Assignment w1 w2 A2H-N 125.964 8.065 D3H-N 119.188 8.203 D4H-N 121.607 7.954 S6H-N 115.864 8.31 A7H-N 125.955 7.854 A8H-N 122.354 7.91 D9H-N 119.431 7.97 R10H-N 122.263 8.036 N11H-N 118.325 8.077 N11HD21-ND2 113.788 7.547 N11HD22-ND2 113.788 6.783 V12H-N 122.103 7.741 E13H-N 120.785 7.751 I14H-N 120.199 7.65 W15H-N 120.828 7.759 W15HE1-NE1 129.716 9.952 K16H-N 119.063 7.963 I17H-N 120.609 7.63 K18H-N 121.687 8.297 K19H-N 119.253 7.685 L20H-N 123.001 7.509 I21H-N 119.392 8.474 K22H-N 117.524 7.3 S23H-N 114.88 7.653 L24H-N 121.607 8.158 E25H-N 119.392 8.344 A26H-N 119.228 7.154 A27H-N 121.417 6.833 R28H-N 123.986 8.679 G29H-N 109.466 8.091 N30H-N 120.048 8.419 N30HD21-ND2 112.643 7.459 N30HD22-ND2 112.643 6.65 G31H-N 110.45 8.071 T32H-N 112.929 7.747 S33H-N 115.208 7.701 M34H-N 120.869 8.679 I35H-N 126.806 9.562 S36H-N 122.217 8.422 L37H-N 128.938 8.916 I38H-N 128.296 8.74 I39H-N 125.429 8.96 K42H-N 113.683 8.004 D43H-N 121.628 7.29 Q44H-N 117.587 9.61 Q44HE21-NE2 113.287 7.275 Q44HE22-NE2 113.287 6.625 I45H-N 126.939 8.806 S46H-N 113.239 8.476 R47H-N 124.53 6.731 V48H-N 121.935 7.257 A49H-N 122.345 8.864 K50H-N 120.376 7.38 M51H-N 121.641 7.508 L52H-N 120.125 8.203 A53H-N 123.639 7.775 D54H-N 123.165 8.156 E55H-N 122.017 8.221 F56H-N 123.334 8.711 G57H-N 107.156 7.985 T58H-N 118.94 7.992 A59H-N 126.365 8.351 S60H-N 112.435 7.459 N61H-N 116.971 7.372 N61HD21-ND2 114.742 7.351 N61HD22-ND2 114.742 6.838 I62H-N 123.98 7.461 K63H-N 128.982 8.417 S64H-N 114.306 7.599 R65H-N 132.125 8.689 V66H-N 116.947 7.946 N67H-N 119.499 7.386 N67HD21-ND2 111.758 7.345 N67HD22-ND2 111.758 6.772 R68H-N 122.132 8.566 L69H-N 116.564 8.167 S70H-N 116.805 7.589 V71H-N 124.991 7.934 L72H-N 118.68 8.354 G73H-N 106.674 8.052 A74H-N 127.313 7.784 I75H-N 119.31 8.638 T76H-N 116.205 8.317 S77H-N 118.405 7.843 V78H-N 124.171 8.153 Q79H-N 120.008 8.688 Q79HE21-NE2 109.947 6.918 Q79HE22-NE2 109.947 6.485 Q80H-N 116.87 7.85 Q80HE21-NE2 112.595 7.207 Q80HE22-NE2 112.595 6.717 R81H-N 119.074 7.52 L82H-N 117.238 8.189 K83H-N 114.899 7.064 L84H-N 117.84 7.271 Y85H-N 119.72 7.633 N86H-N 119.638 8.622 N86HD21-ND2 113.597 7.463 N86HD22-ND2 113.597 6.773 K87H-N 116.321 7.631 V88H-N 125.141 8.357 N91H-N 112.735 9.163 N91HD21-ND2 107.791 6.918 N91HD22-ND2 107.791 6.107 G92H-N 108.893 7.898 L93H-N 117.751 8.508 V94H-N 126.296 8.168 V95H-N 125.531 8.744 Y96H-N 123.577 8.698 C97H-N 120.144 8.796 G98H-N 112.534 8.776 T99H-N 119.083 8.168 I100H-N 122.25 8.838 V101H-N 120.622 8.31 T102H-N 118.661 8.867 E103H-N 121.906 9.243 E104H-N 116.013 7.716 G105H-N 109.001 8.045 K106H-N 119.559 6.924 E107H-N 121.771 8.371 K108H-N 125.216 8.946 K109H-N 125.136 8.548 V110H-N 125.626 8.85 N111H-N 126.837 8.711 N111HD21-ND2 111.927 7.533 N111HD22-ND2 111.927 6.388 I112H-N 125.729 8.931 D113H-N 122.734 8.116 F114H-N 116.385 8.613 E115H-N 124.642 8.591 F117H-N 116.676 7.842 K118H-N 118.589 6.889 I120H-N 121.968 7.44 N121H-N 120.951 8.112 N121HD21-ND2 113.096 6.572 N121HD22-ND2 113.096 7.341 Q122H-N 118.826 7.009 Q122HE21-NE2 112.607 7.389 Q122HE22-NE2 112.607 6.708 F123H-N 122.795 8.335 M124H-N 126.99 7.992 Y125H-N 122.216 7.552 F126H-N 124.584 8.271 C127H-N 124.011 8.442 D128H-N 127.486 8.907 N129H-N 119.092 9.136 N129HD21-ND2 110.722 7.334 N129HD22-ND2 110.722 6.527 K130H-N 114.367 7.115 F131H-N 121.117 9.291 H132H-N 121.897 9.026 T133H-N 117.915 8.7 E134H-N 129.072 10.805 A135H-N 122.099 8.59 L136H-N 116.72 7.471 T137H-N 117.177 8.044 A138H-N 124.719 7.695 L139H-N 120.059 7.345 L140H-N 117.771 7.748 S141H-N 114.778 7.807 D142H-N 121.827 7.878 L143H-N 120.22 7.846 E144H-N 117.664 7.862