Assignment w1 w2 Q4H-N 122.771 8.899 Q4HE21-NE2 112.558 7.39 Q4HE22-NE2 112.558 6.8 T5H-N 115.866 8.063 D6H-N 124.653 8.499 I7H-N 119.741 7.799 S8H-N 121.92 8.85 V9H-N 125.845 8.452 S10H-N 121.312 8.624 L11H-N 124.101 8.443 L12H-N 124.363 8.977 K13H-N 121.228 8.151 F16H-N 123.773 8.348 W20H-N 119.035 8.275 T21H-N 122.056 8.47 Q23H-N 123.024 8.638 Q23HE21-NE2 112.505 7.322 Q23HE22-NE2 112.505 6.651 T24H-N 110.779 7.402 T26H-N 116.103 7.874 V28H-N 125.545 7.502 C29H-N 128.977 9.907 E30H-N 126.688 9.217 I31H-N 130.021 9.119 V32H-N 127.671 8.723 Y33H-N 125.563 9.114 S34H-N 111.556 8.342 D35H-N 118.304 8.672 L36H-N 117.764 7.357 E37H-N 120.855 9.557 N38H-N 122.459 9.124 N38HD21-ND2 115.842 7.941 N38HD22-ND2 115.842 6.9 I39H-N 119.708 7.252 K40H-N 128.321 8.76 V41H-N 121.679 7.902 F42H-N 126.8 9.352 W43H-N 119.314 8.847 W43HE1-NE1 127.902 9.966 Q44H-N 118.782 9.376 V45H-N 121.659 8.796 N46H-N 128.796 9.628 G47H-N 102.032 8.82 V48H-N 120.265 7.529 E49H-N 128.059 8.851 R50H-N 128.391 8.704 K51H-N 124.441 8.772 K52H-N 122.374 7.752 G53H-N 112.97 8.832 V54H-N 120.474 7.004 E55H-N 129.276 9.091 T56H-N 126.675 9.162 Q57H-N 127.368 8.638 Q57HE21-NE2 111.875 7.557 Q57HE22-NE2 111.875 6.896 N58H-N 118.031 8.398 N58HD21-ND2 109.463 7.317 N58HD22-ND2 109.463 6.553 E60H-N 122.445 8.704 W61H-N 125.833 8.817 S62H-N 120.682 8.551 G63H-N 112.655 6.895 K65H-N 120.463 7.441 S66H-N 117.984 8.522 T67H-N 115.663 8.354 I68H-N 127.394 9.529 V69H-N 125.903 7.253 S70H-N 121.681 9.302 K71H-N 127.421 9.029 L72H-N 124.252 8.407 K73H-N 128.141 8.09 V74H-N 121.453 8.73 M75H-N 119.151 8.724 A76H-N 127.351 8.46 S77H-N 110.202 8.46 E78H-N 124.828 7.336 W79H-N 123.252 7.469 W79HE1-NE1 129.058 10.504 D80H-N 116.114 8.816 S81H-N 112.692 7.393 G82H-N 108.811 7.587 T83H-N 116.253 6.788 E84H-N 124.967 8.006 Y85H-N 127.327 8.993 V86H-N 121.985 8.873 C87H-N 127.376 8.312 L88H-N 127.118 8.837 V89H-N 120.421 8.687 E90H-N 122.482 8.551 D91H-N 119.348 7.98 S92H-N 121.504 7.973 E93H-N 121.008 9.782 L94H-N 121.375 7.802 T96H-N 109.657 7.094 V98H-N 122.997 8.358 K99H-N 122.194 8.34 A100H-N 123.875 8.6 S101H-N 114.189 8.367 I102H-N 121.742 9.317 R103H-N 120.111 7.525 K104H-N 126.177 9.077 A105H-N 133.927 7.874