727 R84H-N 122.15 7.791 R84HE-NE 85.282 7.403 L85H-N 121.041 8.403 A86H-N 118.889 8.306 Y87H-N 119.623 7.784 E88H-N 121.073 8.972 V89H-N 120.035 8.816 S90H-N 118.901 8.502 L91H-N 122.703 7.797 L92H-N 119.551 7.275 V93H-N 118.402 8.094 F94H-N 118.985 8.521 Q95H-N 115.697 8.458 L96H-N 116.123 8.654 A97H-N 120.739 8.354 G98H-N 107.155 8.12 G99H-N 106.211 7.885 I100H-N 119.388 7.734 G101H-N 110.103 8.526 E102H-N 121.104 8.356 R103H-N 124.617 8.37 Q105H-N 121.189 8.472 Q105HE21-NE2 112.562 7.56 Q105HE22-NE2 112.562 6.889 S107H-N 115.06 8.041