Assignment w1 w2 E3H-N 119.869 8.707 D4H-N 119.65 8.053 D5H-N 119.339 8.02 K6H-N 121.265 7.711 V7H-N 122.743 8.34 E8H-N 129.254 8.996 I9H-N 123.662 8.478 Q11H-N 112.602 7.987 Q11HE21-NE2 112.776 6.716 Q11HE22-NE2 112.776 7.517 L12H-N 119.555 7.964 V13H-N 112.72 6.577 G14H-N 116.042 8.919 K15H-N 120.788 8.395 W16H-N 123.983 9.55 W16HE1-NE1 129.196 10.749 I17H-N 122.229 9.39 V18H-N 126.326 8.739 K19H-N 129.061 9.195 E20H-N 118.305 7.661 V22H-N 119.998 8.354 L23H-N 128.343 8.58 Q24H-N 117.971 8.142 Q24HE21-NE2 111.709 6.754 Q24HE22-NE2 111.709 7.441 D25H-N 117.501 8.587 D26H-N 112.782 8.336 F27H-N 118.623 7.599 V28H-N 119.117 8.567 T29H-N 124.304 9.012 C30H-N 123.969 8.859 Y31H-N 125.131 9.302 T32H-N 118.682 9.349 F33H-N 123.161 9.177 N34H-N 119.699 9.139 N34HD21-ND2 114.232 7.527 N34HD22-ND2 114.232 6.906 A35H-N 128.044 9.788 D36H-N 116.944 7.872 K37H-N 108.202 7.511 T38H-N 107.877 7.823 Y39H-N 117.837 8.503 E40H-N 118.677 8.816 V41H-N 121.838 9.097 Y42H-N 126.74 8.381 T43H-N 122.111 7.957 G44H-N 112.123 8.282 S45H-N 118.181 8.489 L47H-N 115.053 7.724 S48H-N 114.93 7.468 N49H-N 121.801 8.561 N49HD21-ND2 112.533 6.758 N49HD22-ND2 112.533 7.428 G50H-N 108.685 7.886 V51H-N 121.162 8.234 F53H-N 123.537 8.846 R54H-N 124.57 7.776 G55H-N 107.998 7.142 T56H-N 114.021 8.522 Y57H-N 115.684 8.739 I58H-N 118.048 8.972 I59H-N 124.887 8.566 S60H-N 122.768 8.913 L61H-N 129.303 8.943 D62H-N 118.454 8.63 E63H-N 115.083 7.505 K64H-N 117.578 7.833 L65H-N 119.527 7.498 I66H-N 123.527 8.963 K67H-N 125.168 8.419 L68H-N 123.218 8.534 Y69H-N 119.751 9.511 D70H-N 120.335 8.707 K71H-N 117.975 8.553 E72H-N 119.779 8.067 E73H-N 112.572 8.163 H74H-N 118.561 8.663 C75H-N 126.459 8.939 T76H-N 123.868 9.052 E77H-N 120.185 7.257 Q78H-N 118.401 8.845 Q78HE21-NE2 110.657 7.249 Q78HE22-NE2 110.657 6.418 Y79H-N 116.069 8.302 H80H-N 119.747 9.44 I81H-N 126.268 8.971 L82H-N 127.552 8.274 K83H-N 115.809 7.208 L84H-N 129.953 9.677 T85H-N 119.648 9.203 S86H-N 108.79 8.457 K87H-N 116.161 7.873 E88H-N 119.485 7.879 M89H-N 122.595 8.577 K90H-N 124.449 8.398 W91H-N 125.457 9.114 W91HE1-NE1 122.222 8.705 E92H-N 123.111 9.129 N93H-N 126.757 9.676 N93HD21-ND2 116.812 7.952 N93HD22-ND2 116.812 7.647 A94H-N 130.509 8.563 S95H-N 114.601 8.343 K97H-N 118.117 8.267 D98H-N 119.82 8.333 G99H-N 107.593 7.907 N100H-N 119.859 8.557 N100HD21-ND2 115.644 6.824 N100HD22-ND2 115.644 7.799 S101H-N 117.38 8.526 D102H-N 123.193 8.474 K103H-N 117.188 8.159 R104H-N 122.088 8.714 L105H-N 126.226 9.414 E106H-N 120.408 9.087 K107H-N 127.864 7.497 Y108H-N 127.87 8.699 N109H-N 123.534 8.065 N109HD21-ND2 113.078 6.732 N109HD22-ND2 113.078 7.44 D110H-N 125.826 7.432