Assignment w1 w2 A2H-N 125.522 8.745 E3H-N 120.928 8.563 A4H-N 124.702 8.356 Q5H-N 119.616 8.58 Q5HE21-NE2 112.239 7.605 Q5HE22-NE2 112.239 6.8 E6H-N 122.897 8.551 E7H-N 121.092 8.805 C8H-N 116.012 8.23 R9H-N 122.322 8.316 E10H-N 120.265 8.053 Q11H-N 119.117 8.017 Q11HE21-NE2 109.903 7.426 Q11HE22-NE2 109.903 6.761 M12H-N 118.796 8.114 Q13H-N 119.616 8.025 Q13HE21-NE2 110.737 7.567 Q13HE22-NE2 110.737 6.974 R14H-N 121.256 8.111 Q15H-N 116.335 7.456 Q15HE21-NE2 110.694 7.822 Q15HE22-NE2 110.694 6.977 Q16H-N 112.57 7.671 Q16HE21-NE2 112.766 7.548 Q16HE22-NE2 112.766 6.859 M17H-N 110.792 8.834 L18H-N 111.161 8.066 S19H-N 114.266 7.31 H20H-N 122.661 9.976 C21H-N 119.944 7.768 R22H-N 122.241 8.168 M23H-N 117.809 7.857 Y24H-N 120.974 8.223 M25H-N 118.348 8.136 R26H-N 118.274 8.306 Q27H-N 117.9 7.811 Q27HE21-NE2 110.954 7.366 Q27HE22-NE2 110.954 6.81 Q28H-N 116.689 7.774 Q28HE21-NE2 112.238 7.55 Q28HE22-NE2 112.238 6.947 M29H-N 117.091 7.757 E30H-N 118.887 7.624 E31H-N 120.325 8.0 S32H-N 116.015 8.287 T33H-N 114.867 7.963 Y34H-N 121.044 7.956 Q35H-N 121.225 8.101 Q35HE21-NE2 112.233 7.478 Q35HE22-NE2 112.233 6.854 T36H-N 114.754 8.071 M37H-N 123.919 8.205 R39H-N 121.403 8.354 R40H-N 122.405 8.411 G41H-N 110.278 8.354 M42H-N 119.43 8.178 E43H-N 124.21 9.342 H45H-N 113.856 8.776 M46H-N 121.905 8.101 S47H-N 115.35 8.875 E48H-N 121.586 9.326 C49H-N 119.786 8.139 C50H-N 117.281 8.695 E51H-N 119.965 7.9 Q52H-N 119.78 7.889 L53H-N 118.96 8.516 E54H-N 120.272 8.737 G55H-N 102.554 7.292 M56H-N 119.452 7.531 D57H-N 121.694 8.911 E58H-N 124.274 9.131 S59H-N 111.905 8.579 C60H-N 117.368 8.276 R61H-N 122.241 7.526 C62H-N 114.53 8.929 E63H-N 123.02 8.676 G64H-N 107.461 8.562 L65H-N 121.913 7.983 R66H-N 119.944 8.454 M67H-N 119.78 8.667 M68H-N 120.956 8.561 M69H-N 118.201 8.152 R70H-N 120.232 8.14 M71H-N 117.819 7.965 M72H-N 118.139 8.006 Q73H-N 118.303 7.935 Q73HE21-NE2 110.082 7.189 Q73HE22-NE2 110.082 6.769 Q74H-N 117.483 7.745 Q74HE21-NE2 111.52 7.446 Q74HE22-NE2 111.52 6.788 K75H-N 117.975 7.906 E76H-N 119.124 8.516 M77H-N 118.796 8.123 Q78H-N 121.256 8.322 Q78HE21-NE2 112.059 7.473 Q78HE22-NE2 112.059 6.792 R80H-N 118.632 8.288 G81H-N 109.608 8.493 E82H-N 122.569 8.986 Q83H-N 118.632 8.185 Q83HE21-NE2 112.059 7.545 Q83HE22-NE2 112.059 6.941 M84H-N 119.124 7.777 R85H-N 118.96 7.957 R86H-N 119.124 7.96 M87H-N 118.96 8.134 M88H-N 117.61 8.347 R89H-N 117.881 7.687 L90H-N 119.288 7.843 A91H-N 121.577 8.231 E92H-N 113.317 7.972 N93H-N 111.413 7.184 N93HD21-ND2 113.599 7.713 N93HD22-ND2 113.599 7.009 I94H-N 122.241 7.644 S96H-N 112.233 7.383 R97H-N 123.225 7.971 C98H-N 114.366 7.609 N99H-N 118.528 8.122 N99HD21-ND2 111.878 7.514 N99HD22-ND2 111.878 6.731 L100H-N 117.27 8.124 S101H-N 115.995 8.099 M103H-N 117.45 8.646 R104H-N 118.348 7.945 C105H-N 121.421 8.941 M107H-N 123.921 9.455 G108H-N 109.19 8.315 G109H-N 109.919 8.604 S110H-N 115.475 8.184 I111H-N 120.68 7.856 A112H-N 126.45 8.208 G113H-N 107.925 8.138 F114H-N 124.211 7.618