Assignment w1 w2 S5H-N 117.601 8.292 D6H-N 122.987 8.331 N7H-N 118.998 8.203 E8H-N 121.864 8.298 D9H-N 121.598 8.212 N10H-N 119.644 8.112 F11H-N 122.478 8.202 D12H-N 123.861 8.24 G13H-N 109.77 7.658 D14H-N 121.388 8.135 D15H-N 121.401 8.167 F16H-N 121.474 8.049 D17H-N 123.374 8.21 D18H-N 122.486 8.142 V19H-N 121.484 7.99 E20H-N 126.53 8.423 E21H-N 124.185 8.424 D22H-N 123.492 8.397 E23H-N 123.711 8.455 G24H-N 110.947 8.478 L25H-N 122.533 8.028 D26H-N 122.148 8.285 D27H-N 121.848 8.186 L28H-N 123.39 8.097 E29H-N 122.204 8.27 N30H-N 120.712 8.293 N30HD21-ND2 114.406 7.61 N30HD22-ND2 114.406 6.845 A31H-N 125.987 8.185 E32H-N 121.122 8.316 E33H-N 123.006 8.285 E34H-N 123.487 8.396 G35H-N 111.247 8.373 Q36H-N 120.577 8.028 Q36HE21-NE2 113.718 7.48 Q36HE22-NE2 113.718 6.786 E37H-N 122.018 7.481 N38H-N 122.693 8.729 N38HD21-ND2 112.395 7.384 N38HD22-ND2 112.395 6.588 V39H-N 120.796 8.056 E40H-N 125.774 9.353 I41H-N 125.31 8.577 L42H-N 130.435 8.897 S44H-N 116.219 7.648 G45H-N 112.011 8.16 E46H-N 122.359 8.053 R47H-N 124.25 8.315 R47HE-NE 85.397 7.261 Q49H-N 122.747 8.628 Q49HE21-NE2 113.927 7.502 Q49HE22-NE2 113.927 6.78 A50H-N 127.154 8.306 N51H-N 118.5 8.399 N51HD21-ND2 113.713 7.514 N51HD22-ND2 113.713 6.817 Q52H-N 120.766 7.962 Q52HE21-NE2 113.603 7.504 Q52HE22-NE2 113.603 6.963 K53H-N 125.473 8.443 R54H-N 126.56 8.171 R54HE-NE 83.208 5.814 I55H-N 122.283 11.126 T56H-N 117.246 8.714 T57H-N 112.058 7.967 Y59H-N 120.287 7.274 M60H-N 124.852 8.255 T61H-N 124.556 9.34 K62H-N 123.029 8.814 Y63H-N 123.209 8.715 E64H-N 120.732 8.036 R65H-N 119.908 8.435 R65HE-NE 85.352 7.274 A66H-N 120.441 7.478 R67H-N 119.95 7.922 R67HE-NE 84.003 7.184 V68H-N 124.584 9.134 L69H-N 119.093 8.267 G70H-N 105.731 8.11 T71H-N 119.476 7.981 R72H-N 122.615 8.411 R72HE-NE 87.998 11.37 A73H-N 122.465 8.804 L74H-N 118.735 7.106 Q75H-N 123.316 7.422 Q75HE21-NE2 108.919 7.573 Q75HE22-NE2 108.919 6.005 I76H-N 121.866 8.373 A77H-N 126.124 8.479 M78H-N 117.3 7.471 C79H-N 111.694 7.898 A80H-N 125.576 7.971 V82H-N 123.27 8.272 M83H-N 123.406 9.838 V84H-N 110.834 6.938 E85H-N 121.914 8.326 L86H-N 125.349 8.536 E87H-N 121.8 9.509 G88H-N 107.701 8.059 E89H-N 122.596 8.435 T90H-N 112.103 8.431 D91H-N 128.385 8.464 L93H-N 119.411 7.988 L94H-N 120.64 7.543 I95H-N 122.643 8.32 A96H-N 124.266 8.201 M97H-N 117.532 8.263 K98H-N 124.19 7.794 E99H-N 120.668 8.426 L100H-N 122.74 8.674 K101H-N 121.403 8.165 A102H-N 119.272 7.344 R103H-N 115.085 7.932 R103HE-NE 86.429 7.22 K104H-N 116.586 7.977 I105H-N 121.102 7.196 I107H-N 123.87 7.819 I108H-N 126.427 8.897 I109H-N 125.115 9.099 R110H-N 130.726 9.061 R110HE-NE 90.051 10.027 R111H-N 127.688 9.226 R111HE-NE 83.694 9.161 Y112H-N 121.728 8.241 L113H-N 126.919 8.993 D115H-N 114.722 7.526 G116H-N 110.433 8.361 S117H-N 118.637 8.093 Y118H-N 113.597 7.564 E119H-N 118.631 8.997 D120H-N 125.032 8.509 W121H-N 125.119 9.57 W121HE1-NE1 128.005 9.831 G122H-N 112.735 9.938 V123H-N 124.479 8.436 D124H-N 115.344 8.737 E125H-N 118.82 7.735 L126H-N 119.887 7.074 I127H-N 122.947 8.634 I128H-N 130.171 8.45 T129H-N 121.013 8.382 D130H-N 129.341 8.028