Assignment w1 w2 T3H-N 117.548 8.669 L4H-N 124.461 8.151 L5H-N 124.471 9.428 T6H-N 114.652 9.047 T7H-N 115.463 8.834 D8H-N 119.917 8.238 D9H-N 120.307 7.891 L10H-N 121.229 8.059 R11H-N 119.757 8.832 R11HE-NE 83.604 7.326 R12H-N 115.536 7.986 R12HE-NE 85.017 7.514 A13H-N 119.868 7.708 L14H-N 119.047 8.39 V15H-N 120.237 8.46 E16H-N 119.798 8.228 S17H-N 113.678 7.808 A18H-N 123.226 7.824 G19H-N 107.442 8.241 E20H-N 120.403 8.497 T21H-N 113.999 8.243 D22H-N 122.202 8.484 G23H-N 109.364 8.491 T24H-N 115.813 8.127 D25H-N 123.729 8.604 L26H-N 123.768 8.469 S27H-N 115.146 8.245 G28H-N 111.414 8.562 D29H-N 123.16 8.66 F30H-N 122.034 8.039 L31H-N 118.857 7.517 D32H-N 111.791 8.054 L33H-N 122.098 7.211 R34H-N 116.204 8.458 R34HE-NE 85.078 7.984 F35H-N 122.901 8.42 E36H-N 117.062 9.568 D37H-N 118.322 7.554 I38H-N 113.22 7.715 G39H-N 106.876 7.722 Y40H-N 121.461 8.029 D41H-N 123.525 8.006 S42H-N 114.053 8.929 L43H-N 124.044 7.817 A44H-N 123.19 8.159 L45H-N 121.077 8.458 M46H-N 119.516 8.226 E47H-N 120.644 8.487 T48H-N 118.554 8.324 A49H-N 123.691 8.72 A50H-N 119.584 8.223 R51H-N 119.695 8.139 R51HE-NE 84.792 7.566 L52H-N 120.352 8.435 E53H-N 119.355 8.904 S54H-N 112.863 8.046 R55H-N 120.604 8.134 R55HE-NE 84.814 7.183 Y56H-N 113.384 8.103 G57H-N 109.544 7.953 V58H-N 112.461 7.492 S59H-N 117.015 8.469 I60H-N 125.711 8.299 D62H-N 122.54 8.763 D63H-N 116.617 8.576 V64H-N 118.616 7.437 A65H-N 122.653 8.218 G66H-N 101.624 8.071 R67H-N 117.121 7.603 R67HE-NE 85.057 7.414 V68H-N 115.86 7.456 D69H-N 121.233 9.134 T70H-N 108.118 7.478 R72H-N 117.695 8.997 R72HH11-NH1 71.207 6.892 R72HH12-NH1 71.207 6.892 R72HH21-NH2 71.207 6.892 R72HH22-NH2 71.207 6.892 R72HE-NE 83.515 9.074 E73H-N 116.493 7.825 L74H-N 120.459 7.728 L75H-N 121.064 8.73 D76H-N 117.553 8.672 L77H-N 122.897 7.992 I78H-N 119.766 8.285 N79H-N 117.838 8.883 N79HD21-ND2 107.782 7.355 N79HD22-ND2 107.782 7.668 G80H-N 110.017 8.405 A81H-N 124.006 7.593 L82H-N 119.83 8.271 A83H-N 121.377 7.952 E84H-N 117.167 7.765 A85H-N 124.197 7.836 A86H-N 129.269 7.974