Assignment w1 w2 D2H-N 120.661 8.626 D3H-N 119.152 8.424 D4H-N 119.647 7.998 E5H-N 121.98 8.101 G7H-N 109.549 8.529 G8H-N 108.461 8.144 K9H-N 119.936 8.089 G10H-N 107.507 8.33 A11H-N 121.186 8.177 M12H-N 118.348 7.708 Y13H-N 118.821 8.075 E14H-N 121.324 8.465 V15H-N 123.502 9.443 T16H-N 118.576 9.124 I17H-N 124.351 9.023 E18H-N 125.259 8.602 Q19H-N 123.95 9.418 Q19HE21-NE2 112.127 6.838 Q19HE22-NE2 112.127 7.126 S20H-N 114.358 8.954 G21H-N 109.346 9.006 D22H-N 126.409 8.273 F23H-N 116.268 7.833 R24H-N 121.463 8.103 S25H-N 113.672 7.399 F26H-N 118.894 6.909 I27H-N 123.975 8.95 K28H-N 131.216 10.059 S29H-N 114.165 8.347 V30H-N 123.94 8.247 V31H-N 127.113 9.194 V32H-N 127.99 9.056 V33H-N 126.994 8.718 A34H-N 128.089 8.746 N35H-N 119.68 7.857 N35HD21-ND2 111.98 6.839 N35HD22-ND2 111.98 8.095 G36H-N 113.112 8.779 T37H-N 114.086 7.553 Q38H-N 119.203 8.1 Q38HE21-NE2 110.825 7.176 Q38HE22-NE2 110.825 6.712 L39H-N 120.932 8.924 K40H-N 121.508 9.478 D41H-N 127.693 8.526 G42H-N 115.554 8.831 A43H-N 122.215 8.647 T44H-N 105.783 7.766 G45H-N 111.388 8.385 E46H-N 120.992 7.817 S47H-N 117.885 8.466 L48H-N 127.192 9.501 A49H-N 123.115 8.131 S50H-N 112.472 8.315 V52H-N 122.574 9.022 I53H-N 127.591 8.381 L54H-N 129.185 9.645 S55H-N 120.367 8.932 D56H-N 119.741 8.369 E57H-N 117.479 8.329 E58H-N 118.716 7.789 L59H-N 116.833 7.746 A60H-N 121.791 7.294 V61H-N 109.641 6.768 E62H-N 117.682 8.648 K63H-N 117.306 7.435 V64H-N 125.885 8.528 T65H-N 122.384 8.858 L66H-N 125.107 8.796 S67H-N 114.475 8.358 T68H-N 114.239 9.039 T69H-N 115.512 8.626 G70H-N 112.649 7.585 K71H-N 120.451 8.301 A72H-N 123.707 9.155 I73H-N 120.092 8.625 E74H-N 115.157 7.302 F75H-N 124.407 8.665 A76H-N 128.56 8.537 V77H-N 119.281 8.159 S78H-N 121.585 9.014 G79H-N 107.939 8.421 G80H-N 106.729 8.883 V81H-N 115.409 7.33 V82H-N 119.898 8.512 D83H-N 124.374 8.378 G84H-N 115.997 8.253 E85H-N 121.282 8.568 D86H-N 130.428 9.121 G87H-N 108.493 8.612 V88H-N 118.928 6.862 V89H-N 131.792 8.96 N90H-N 129.808 9.072 N90HD21-ND2 114.123 6.768 N90HD22-ND2 114.123 7.231 E91H-N 123.165 8.741 M93H-N 116.804 8.643 Q94H-N 119.277 8.198 Q94HE22-NE2 109.311 6.564 W95H-N 123.846 8.952 W95HE1-NE1 129.873 11.274 V96H-N 120.922 8.795 V97H-N 132.918 9.483 T98H-N 123.728 8.862 V99H-N 124.895 8.576 Y100H-N 126.192 9.312 K101H-N 122.676 8.883 N102H-N 128.486 9.602 N102HD21-ND2 115.042 7.199 N102HD22-ND2 115.042 7.694 G103H-N 102.973 8.852 K104H-N 120.846 7.613 E105H-N 127.209 8.964 I106H-N 121.621 8.931 E107H-N 123.222 7.439 K108H-N 126.67 8.502 K109H-N 128.071 9.371 S110H-N 120.162 8.598 L111H-N 127.535 9.365 V112H-N 121.571 7.803 F113H-N 125.54 8.342 R114H-N 119.643 8.595 D115H-N 117.466 8.897 G116H-N 115.618 10.313 K117H-N 121.755 7.592 E118H-N 129.965 8.832 I119H-N 124.567 7.812 S120H-N 120.17 8.197 T121H-N 115.284 8.387 D122H-N 121.007 8.33 D123H-N 121.462 8.191 L124H-N 117.572 7.721 N125H-N 125.852 9.065 N125HD21-ND2 112.256 6.739 N125HD22-ND2 112.256 7.608 L126H-N 124.201 9.033 Y127H-N 124.562 7.812 Y128H-N 126.347 8.39 N129H-N 123.791 7.799 N129HD21-ND2 110.708 6.711 N129HD22-ND2 110.708 7.314