Assignment w1 w2 E3H-N 120.248 8.94 E4H-N 120.433 7.963 D5H-N 122.297 8.233 E6H-N 122.597 8.476 K7H-N 120.28 7.972 E8H-N 122.227 8.17 S9H-N 115.938 8.396 Q10H-N 121.113 8.118 Q10HE21-NE2 112.041 7.63 Q10HE22-NE2 112.041 6.847 R11H-N 124.201 8.162 R11HE-NE 85.035 9.096 I12H-N 118.863 8.535 A13H-N 122.664 8.089 S14H-N 116.801 7.912 K15H-N 126.656 7.921 N16H-N 116.607 8.758 N16HD21-ND2 111.133 7.514 N16HD22-ND2 111.133 6.811 Q17H-N 122.298 8.257 Q17HE21-NE2 111.587 7.528 Q17HE22-NE2 111.587 6.873 L18H-N 120.329 7.74 E19H-N 117.672 8.249 S20H-N 112.122 8.356 I21H-N 123.367 8.485 A22H-N 123.136 8.403 Y23H-N 113.918 8.242 S24H-N 116.428 8.469 L25H-N 123.452 8.791 K26H-N 117.343 7.582 N27H-N 118.612 8.373 N27HD21-ND2 113.025 7.677 N27HD22-ND2 113.025 6.943 T28H-N 119.197 8.814 I29H-N 121.121 8.204 S30H-N 116.213 7.841 E31H-N 118.884 7.438 A32H-N 122.004 7.685 G33H-N 106.263 8.187 D34H-N 124.443 8.642 K35H-N 117.743 7.892 L36H-N 113.936 6.952 E37H-N 120.852 9.324 Q38H-N 124.371 9.007 Q38HE21-NE2 117.021 8.092 Q38HE22-NE2 117.021 7.011 A39H-N 118.603 8.931 D40H-N 117.626 6.864 K41H-N 119.117 7.671 D42H-N 120.055 8.82 T43H-N 117.583 8.06 V44H-N 119.182 7.439 T45H-N 116.88 8.809 K46H-N 119.964 8.619 K47H-N 118.994 7.434 A48H-N 125.544 9.044 E49H-N 118.187 8.861 E50H-N 121.32 8.611 T51H-N 118.224 8.067 I52H-N 124.189 8.267 S53H-N 115.154 8.319 W54H-N 123.788 8.479 W54HE1-NE1 131.482 10.213 L55H-N 123.382 8.961 D56H-N 117.705 7.967 S57H-N 111.485 7.259 N58H-N 121.766 7.473 N58HD21-ND2 117.24 6.441 N58HD22-ND2 117.24 6.793 T59H-N 111.444 7.891 T60H-N 108.988 7.664 A61H-N 125.454 7.089 S62H-N 113.054 8.204 K63H-N 121.026 9.125 E64H-N 115.859 8.894 E65H-N 119.209 7.608 F66H-N 119.159 8.0 D67H-N 120.799 9.002 D68H-N 123.191 8.595 K69H-N 121.253 7.824 L70H-N 122.585 8.356 K71H-N 120.908 7.823 E72H-N 117.78 7.886 L73H-N 119.166 7.664 Q74H-N 118.316 8.863 Q74HE21-NE2 110.569 7.361 Q74HE22-NE2 110.569 6.772 D75H-N 119.667 8.868 I76H-N 117.172 7.071 A77H-N 119.57 8.614 N78H-N 118.919 9.337 N78HD21-ND2 110.412 7.628 N78HD22-ND2 110.412 6.745 I80H-N 117.982 6.832 M81H-N 118.244 8.674 S82H-N 113.466 8.133 K83H-N 120.672 7.369 L84H-N 119.841 7.674 Y85H-N 118.396 7.933 Q86H-N 120.233 8.017 Q86HE21-NE2 112.119 7.47 Q86HE22-NE2 112.119 6.852 A87H-N 123.526 8.026 G88H-N 107.464 8.173 G89H-N 108.203 8.196 A90H-N 124.434 8.221 G92H-N 109.87 8.479 G93H-N 108.864 8.236 A94H-N 124.161 8.232 A95H-N 123.525 8.334 G96H-N 108.27 8.3 G97H-N 108.654 8.167 A98H-N 125.045 8.185 G100H-N 111.783 8.517 G101H-N 115.357 7.915