Assignment w1 w2 S3H-N 113.663 8.301 D4H-N 121.532 7.874 F5H-N 119.126 7.832 Q6H-N 122.092 8.447 Q6HE21-NE2 112.759 7.581 Q6HE22-NE2 112.759 6.778 T7H-N 114.717 8.145 G8H-N 111.628 9.234 I9H-N 119.585 8.603 H10H-N 133.616 8.599 K11H-N 122.949 8.775 I12H-N 125.26 8.578 V13H-N 126.515 9.052 I14H-N 125.803 8.974 Q15H-N 125.773 9.244 Q15HE21-NE2 109.793 6.607 Q15HE22-NE2 109.793 7.081 Q16H-N 119.832 8.964 Q16HE21-NE2 104.398 6.813 Q16HE22-NE2 104.398 5.706 S17H-N 115.201 8.77 G18H-N 109.321 8.798 D19H-N 128.121 9.708 T20H-N 111.61 8.136 D21H-N 118.304 8.566 S22H-N 114.253 8.076 F23H-N 119.853 7.611 E24H-N 119.255 8.958 V25H-N 130.637 9.678 S26H-N 122.555 8.883 V27H-N 113.682 8.493 S28H-N 116.852 8.709 I29H-N 128.765 9.631 G30H-N 112.478 8.095 G31H-N 108.502 9.755 A32H-N 122.02 7.338 D33H-N 121.217 8.945 K34H-N 117.693 8.2 G35H-N 106.697 8.653 G36H-N 110.824 7.601 A38H-N 127.841 7.486 K39H-N 121.148 8.042 L40H-N 118.817 7.901 Y41H-N 117.843 9.109 N42H-N 117.689 8.239 N42HD21-ND2 113.755 7.948 N42HD22-ND2 113.755 7.765 D43H-N 116.76 8.65 K44H-N 118.108 7.505 G45H-N 108.163 8.117 E46H-N 120.173 7.884 Y47H-N 123.803 8.71 I48H-N 123.458 8.416 G49H-N 107.257 5.472 D50H-N 116.887 8.234 S51H-N 112.664 7.689 Y52H-N 122.672 8.231 S53H-N 123.803 8.008 A54H-N 125.516 8.089 Q55H-N 118.838 8.1 Q55HE21-NE2 111.128 6.789 Q55HE22-NE2 111.128 7.711 I56H-N 124.748 8.91 R57H-N 127.183 8.979 T58H-N 109.995 7.15 A59H-N 123.143 8.531 T60H-N 105.988 7.521 M61H-N 124.706 8.758 S62H-N 117.004 8.164 C63H-N 120.27 8.537 C64H-N 120.868 9.307 T65H-N 109.83 8.447 N66H-N 114.459 9.3 N66HD21-ND2 112.832 7.642 N66HD22-ND2 112.832 7.168 G67H-N 103.647 8.237 A69H-N 121.911 7.677 F70H-N 114.118 8.549 F71H-N 110.252 6.617 M72H-N 118.637 8.162 T73H-N 117.278 9.22 C74H-N 124.101 8.958 A75H-N 132.901 8.834 G76H-N 110.691 8.265 S77H-N 115.145 8.723 V78H-N 124.775 8.963 S79H-N 118.951 8.661 S80H-N 114.75 8.563 I81H-N 120.003 8.366 S82H-N 119.139 8.204 E83H-N 118.35 8.381 A84H-N 121.665 8.482 G85H-N 108.356 8.078 K86H-N 121.491 8.225 R87H-N 121.874 9.979 L88H-N 125.264 8.756 H89H-N 125.453 8.91 I90H-N 126.486 8.689 T91H-N 123.2 8.636 V92H-N 127.071 9.162 I93H-N 127.095 9.313 G94H-N 111.893 8.577 Y95H-N 123.099 9.64 I96H-N 116.705 8.27 D97H-N 130.442 9.849 D98H-N 114.957 8.355 K99H-N 121.68 8.049 E100H-N 127.574 8.839 V101H-N 120.606 8.997 N102H-N 118.568 7.598 N102HD21-ND2 110.65 6.69 N102HD22-ND2 110.65 7.564 R103H-N 120.366 8.155 L104H-N 128.859 9.271 E105H-N 125.663 8.346 K106H-N 123.659 8.526 E107H-N 121.917 7.773 Y108H-N 124.981 9.031 I109H-N 121.68 8.475 T110H-N 117.537 9.18 D111H-N 122.428 9.342 G112H-N 110.714 8.333 N113H-N 119.462 8.21 N113HD21-ND2 115.479 7.551 N113HD22-ND2 115.479 6.864 T114H-N 117.962 8.436 L115H-N 132.998 8.789 I116H-N 126.586 8.637 E117H-N 127.084 8.933 T118H-N 110.826 8.664 F119H-N 115.915 8.087 S120H-N 114.953 8.627 V121H-N 124.122 8.866 S122H-N 119.703 8.334 T123H-N 113.276 8.898 K124H-N 119.191 7.569 E125H-N 124.243 8.359 I126H-N 126.888 7.674