Assignment w1 w2 S2H-N 115.751 8.695 Q3H-N 122.346 8.618 G4H-N 109.885 8.431 H5H-N 117.765 8.342 D6H-N 121.91 8.518 T7H-N 116.925 8.25 V8H-N 119.837 7.798 Q9H-N 127.192 8.472 Q9HE21-NE2 114.158 7.044 Q9HE22-NE2 114.158 7.888 N11H-N 119.013 8.972 N11HD21-ND2 112.57 6.972 N11HD22-ND2 112.57 7.666 F12H-N 119.073 7.996 Q13H-N 128.226 7.402 Q13HE21-NE2 112.628 6.917 Q13HE22-NE2 112.628 7.423 Q14H-N 124.702 8.736 D15H-N 114.027 8.628 K16H-N 116.638 6.859 F17H-N 119.221 7.454 L18H-N 112.003 6.674 G19H-N 107.87 8.876 R20H-N 121.873 8.678 W21H-N 130.676 9.32 W21HE1-NE1 130.608 9.733 Y22H-N 117.926 9.661 S23H-N 119.038 9.249 A24H-N 126.183 8.724 G25H-N 107.738 7.82 L26H-N 125.132 9.082 A27H-N 123.65 8.854 S28H-N 113.858 7.321 N29H-N 120.399 7.743 N29HD21-ND2 110.09 7.18 N29HD22-ND2 110.09 7.69 S30H-N 116.012 8.156 S31H-N 120.999 9.142 W32H-N 121.477 8.03 W32HE1-NE1 129.897 10.191 F33H-N 120.174 7.333 R34H-N 117.452 7.86 E35H-N 116.049 7.715 K36H-N 116.955 7.614 K37H-N 118.551 7.546 A38H-N 118.227 7.94 V39H-N 111.011 7.917 L40H-N 121.749 6.773 Y41H-N 118.215 8.277 M42H-N 122.104 8.749 A43H-N 126.545 7.715 K44H-N 122.33 8.405 T45H-N 125.471 9.398 V46H-N 126.96 9.026 V47H-N 130.792 9.346 A48H-N 133.796 9.268 S50H-N 117.492 8.025 T51H-N 116.878 8.73 E52H-N 118.204 8.151 G53H-N 106.348 7.778 G54H-N 108.46 7.775 L55H-N 120.236 8.311 N56H-N 120.305 9.424 N56HD21-ND2 109.46 6.465 N56HD22-ND2 109.46 7.153 L57H-N 127.309 9.259 T58H-N 122.763 8.973 S59H-N 126.425 9.549 T60H-N 121.445 9.332 F61H-N 121.707 8.794 L62H-N 122.16 8.915 R63H-N 128.889 9.213 K64H-N 127.634 9.466 N65H-N 113.645 8.648 N65HD21-ND2 112.131 6.944 N65HD22-ND2 112.131 7.592 Q66H-N 118.506 8.009 Q66HE21-NE2 111.559 6.855 Q66HE22-NE2 111.559 7.533 C67H-N 119.694 8.712 E68H-N 126.906 9.083 T69H-N 115.413 8.233 K70H-N 125.378 9.232 I71H-N 124.29 8.751 M72H-N 127.651 9.003 V73H-N 125.436 8.607 L74H-N 127.76 9.278 Q75H-N 125.135 9.28 A77H-N 126.607 8.021 G78H-N 109.388 8.185 A79H-N 126.934 8.074 G81H-N 111.362 8.227 H82H-N 117.393 7.61 Y83H-N 122.473 9.164 T84H-N 112.202 9.475 Y85H-N 118.519 8.723 S86H-N 120.384 8.509 S87H-N 120.949 8.155 H89H-N 115.372 8.535 S90H-N 112.865 8.012 G91H-N 110.848 8.239 S92H-N 114.404 7.757 I93H-N 124.873 8.456 H94H-N 125.591 8.994 S95H-N 117.598 9.153 V96H-N 126.585 9.055 S97H-N 121.395 9.032 V98H-N 124.771 8.402 V99H-N 128.844 8.361 E100H-N 113.832 7.188 A101H-N 124.349 8.708 Y106H-N 118.441 9.359 A107H-N 120.309 9.057 L108H-N 122.798 8.889 L109H-N 126.359 9.168 F110H-N 120.892 9.15 S111H-N 125.184 8.978 R112H-N 120.408 8.581 G113H-N 108.687 8.195 T114H-N 112.383 8.437 K115H-N 121.031 8.042 G116H-N 112.843 8.574 G118H-N 110.324 8.835 Q119H-N 119.674 8.062 D120H-N 117.596 8.554 F121H-N 122.226 7.89 R122H-N 126.876 7.956 M123H-N 121.767 8.444 A124H-N 132.634 9.809 T125H-N 118.001 9.169 L126H-N 128.462 8.287 Y127H-N 127.854 9.352 S128H-N 113.673 9.808 R129H-N 126.102 8.667 T130H-N 108.224 8.244 Q131H-N 119.385 8.765 Q131HE21-NE2 108.331 6.36 Q131HE22-NE2 108.331 6.62 T132H-N 108.689 7.242 L133H-N 124.56 8.608 K134H-N 123.852 8.157 D135H-N 124.197 8.974 E136H-N 117.885 9.287 L137H-N 119.393 7.246 K138H-N 119.612 7.383 E139H-N 119.51 7.978 K140H-N 120.614 7.86 F141H-N 119.075 8.548 T142H-N 120.224 8.791 T143H-N 118.456 8.536 F144H-N 122.676 8.264 S145H-N 115.714 8.077 K146H-N 121.529 8.0 A147H-N 123.249 7.726 Q148H-N 113.952 7.058 Q148HE21-NE2 111.91 5.453 Q148HE22-NE2 111.91 6.385 G149H-N 106.21 7.651 L150H-N 120.964 7.395 T151H-N 110.762 8.27 E152H-N 118.629 9.041 E153H-N 115.885 8.2 D154H-N 118.196 7.833 I155H-N 117.852 7.007 V156H-N 126.166 9.203 F157H-N 124.905 8.718 L158H-N 125.466 7.459 D162H-N 117.032 8.449 K163H-N 115.3 7.195 C164H-N 107.133 8.427 I165H-N 113.57 7.881 Q166H-N 122.915 8.308 Q166HE21-NE2 110.66 6.595 Q166HE22-NE2 110.66 7.501 E167H-N 125.884 8.054