Assignment w1 w2 G13H-N 110.446 8.399 L14H-N 121.478 8.06 V15H-N 122.588 8.095 R17H-N 121.89 8.457 G18H-N 110.122 8.455 S19H-N 115.364 8.201 H20H-N 120.118 8.477 M21H-N 120.834 8.208 Q22H-N 121.825 8.47 Q22HE21-NE2 111.793 6.715 Q22HE22-NE2 111.793 7.385 K23H-N 122.944 8.248 E24H-N 121.256 8.179 G25H-N 109.582 9.032 E27H-N 119.152 8.378 G28H-N 112.523 8.429 A29H-N 119.579 8.351 N30H-N 114.968 7.476 N30HD21-ND2 118.078 6.716 N30HD22-ND2 118.078 7.748 L31H-N 123.807 9.457 F32H-N 119.903 9.14 I33H-N 121.927 8.203 Y34H-N 122.392 9.26 H35H-N 111.989 8.471 L36H-N 113.66 7.454 Q38H-N 126.183 9.129 Q38HE21-NE2 112.908 7.043 Q38HE22-NE2 112.908 7.631 E39H-N 114.213 9.195 F40H-N 121.628 7.552 G41H-N 113.29 9.771 D42H-N 121.533 8.669 Q43H-N 116.182 8.765 Q43HE21-NE2 112.007 6.827 Q43HE22-NE2 112.007 7.533 D44H-N 117.356 7.146 I45H-N 116.686 7.575 L46H-N 123.191 7.889 Q47H-N 115.358 7.816 Q47HE21-NE2 111.959 6.87 Q47HE22-NE2 111.959 7.474 M48H-N 115.399 7.476 F49H-N 112.428 7.685 M50H-N 127.442 8.525 F52H-N 110.021 6.584 G53H-N 105.692 7.659 N54H-N 117.257 9.024 N54HD21-ND2 113.819 6.876 N54HD22-ND2 113.819 7.908 V55H-N 127.62 8.244 I56H-N 127.314 8.793 S57H-N 113.806 7.276 A58H-N 125.579 8.069 K59H-N 121.198 8.536 V60H-N 122.862 8.42 F61H-N 126.955 8.245 I62H-N 122.066 8.284 D63H-N 126.201 8.683 K64H-N 127.33 8.889 Q65H-N 116.945 8.691 Q65HE21-NE2 112.179 6.87 Q65HE22-NE2 112.179 7.64 T66H-N 106.97 7.792 N67H-N 116.787 8.493 N67HD21-ND2 112.142 6.74 N67HD22-ND2 112.142 7.452 L68H-N 117.686 7.609 S69H-N 114.932 8.716 K70H-N 125.2 9.156 C71H-N 111.895 10.095 F72H-N 113.933 7.54 G73H-N 107.194 9.12 F74H-N 118.584 8.603 V75H-N 122.59 7.833 S76H-N 119.927 8.6 Y77H-N 121.169 8.42 D78H-N 112.933 7.819 N79H-N 114.034 7.176 N79HD21-ND2 114.641 7.274 N79HD22-ND2 114.641 7.983 V81H-N 120.893 8.075 S82H-N 117.811 7.818 A83H-N 120.079 6.366 Q84H-N 115.869 7.741 Q84HE21-NE2 112.056 6.811 Q84HE22-NE2 112.056 7.817 A85H-N 122.805 7.822 A86H-N 121.653 7.853 I87H-N 118.541 8.065 Q88H-N 116.597 7.737 Q88HE21-NE2 111.327 6.808 Q88HE22-NE2 111.327 7.334 A89H-N 117.142 7.502 M90H-N 111.165 8.241 N91H-N 118.845 8.487 N91HD21-ND2 114.507 7.059 N91HD22-ND2 114.507 7.872 G92H-N 118.298 9.002 F93H-N 123.29 7.93 Q94H-N 128.505 8.018 Q94HE21-NE2 110.649 6.663 Q94HE22-NE2 110.649 7.416 I95H-N 126.391 8.116 G96H-N 117.599 8.952 M97H-N 123.36 8.933 K98H-N 119.679 7.894 R99H-N 119.743 8.234 R99HE-NE 84.682 7.215 L100H-N 123.252 9.073 K101H-N 123.591 8.065 V102H-N 125.897 8.702 Q103H-N 123.027 9.007 Q103HE21-NE2 111.926 6.938 Q103HE22-NE2 111.926 7.695 L104H-N 122.285 8.75 K105H-N 124.011 8.424 R106H-N 127.634 8.822 R106HE-NE 84.516 7.155 S107H-N 118.822 8.697 K108H-N 123.482 8.588 N109H-N 119.058 8.459 N109HD21-ND2 112.918 6.914 N109HD22-ND2 112.918 7.595 D110H-N 120.727 8.126 S111H-N 115.533 8.167 K112H-N 123.609 8.117 W114H-N 125.124 7.454 W114HE1-NE1 128.674 9.993