Assignment w1 w2 G13H-N 110.367 8.239 Y14H-N 120.625 8.058 N15H-N 122.776 8.321 N15HD21-ND2 111.36 6.773 N15HD22-ND2 111.36 7.456 G16H-N 107.72 7.596 T17H-N 112.518 7.968 T18H-N 115.993 8.069 Q19H-N 122.776 8.265 Q19HE21-NE2 111.525 7.385 Q19HE22-NE2 111.525 6.72 R20H-N 123.107 8.225 V21H-N 122.114 8.144 E22H-N 125.92 8.376 Q23H-N 120.956 8.372 Q23HE21-NE2 115.002 7.495 Q23HE22-NE2 115.002 7.059 A24H-N 127.243 8.083 S25H-N 112.849 7.816 D26H-N 123.769 8.31 L27H-N 121.453 7.644 I28H-N 125.093 8.034 L29H-N 126.913 8.795 D30H-N 117.151 8.24 E31H-N 119.304 7.395 K32H-N 120.46 8.139 I33H-N 119.625 9.046 K34H-N 126.416 7.737 V35H-N 129.56 9.152 T36H-N 120.108 8.738 F37H-N 120.46 7.899 D38H-N 121.618 9.168 A39H-N 127.74 8.838 N40H-N 117.813 8.773 N40HD21-ND2 113.979 6.867 N40HD22-ND2 113.979 6.685 V41H-N 120.46 8.797 A42H-N 130.718 8.382 A43H-N 119.613 8.061 G44H-N 105.735 8.399 L45H-N 122.28 7.241 W47H-N 120.129 7.964 W47HE1-NE1 127.409 10.125 E48H-N 119.964 8.767 F49H-N 127.905 8.664 V50H-N 119.633 8.566 V52H-N 122.942 8.093 Q53H-N 115.993 7.484 Q53HE21-NE2 111.195 6.84 Q53HE22-NE2 111.195 7.189 R54H-N 121.453 8.673 D55H-N 112.518 7.753 I56H-N 116.324 8.902 D57H-N 125.589 8.158 V58H-N 119.964 9.039 R59H-N 123.438 8.597 I60H-N 126.582 8.661 G61H-N 118.309 8.299 E62H-N 122.776 7.838 T63H-N 123.604 8.943 V64H-N 122.611 8.608 Q65H-N 120.294 8.055 Q65HE21-NE2 110.202 6.931 Q65HE22-NE2 110.202 6.692 I66H-N 121.949 9.19 M67H-N 117.316 8.253 Y68H-N 124.1 8.689 R69H-N 120.129 9.073 R69HE-NE 124.431 7.194 A70H-N 126.251 8.461 K71H-N 119.467 8.397 N72H-N 122.776 7.502 N72HD21-ND2 110.698 7.11 N72HD22-ND2 110.698 6.264 L73H-N 126.747 8.936 A74H-N 121.618 7.978 S75H-N 110.864 8.383 T76H-N 111.525 7.22 T78H-N 112.187 8.298 T79H-N 117.482 8.109 G80H-N 113.345 9.074 Q81H-N 118.64 9.048 Q81HE21-NE2 110.698 7.388 Q81HE22-NE2 110.698 6.579 T83H-N 111.856 8.603 F84H-N 116.82 7.771 N85H-N 117.482 8.559 N85HD21-ND2 112.684 7.195 N85HD22-ND2 112.684 6.452 V86H-N 122.776 7.904 T87H-N 119.136 8.374 M89H-N 124.762 9.007 A90H-N 120.625 8.872 A91H-N 114.354 7.647 G92H-N 105.073 7.91 A93H-N 120.625 7.551 Y94H-N 113.345 7.46 F95H-N 124.762 7.44 N96H-N 128.567 8.075 N96HD21-ND2 111.856 5.721 N96HD22-ND2 111.856 7.187 T106H-N 123.934 9.164 T107H-N 126.582 8.899 L108H-N 126.913 8.612 E109H-N 122.776 9.316 G111H-N 114.237 7.76 E112H-N 123.273 7.91 E113H-N 124.431 8.1 M114H-N 124.431 8.934 E115H-N 125.424 8.452 M116H-N 123.604 8.919 V118H-N 119.741 8.838 V119H-N 126.913 8.667 F120H-N 124.762 8.911 F121H-N 112.849 8.477 V122H-N 121.778 9.345 D123H-N 129.891 9.178 E125H-N 119.964 9.139 I126H-N 118.64 8.043 V127H-N 110.202 6.618 K128H-N 120.46 7.553 V130H-N 122.114 8.451 E131H-N 116.511 9.081 T132H-N 104.08 7.081 Q133H-N 122.611 7.66 Q133HE21-NE2 110.533 7.074 Q133HE22-NE2 110.533 6.656 G134H-N 107.72 8.592 I135H-N 121.122 7.348 K136H-N 124.431 8.474 T137H-N 114.173 7.295 L138H-N 124.762 8.838 T139H-N 117.151 8.925 L140H-N 130.883 8.719 S141H-N 118.971 8.337 Y142H-N 122.611 7.439 F144H-N 127.243 8.317 Y145H-N 120.46 8.534 R147H-N 120.46 7.847 E148H-N 123.273 8.399 S150H-N 118.309 9.124 K151H-N 123.769 8.061 V153H-N 120.625 8.152 A154H-N 128.071 8.265 Q155H-N 120.129 8.233 Q155HE21-NE2 111.195 7.459 Q155HE22-NE2 111.195 6.739 V156H-N 122.28 8.104