Assignment w1 w2 A2H-N 129.568 6.755 C3H-N 112.476 8.038 K4H-N 121.282 10.031 T5H-N 109.346 8.811 A6H-N 123.422 8.687 N7H-N 112.742 8.133 N7HD21-ND2 112.43 7.098 N7HD22-ND2 112.43 7.836 G8H-N 107.602 8.093 T9H-N 118.246 7.785 A10H-N 128.049 8.729 I11H-N 120.457 8.504 I13H-N 116.188 7.814 G14H-N 116.542 8.126 G15H-N 108.704 7.652 G16H-N 104.037 7.621 S17H-N 115.482 8.349 A18H-N 122.099 8.565 N19H-N 118.886 8.685 N19HD21-ND2 112.201 6.951 N19HD22-ND2 112.201 7.406 V20H-N 124.043 9.507 Y21H-N 128.414 8.874 V22H-N 116.063 8.761 N23H-N 124.107 8.916 N23HD21-ND2 113.944 7.106 N23HD22-ND2 113.944 7.662 L24H-N 124.445 9.093 A25H-N 128.81 7.91 V27H-N 117.876 7.349 V28H-N 126.29 8.64 N29H-N 121.474 8.127 N29HD21-ND2 111.384 6.835 N29HD22-ND2 111.384 7.326 V30H-N 119.459 8.633 G31H-N 115.179 8.805 Q32H-N 119.807 8.126 Q32HE21-NE2 113.127 6.928 Q32HE22-NE2 113.127 7.671 N33H-N 116.734 8.534 N33HD21-ND2 111.793 6.893 N33HD22-ND2 111.793 7.465 L34H-N 126.36 9.849 V35H-N 127.398 8.636 V36H-N 129.131 8.946 D37H-N 126.54 8.998 L38H-N 125.201 8.506 S39H-N 120.216 8.728 T40H-N 105.556 6.668 Q41H-N 117.063 7.596 Q41HE21-NE2 111.866 6.809 Q41HE22-NE2 111.866 7.495 I42H-N 117.897 7.211 F43H-N 123.316 8.572 C44H-N 117.716 9.205 H45H-N 112.267 7.415 N46H-N 118.336 7.857 D47H-N 123.14 8.853 Y48H-N 118.77 9.473 E50H-N 119.744 9.169 T51H-N 108.805 7.285 I52H-N 122.969 8.303 T53H-N 125.042 8.786 D54H-N 124.418 6.806 Y55H-N 121.243 8.655 V56H-N 121.797 9.272 T57H-N 123.627 9.669 L58H-N 120.101 7.428 Q59H-N 130.77 9.205 Q59HE21-NE2 108.325 6.608 Q59HE22-NE2 108.325 7.22 R60H-N 112.716 7.125 R60HE-NE 84.147 7.086 G61H-N 112.581 9.34 S62H-N 122.248 9.174 A63H-N 125.61 8.13 Y64H-N 116.075 7.645 G65H-N 108.328 8.951 G66H-N 114.431 9.655 V67H-N 119.656 7.69 L68H-N 118.517 6.581 S69H-N 109.1 7.893 N70H-N 114.166 8.116 N70HD21-ND2 116.563 7.356 N70HD22-ND2 116.563 7.913 F71H-N 116.84 7.864 S72H-N 115.18 9.208 G73H-N 109.491 8.944 T74H-N 111.841 8.702 V75H-N 119.6 9.594 K76H-N 128.187 9.496 Y77H-N 125.239 9.357 S78H-N 125.047 8.897 G79H-N 105.013 8.733 S80H-N 117.05 7.526 S81H-N 117.879 8.319 Y82H-N 123.653 9.227 F84H-N 119.225 7.516 T86H-N 113.369 8.356 T87H-N 110.091 8.801 S88H-N 116.157 7.696 E89H-N 124.424 8.417 T90H-N 116.76 7.576 R92H-N 117.462 8.241 R92HE-NE 83.495 7.03 V93H-N 121.091 9.256 V94H-N 125.167 8.502 Y95H-N 126.031 9.068 N96H-N 124.316 9.173 N96HD21-ND2 110.293 6.876 N96HD22-ND2 110.293 7.627 S97H-N 109.291 7.357 R98H-N 129.042 9.482 R98HE-NE 84.921 7.078 T99H-N 116.881 8.351 D100H-N 126.103 8.498 K101H-N 124.431 9.383 W103H-N 128.336 8.357 W103HE1-NE1 127.967 9.05 V105H-N 125.64 8.123 A106H-N 125.791 8.376 L107H-N 119.952 8.669 Y108H-N 123.128 8.965 L109H-N 124.816 9.024 T110H-N 120.212 9.651 V112H-N 118.104 8.103 S113H-N 114.684 8.33 S114H-N 112.588 7.726 A115H-N 125.838 7.75 G116H-N 106.371 8.128 G117H-N 111.609 8.661 V118H-N 122.391 8.637 A119H-N 134.633 9.112 I120H-N 115.644 7.637 K121H-N 125.543 8.421 A122H-N 128.859 9.839 G123H-N 111.618 9.075 S124H-N 114.86 8.077 L125H-N 123.798 8.244 I126H-N 119.576 9.087 A127H-N 120.087 7.727 V128H-N 119.05 8.559 L129H-N 128.439 9.406 I130H-N 121.548 9.082 L131H-N 134.404 9.338 R132H-N 130.085 9.104 R132HE-NE 86.609 8.756 Q133H-N 132.716 9.43 Q133HE21-NE2 108.57 5.087 Q133HE22-NE2 108.57 5.085 T134H-N 117.42 8.774 N135H-N 117.434 9.824 N135HD21-ND2 120.451 10.761 N135HD22-ND2 120.451 10.759 N136H-N 116.805 8.152 N136HD21-ND2 112.778 5.071 N136HD22-ND2 112.778 5.072 Y137H-N 123.39 9.14 N138H-N 122.165 9.712 N138HD21-ND2 121.364 10.924 N138HD22-ND2 121.364 10.918 S139H-N 111.818 7.792 D140H-N 124.069 7.717 D141H-N 121.25 6.801 F142H-N 123.137 9.0 Q143H-N 117.754 8.801 Q143HE21-NE2 112.123 6.601 Q143HE22-NE2 112.123 7.778 F144H-N 127.488 10.006 V145H-N 125.065 8.81 W146H-N 126.687 8.758 W146HE1-NE1 122.482 7.095 N147H-N 124.963 9.017 N147HD21-ND2 110.091 6.303 N147HD22-ND2 110.091 6.674 I148H-N 124.402 9.248 Y149H-N 127.26 9.328 A150H-N 122.156 8.568 N151H-N 120.028 9.137 N151HD21-ND2 109.153 6.558 N151HD22-ND2 109.153 7.414 N152H-N 110.772 7.402 N152HD21-ND2 114.998 7.175 N152HD22-ND2 114.998 7.242 D153H-N 117.1 8.48 V154H-N 120.97 8.842 V155H-N 128.338 8.732 V156H-N 126.97 8.526 T158H-N 118.858 7.729