Assignment w1 w2 A2H-N 120.258 8.496 M3H-N 120.18 8.496 A4H-N 125.712 8.364 Q5H-N 119.776 8.35 Q5HE21-NE2 112.47 7.544 Q5HE22-NE2 112.47 6.897 R6H-N 122.816 8.432 K7H-N 122.942 8.447 G8H-N 110.276 8.473 A9H-N 123.036 8.108 G10H-N 106.65 8.418 R11H-N 117.102 8.571 R11HE-NE 84.659 7.341 V12H-N 119.627 8.388 V13H-N 129.884 9.533 H14H-N 128.207 9.915 I15H-N 126.766 8.362 C16H-N 118.997 8.72 N17H-N 115.09 9.146 N17HD21-ND2 113.04 7.585 N17HD22-ND2 113.04 7.353 L18H-N 116.543 7.344 E20H-N 123.648 8.7 G21H-N 114.857 8.989 S22H-N 114.363 8.059 C23H-N 122.922 8.065 T24H-N 112.106 7.712 E25H-N 121.642 9.692 N26H-N 115.453 8.29 N26HD21-ND2 110.319 7.363 N26HD22-ND2 110.319 6.848 D27H-N 116.362 7.524 V28H-N 115.37 7.642 I29H-N 118.72 8.145 N30H-N 115.242 7.529 N30HD21-ND2 112.121 7.542 N30HD22-ND2 112.121 6.585 L31H-N 115.223 7.283 G32H-N 102.995 7.693 L33H-N 119.888 7.3 F35H-N 112.508 7.846 G36H-N 106.276 7.517 K37H-N 118.522 8.204 V38H-N 129.271 8.118 T39H-N 115.922 9.165 N40H-N 119.054 8.206 N40HD21-ND2 110.861 8.217 N40HD22-ND2 110.861 6.426 Y41H-N 114.834 8.374 I42H-N 117.29 8.486 L43H-N 126.986 9.257 M44H-N 126.918 8.432 K45H-N 121.02 7.504 S46H-N 112.841 8.927 T47H-N 107.726 7.209 N48H-N 118.338 7.857 N48HD21-ND2 112.642 7.42 N48HD22-ND2 112.642 6.811 Q49H-N 112.989 7.797 Q49HE21-NE2 112.235 8.183 Q49HE22-NE2 112.235 7.006 A50H-N 118.936 8.941 F51H-N 114.264 9.034 L52H-N 120.159 9.224 E53H-N 126.267 8.826 M54H-N 123.733 8.703 A55H-N 121.232 8.474 Y56H-N 109.482 7.485 T57H-N 120.316 9.462 E58H-N 121.638 9.765 A59H-N 121.602 6.99 A60H-N 119.918 7.107 Q61H-N 114.668 8.396 Q61HE21-NE2 113.192 7.538 Q61HE22-NE2 113.192 7.026 A62H-N 122.332 8.119 M63H-N 120.533 7.802 V64H-N 117.37 7.706 Q65H-N 118.753 8.141 Q65HE21-NE2 112.294 7.636 Q65HE22-NE2 112.294 6.828 Y66H-N 120.606 8.112 Y67H-N 115.701 7.772 Q68H-N 118.498 7.623 Q68HE21-NE2 111.474 7.521 Q68HE22-NE2 111.474 6.831 E69H-N 117.849 7.145 K70H-N 121.222 8.147 A72H-N 126.835 8.919 I73H-N 123.02 8.008 I74H-N 127.083 8.69 N75H-N 126.524 9.329 N75HD21-ND2 111.653 7.36 N75HD22-ND2 111.653 6.824 G76H-N 102.181 8.179 E77H-N 122.22 7.984 K78H-N 123.32 8.458 L79H-N 126.659 8.722 L80H-N 122.994 7.812 I81H-N 129.249 8.58 R82H-N 127.778 9.375 M83H-N 119.948 9.009 S84H-N 116.281 8.594 T85H-N 120.488 9.54 R86H-N 121.699 7.595 Y87H-N 117.096 8.156 K88H-N 121.619 9.238 E89H-N 116.002 7.854 L90H-N 118.962 9.116 Q91H-N 121.55 8.816 Q91HE21-NE2 112.031 7.492 Q91HE22-NE2 112.031 6.758 L92H-N 129.931 9.035 K93H-N 122.439 8.558 K94H-N 119.181 7.646 G96H-N 110.009 8.213 K97H-N 121.926 8.3 N98H-N 121.927 8.686 N98HD21-ND2 113.025 7.758 N98HD22-ND2 113.025 7.042 V99H-N 125.659 8.731 A100H-N 122.174 8.313 A101H-N 120.794 7.666 I102H-N 120.526 7.69 I103H-N 120.104 8.288 Q104H-N 119.396 7.81 Q104HE21-NE2 112.076 7.506 Q104HE22-NE2 112.076 6.861 D105H-N 121.315 7.918 I106H-N 121.464 8.285 H107H-N 118.683 8.281 S108H-N 115.676 8.205 Q109H-N 120.857 8.06 Q109HE21-NE2 112.279 7.48 Q109HE22-NE2 112.279 6.78 R110H-N 120.474 8.009 E111H-N 121.619 8.284 R112H-N 126.431 7.856