Assignment w1 w2 S1H-N 124.298 7.571 M2H-N 128.026 7.967 Q3H-N 123.167 8.504 Q3HE21-NE2 110.899 7.352 Q3HE22-NE2 110.899 6.791 E5H-N 120.296 8.692 E6H-N 121.061 8.231 F7H-N 120.532 8.046 A8H-N 124.429 8.061 A9H-N 122.078 7.989 A10H-N 122.703 8.059 A11H-N 121.726 7.976 R12H-N 119.362 8.052 R12HE-NE 103.409 7.384 G13H-N 109.118 8.209 G14H-N 108.307 8.117 F15H-N 119.759 8.146 G16H-N 110.732 8.429 G17H-N 108.494 8.005 D18H-N 120.676 8.225 A19H-N 124.743 8.345 E20H-N 118.726 8.213 K21H-N 121.185 8.002 A22H-N 123.485 8.019 K23H-N 119.543 7.972 A24H-N 123.399 8.011 A25H-N 121.863 8.072 E26H-N 119.442 8.2 A27H-N 123.243 8.055 Q28H-N 118.658 8.135 Q28HE21-NE2 111.158 7.387 Q28HE22-NE2 111.158 6.768 E29H-N 121.117 8.162 A30H-N 122.543 8.101 M31H-N 117.811 7.922 R32H-N 121.131 8.077 R32HH11-NH1 98.122 6.938 R32HH12-NH1 98.122 6.96 R32HH21-NH2 98.047 6.973 R32HH22-NH2 98.047 6.989 R32HE-NE 103.863 7.602 Q33H-N 118.816 8.268 Q33HE21-NE2 111.645 7.524 Q33HE22-NE2 111.645 6.859 Q34H-N 117.348 7.776 Q34HE21-NE2 111.547 7.401 Q34HE22-NE2 111.547 6.79 M35H-N 118.39 8.215 E37H-N 120.148 8.091 Q38H-N 119.446 8.246 Q38HE21-NE2 110.943 7.448 Q38HE22-NE2 110.943 6.706 R39H-N 120.091 7.936 R40H-N 118.298 7.844 I41H-N 119.892 8.023 M42H-N 121.582 8.138 L43H-N 119.541 8.508 R44H-N 116.292 7.742 R44HH11-NH1 101.373 6.836 R44HH12-NH1 101.373 6.829 R44HH21-NH2 100.395 6.816 R44HH22-NH2 100.395 6.808 A45H-N 117.952 7.461 V46H-N 110.605 7.494 L47H-N 121.059 7.473 T48H-N 113.92 8.336 A50H-N 118.892 8.501 A51H-N 121.685 7.733 Q52H-N 118.053 8.675 Q52HE21-NE2 111.747 7.463 Q52HE22-NE2 111.747 6.768 E53H-N 120.056 7.954 R54H-N 120.157 7.85 R54HH11-NH1 100.848 6.463 R54HH12-NH1 100.848 6.433 R54HH21-NH2 100.848 6.405 R54HH22-NH2 100.848 6.496 R57H-N 120.619 8.134 I58H-N 119.782 7.945 Q59H-N 119.987 8.437 Q59HE21-NE2 112.267 7.487 Q59HE22-NE2 112.267 6.783 L60H-N 115.053 7.248 V61H-N 113.294 7.311 K62H-N 124.485 8.762 A63H-N 126.773 8.504 D64H-N 115.732 8.774 K65H-N 120.786 7.577 A66H-N 120.387 7.865 R67H-N 116.64 7.892 E68H-N 119.67 7.698 V69H-N 119.784 8.079 E70H-N 120.837 8.457 A71H-N 118.888 7.753 L72H-N 119.335 7.699 I73H-N 120.356 8.331 Q75H-N 119.227 8.161 Q75HE21-NE2 111.299 7.557 Q75HE22-NE2 111.299 6.795 N76H-N 117.867 8.068 N76HD21-ND2 111.408 7.346 N76HD22-ND2 111.408 7.091 A77H-N 123.187 8.511 Q78H-N 117.841 8.183 Q78HE21-NE2 111.253 7.339 Q78HE22-NE2 111.253 6.727 R79H-N 116.768 7.716 R79HH11-NH1 101.141 6.762 R79HH12-NH1 101.141 6.755 R79HH21-NH2 101.141 6.739 R79HH22-NH2 101.141 6.726 G80H-N 108.044 7.849 R81H-N 118.05 8.024 R81HH11-NH1 98.234 7.047 R81HH12-NH1 98.234 7.047 R81HH21-NH2 98.159 6.856 R81HH22-NH2 98.159 6.856 R81HE-NE 103.093 7.557 L82H-N 121.029 7.933 A83H-N 125.637 8.322 D84H-N 117.204 7.825 K85H-N 118.464 8.243 V86H-N 124.013 8.973 D87H-N 126.153 7.881 E88H-N 119.841 8.498 A89H-N 120.162 8.285 T90H-N 116.774 8.234 L91H-N 123.212 8.244 I92H-N 117.848 8.136 E93H-N 121.009 7.629 L94H-N 120.575 8.351 L95H-N 119.897 8.397 Q97H-N 119.031 8.015 Q97HE21-NE2 110.865 7.309 Q97HE22-NE2 110.865 6.773 T98H-N 111.339 7.834 S99H-N 117.697 8.06 A100H-N 125.277 8.111 A101H-N 122.206 8.072 S102H-N 114.057 8.038 A103H-N 125.406 8.079 A104H-N 122.288 8.011 K105H-N 119.415 8.04 N106H-N 119.034 8.264 N106HD21-ND2 111.769 7.445 N106HD22-ND2 111.769 7.128 T107H-N 116.543 7.965 K109H-N 121.601 8.311 V110H-N 120.88 8.074 T111H-N 118.026 8.161 M112H-N 122.987 8.274 R113H-N 122.487 8.239 R113HE-NE 103.102 7.181 R114H-N 122.684 8.314 R114HE-NE 103.416 7.55 R115H-N 122.05 8.278 F116H-N 120.99 8.437 S117H-N 115.767 8.144 D118H-N 121.722 8.341 D119H-N 119.203 8.115 D120H-N 120.154 8.094 D121H-N 120.121 8.173 D122H-N 120.446 8.117 F123H-N 124.464 7.552