Assignment w1 w2 D4H-N 121.472 8.415 S5H-N 115.613 8.13 F6H-N 121.193 8.906 K7H-N 121.238 8.621 V8H-N 119.246 8.723 V9H-N 124.379 8.5 L10H-N 127.216 9.157 E11H-N 123.214 8.833 G12H-N 111.974 8.589 A14H-N 124.054 7.804 W16H-N 131.54 11.415 W16HE1-NE1 128.083 9.932 G17H-N 106.936 10.159 F18H-N 118.361 7.886 R19H-N 114.923 8.129 R19HE-NE 84.9 7.588 L20H-N 122.098 9.387 Q21H-N 118.897 9.248 Q21HE21-NE2 111.23 7.207 Q21HE22-NE2 111.23 6.708 G22H-N 106.275 8.292 G23H-N 104.613 7.765 K24H-N 121.963 8.559 D25H-N 113.097 10.767 F26H-N 117.778 7.87 N27H-N 114.964 8.056 N27HD21-ND2 112.544 6.821 N27HD22-ND2 112.544 7.545 V28H-N 112.391 7.277 L30H-N 122.944 8.441 S31H-N 116.779 9.153 I32H-N 119.958 8.599 S33H-N 125.51 9.365 R34H-N 121.155 7.471 R34HE-NE 84.37 7.26 L35H-N 123.342 8.605 T36H-N 122.392 8.169 G38H-N 112.895 9.04 G39H-N 106.887 8.019 K40H-N 118.512 8.962 A41H-N 121.647 8.768 A42H-N 122.065 9.113 Q43H-N 118.025 8.484 Q43HE21-NE2 111.753 7.359 Q43HE22-NE2 111.753 6.878 A44H-N 119.35 7.584 G45H-N 104.153 7.729 V46H-N 121.589 7.488 A47H-N 128.694 8.757 V48H-N 120.19 8.354 G49H-N 117.437 9.277 D50H-N 122.877 7.832 W51H-N 122.873 9.021 W51HE1-NE1 127.482 9.928 V52H-N 121.943 8.318 L53H-N 127.018 9.066 S54H-N 112.609 8.2 I55H-N 120.303 8.402 D56H-N 129.196 9.673 G57H-N 102.891 8.672 E58H-N 121.165 7.819 N59H-N 124.356 8.916 N59HD21-ND2 113.741 7.77 N59HD22-ND2 113.741 7.085 A60H-N 128.631 8.508 G61H-N 107.082 8.548 S62H-N 112.1 8.04 L63H-N 120.139 7.319 T64H-N 114.072 9.131 H65H-N 121.992 10.388 I66H-N 117.31 8.821 E67H-N 121.318 7.578 A68H-N 121.53 8.564 Q69H-N 115.646 7.861 Q69HE21-NE2 110.655 7.094 Q69HE22-NE2 110.655 7.094 N70H-N 117.084 8.776 N70HD21-ND2 111.186 7.669 N70HD22-ND2 111.186 6.874 K71H-N 121.876 8.177 I72H-N 119.197 7.804 R73H-N 119.516 8.631 R73HE-NE 85.512 7.345 A74H-N 119.27 7.467 C75H-N 119.073 7.53 G76H-N 110.585 8.633 E77H-N 120.882 8.681 R78H-N 117.321 7.89 R78HE-NE 85.427 9.304 L79H-N 125.342 8.413 S80H-N 122.097 8.692 L81H-N 126.817 8.978 G82H-N 112.162 8.394 L83H-N 126.423 8.684 S84H-N 111.514 8.444 R85H-N 127.084 8.922 R85HE-NE 84.783 7.841 A86H-N 127.568 8.356 G87H-N 108.518 8.314 A88H-N 123.557 8.129 S89H-N 114.496 8.246 A90H-N 125.785 8.266 G91H-N 107.737 8.289 A92H-N 123.752 8.124 S93H-N 114.846 8.278 A94H-N 125.806 8.287 G95H-N 107.789 8.314 S97H-N 114.798 8.273 A98H-N 125.455 8.189 H99H-N 117.031 8.278 G100H-N 109.388 8.275 N101H-N 118.762 8.292 N101HD21-ND2 112.537 7.501 N101HD22-ND2 112.537 6.861 F102H-N 120.821 8.175 A103H-N 124.807 8.076 F104H-N 118.899 7.997 E105H-N 122.519 8.229 G106H-N 109.639 8.02 I107H-N 119.867 8.039 G108H-N 113.618 8.761 D109H-N 121.241 8.304 E110H-N 118.322 8.127 D111H-N 120.305 8.08 L112H-N 130.756 8.398