Assignment w1 w2 S2H-N 115.842 8.289 S3H-N 117.93 8.49 G4H-N 110.985 8.482 G7H-N 110.615 8.419 N8H-N 118.602 8.322 N8HD21-ND2 112.743 7.649 N8HD22-ND2 112.743 6.973 D9H-N 120.504 8.37 N10H-N 119.406 8.382 N10HD21-ND2 112.695 7.647 N10HD22-ND2 112.695 6.97 R11H-N 121.145 7.942 V13H-N 118.395 8.252 F14H-N 122.95 8.725 K15H-N 123.863 8.885 E16H-N 117.026 8.091 G17H-N 109.577 8.421 Q18H-N 120.202 7.858 Q18HE21-NE2 111.863 7.508 Q18HE22-NE2 111.863 6.782 V19H-N 121.257 8.216 E20H-N 127.095 8.61 V21H-N 120.489 8.727 H22H-N 124.991 8.68 I23H-N 123.121 9.179 E25H-N 117.706 8.399 N26H-N 112.383 7.488 N26HD21-ND2 111.194 7.698 N26HD22-ND2 111.194 6.965 A27H-N 125.139 7.716 V29H-N 123.592 8.691 G30H-N 116.042 9.197 T31H-N 117.679 7.838 S32H-N 123.045 9.022 V33H-N 126.861 9.202 I34H-N 111.445 7.074 Q35H-N 127.342 8.45 Q35HE21-NE2 113.225 7.717 Q35HE22-NE2 113.225 6.586 L36H-N 128.895 7.761 H37H-N 115.903 8.529 A38H-N 128.891 8.474 T39H-N 110.982 8.095 D40H-N 121.45 8.417 A41H-N 124.607 8.435 D42H-N 118.03 8.31 I43H-N 119.301 8.0 G44H-N 111.333 8.448 S45H-N 115.551 8.061 N46H-N 120.698 8.547 N46HD21-ND2 113.089 6.918 N46HD22-ND2 113.089 7.608 A47H-N 124.093 8.239 E48H-N 119.75 8.376 I49H-N 122.772 7.806 R50H-N 126.912 8.247 Y51H-N 121.627 9.041 I52H-N 117.697 8.85 F53H-N 121.433 8.748 G54H-N 106.444 8.538 A55H-N 123.47 8.594 Q56H-N 114.221 8.727 Q56HE21-NE2 112.709 7.575 Q56HE22-NE2 112.709 6.854 V57H-N 121.341 7.204 A58H-N 132.726 8.92 A60H-N 117.882 8.706 T61H-N 114.483 7.312 K62H-N 118.994 7.556 R63H-N 114.251 7.474 L64H-N 116.109 6.991 F65H-N 116.182 7.673 A66H-N 122.87 8.914 L67H-N 122.208 8.498 N68H-N 126.94 8.357 N68HD21-ND2 115.463 7.724 N68HD22-ND2 115.463 7.188 N69H-N 124.98 8.861 N69HD21-ND2 110.727 8.156 N69HD22-ND2 110.727 7.064 T70H-N 110.394 8.635 T71H-N 110.507 8.069 G72H-N 110.788 7.99 L73H-N 119.222 7.138 I74H-N 129.871 8.925 T75H-N 117.522 9.161 V76H-N 120.876 8.327 Q77H-N 129.825 9.525 Q77HE21-NE2 111.466 6.761 Q77HE22-NE2 111.466 6.46 R78H-N 120.595 7.621 S79H-N 112.565 7.958 L80H-N 123.07 8.715 D81H-N 115.229 7.298 R82H-N 123.174 9.289 R82HE-NE 83.988 7.443 E83H-N 119.549 8.468 E84H-N 118.333 8.033 T85H-N 112.444 7.651 A86H-N 127.705 8.639 I87H-N 118.712 7.663 H88H-N 126.285 9.098 K89H-N 124.332 8.957 V90H-N 124.319 9.174 T91H-N 122.637 6.697 V92H-N 128.265 9.292 L93H-N 126.35 9.495 A94H-N 123.429 8.688 S95H-N 114.418 8.401 D96H-N 125.624 8.69 G97H-N 109.283 8.524 S98H-N 116.64 8.575 S99H-N 117.676 8.945 T100H-N 118.401 8.411 A102H-N 124.487 8.497 R103H-N 119.596 8.663 A104H-N 126.962 9.027 T105H-N 115.327 8.384 V106H-N 126.226 8.97 T107H-N 125.403 8.833 I108H-N 127.152 9.234 N109H-N 126.866 8.723 N109HD21-ND2 113.452 7.317 N109HD22-ND2 113.452 6.131 V110H-N 126.07 9.046 T111H-N 121.425 9.197 D112H-N 119.566 8.435 V113H-N 119.356 8.629 N114H-N 127.458 8.093 N114HD21-ND2 113.052 7.544 N114HD22-ND2 113.052 6.839