Assignment w1 w2 S3H-N 117.997 8.586 N4H-N 120.603 8.639 I5H-N 120.265 8.35 Q6H-N 120.964 8.463 D7H-N 121.23 8.409 N8H-N 117.821 8.546 C9H-N 124.15 9.597 Q10H-N 113.072 7.69 Q10HE21-NE2 110.384 7.231 Q10HE22-NE2 110.384 6.776 V11H-N 119.641 8.818 T12H-N 119.823 8.031 N13H-N 120.781 8.223 N13HD21-ND2 117.83 7.326 N13HD22-ND2 117.83 9.49 A15H-N 117.756 7.805 T16H-N 103.143 6.824 G17H-N 111.757 8.804 H18H-N 119.497 7.916 L19H-N 128.901 7.824 F20H-N 126.611 9.377 D21H-N 120.778 8.533 L22H-N 125.923 8.207 N23H-N 119.34 9.016 N23HD21-ND2 116.298 7.208 N23HD22-ND2 116.298 8.75 S24H-N 113.76 8.753 L25H-N 119.354 7.873 K26H-N 121.883 7.549 N27H-N 120.839 8.059 D28H-N 121.237 8.802 S29H-N 114.17 8.349 G30H-N 110.443 8.123 Y31H-N 118.967 9.177 S32H-N 117.473 8.897 V33H-N 121.357 9.134 A34H-N 127.649 8.554 Y35H-N 117.441 8.657 S36H-N 117.091 7.602 E37H-N 119.616 7.377 K38H-N 116.211 7.987 G39H-N 109.183 7.941 L40H-N 122.578 8.38 I41H-N 122.705 8.759 Y42H-N 125.305 8.867 I43H-N 117.419 8.661 G44H-N 113.165 9.358 I45H-N 123.27 8.839 C46H-N 118.394 8.108 G47H-N 101.392 6.859 G48H-N 99.938 6.681 T49H-N 110.567 8.57 K50H-N 123.879 8.104 N51H-N 115.343 7.646 C52H-N 115.723 7.685 S54H-N 114.626 8.42 G55H-N 114.877 9.734 V56H-N 123.637 8.431 G57H-N 116.593 10.067 V58H-N 119.575 7.531 C59H-N 119.594 9.188 F60H-N 116.074 7.966 G61H-N 107.872 8.633 L62H-N 120.831 8.928 T63H-N 105.821 7.982 K64H-N 118.395 7.799 I65H-N 121.72 7.765 N66H-N 123.253 7.984 N66HD21-ND2 107.991 6.401 N66HD22-ND2 107.991 7.546 A67H-N 131.821 9.254 G68H-N 108.131 8.81 S69H-N 125.709 9.044 W70H-N 121.102 7.072 W70HE1-NE1 129.513 10.396 N71H-N 113.992 7.388 N71HD21-ND2 111.586 6.821 N71HD22-ND2 111.586 7.523 S72H-N 112.333 9.005 Q73H-N 124.227 8.644 Q73HE21-NE2 112.299 6.946 Q73HE22-NE2 112.299 7.675 L74H-N 129.642 8.311 M75H-N 123.84 9.097 Y76H-N 124.114 8.996 V77H-N 128.17 8.621 D78H-N 126.619 8.985 Q79H-N 104.883 6.788 V80H-N 120.496 7.605 L81H-N 124.087 8.392 Q82H-N 121.203 9.35 Q82HE21-NE2 108.656 6.617 Q82HE22-NE2 108.656 6.719 L83H-N 122.358 8.828 V84H-N 121.361 9.596 Y85H-N 130.168 9.671 D86H-N 123.929 8.457 D87H-N 115.937 9.734 G88H-N 105.496 8.082 A89H-N 120.522 9.102 C91H-N 122.692 8.327 S93H-N 114.73 7.677 K94H-N 122.002 7.998 N95H-N 118.824 8.498 A96H-N 120.613 8.09 L97H-N 118.987 7.978 K98H-N 120.652 8.077 Y99H-N 118.74 8.886 K100H-N 116.4 8.469 S101H-N 116.094 9.053 V102H-N 125.119 9.278 I103H-N 128.557 9.238 S104H-N 121.254 8.144 F105H-N 123.742 9.577 V106H-N 121.11 8.38 C107H-N 124.316 9.105 T108H-N 121.145 6.804 H109H-N 121.079 8.714 D110H-N 122.244 8.401 S111H-N 119.254 8.729 G112H-N 110.514 8.648 A113H-N 123.174 7.895 N114H-N 119.979 8.375 N114HD21-ND2 112.411 6.223 N114HD22-ND2 112.411 7.496 N115H-N 120.339 8.547 N115HD21-ND2 111.525 7.018 N115HD22-ND2 111.525 7.819 K116H-N 118.843 7.592 V118H-N 116.512 8.956 F119H-N 125.642 8.91 V120H-N 129.678 8.489 S121H-N 108.972 6.702 L122H-N 122.445 8.34 D123H-N 126.904 9.459 K124H-N 126.592 9.036 Q125H-N 116.274 8.539 T126H-N 104.122 7.188 C127H-N 116.813 8.022 T128H-N 110.554 7.455 L129H-N 129.815 9.41 Y130H-N 118.151 8.668 F131H-N 118.515 9.168 S132H-N 117.298 9.235 W133H-N 127.919 9.023 W133HE1-NE1 127.188 9.695 H134H-N 127.884 9.585 T135H-N 121.136 9.22 L137H-N 118.975 8.472 A138H-N 117.1 7.403 C139H-N 116.796 7.613 E140H-N 122.921 8.995 K141H-N 121.714 8.121 E142H-N 123.334 8.58 E143H-N 124.783 8.608 R145H-N 120.207 8.461 R145HE-NE 84.578 7.261 H146H-N 118.881 8.378 H147H-N 125.423 8.351