Assignment w1 w2 C1H-N 121.035 8.926 D2H-N 125.39 8.787 L3H-N 123.792 8.162 Q5H-N 121.463 8.772 Q5HE21-NE2 107.971 6.849 Q5HE22-NE2 107.971 6.217 T6H-N 111.416 7.879 H7H-N 119.065 8.595 S8H-N 115.697 8.187 L9H-N 123.751 8.415 G10H-N 107.445 8.453 S11H-N 118.7 8.253 R12H-N 121.947 8.02 R13H-N 119.397 8.482 T14H-N 116.679 7.952 L15H-N 120.053 7.564 M16H-N 118.642 8.003 L17H-N 120.64 7.837 L18H-N 118.14 7.501 A19H-N 121.85 7.967 Q20H-N 118.557 7.975 Q20HE21-NE2 109.05 7.192 Q20HE22-NE2 109.05 6.477 M21H-N 116.567 7.426 R22H-N 115.328 6.497 K23H-N 128.349 10.218 I24H-N 118.439 8.472 S25H-N 113.498 8.112 L26H-N 127.532 8.809 F27H-N 116.92 7.993 S28H-N 115.031 7.936 C29H-N 119.727 7.879 L30H-N 122.084 7.818 K31H-N 117.517 8.608 D32H-N 117.548 7.822 R33H-N 120.725 7.389 H34H-N 120.423 7.983 D35H-N 124.823 7.82 F36H-N 122.732 8.986 G37H-N 111.68 8.73 F38H-N 122.939 9.18 Q40H-N 123.513 7.978 Q40HE21-NE2 111.465 6.807 Q40HE22-NE2 111.465 7.587 E41H-N 119.258 9.038 E42H-N 116.994 7.655 F43H-N 115.507 7.619 G44H-N 107.095 7.745 N45H-N 117.414 8.354 N45HD21-ND2 112.301 7.552 N45HD22-ND2 112.301 6.909 Q46H-N 118.777 8.671 Q46HE21-NE2 112.145 6.776 Q46HE22-NE2 112.145 7.234 F47H-N 119.354 7.911 Q48H-N 119.917 8.232 Q48HE21-NE2 112.287 6.862 Q48HE22-NE2 112.287 7.509 K49H-N 121.711 8.435 A50H-N 120.227 8.586 E51H-N 114.753 7.897 T52H-N 111.325 7.878 I53H-N 119.0 8.353 V55H-N 116.054 7.122 L56H-N 122.938 8.546 H57H-N 116.914 9.057 E58H-N 119.466 7.861 M59H-N 118.598 8.638 I60H-N 117.037 8.351 Q61H-N 119.984 8.229 Q61HE21-NE2 113.596 6.753 Q61HE22-NE2 113.596 7.206 Q62H-N 116.625 8.435 Q62HE21-NE2 114.454 7.078 Q62HE22-NE2 114.454 8.217 I63H-N 122.679 8.177 F64H-N 120.727 8.417 N65H-N 119.808 8.82 N65HD21-ND2 108.837 7.132 N65HD22-ND2 108.837 7.105 L66H-N 121.431 8.183 F67H-N 110.696 8.169 S68H-N 119.005 8.025 T69H-N 111.191 6.985 K70H-N 120.974 9.07 D71H-N 116.175 7.535 S72H-N 117.135 8.072 S73H-N 113.19 7.991 A74H-N 119.293 7.106 A75H-N 121.276 7.169 W76H-N 116.629 7.092 W76HE1-NE1 121.914 6.784 D77H-N 119.888 8.231 E78H-N 127.097 8.928 T79H-N 115.274 8.124 L80H-N 121.582 7.726 L81H-N 119.157 8.347 D82H-N 115.193 8.01 K83H-N 119.453 7.351 F84H-N 123.708 8.482 Y85H-N 118.185 9.017 T86H-N 113.903 7.62 E87H-N 120.723 7.73 L88H-N 120.663 8.398 Y89H-N 118.54 8.634 Q90H-N 118.121 7.815 Q90HE21-NE2 112.983 6.839 Q90HE22-NE2 112.983 7.48 Q91H-N 117.845 7.751 Q91HE21-NE2 112.176 6.817 Q91HE22-NE2 112.176 7.569 L92H-N 119.862 8.477 N93H-N 117.635 8.095 N93HD21-ND2 111.923 6.407 N93HD22-ND2 111.923 7.345 D94H-N 120.974 8.382 L95H-N 119.125 8.162 E96H-N 118.609 8.1 A97H-N 120.491 7.828 C98H-N 115.372 7.609 V99H-N 121.409 7.834 I100H-N 122.262 8.067 Q101H-N 121.514 8.065 G102H-N 109.125 8.08 V103H-N 118.611 8.1 G104H-N 111.867 8.432 V105H-N 120.678 7.894 T106H-N 116.44 8.712 E107H-N 119.243 8.487 T108H-N 113.929 8.135 L110H-N 118.317 8.019 M111H-N 118.764 7.682 K112H-N 121.228 8.295 E113H-N 118.87 8.281 D114H-N 118.974 8.624 S115H-N 118.023 8.196 I116H-N 123.28 7.809 L117H-N 121.029 8.422 A118H-N 120.065 7.897 V119H-N 118.712 7.584 R120H-N 121.348 8.651 K121H-N 119.575 9.02 Y122H-N 121.333 7.483 F123H-N 115.876 7.943 Q124H-N 122.933 8.486 Q124HE21-NE2 110.727 6.809 Q124HE22-NE2 110.727 7.483 R125H-N 120.197 8.142 I126H-N 121.695 7.533 T127H-N 115.417 8.298 L128H-N 122.605 8.274 Y129H-N 120.78 7.53 L130H-N 119.015 7.727 K131H-N 116.716 7.503 E132H-N 121.715 8.447 K133H-N 115.915 7.397 K134H-N 117.641 7.724 Y135H-N 110.376 8.443 S136H-N 113.528 6.752 C138H-N 113.721 8.591 A139H-N 125.161 8.094 W140H-N 116.435 8.515 W140HE1-NE1 126.81 9.65 E141H-N 121.451 8.188 V142H-N 121.076 8.631 V143H-N 120.06 8.336 R144H-N 123.917 9.625 A145H-N 119.254 8.872 E146H-N 121.7 8.15 I147H-N 119.378 8.741 M148H-N 119.314 8.452 R149H-N 119.592 7.663 S150H-N 117.925 9.204 F151H-N 125.098 9.458 S152H-N 115.801 7.852 L153H-N 121.275 7.79 S154H-N 113.81 7.888 T155H-N 109.305 7.179 N156H-N 119.563 7.754 N156HD21-ND2 111.888 6.835 N156HD22-ND2 111.888 7.484 L157H-N 120.455 8.101 Q158H-N 119.914 8.257 Q158HE21-NE2 111.543 6.749 Q158HE22-NE2 111.543 7.447 E159H-N 120.433 8.303 S160H-N 115.564 8.124 L161H-N 123.702 8.037 R162H-N 120.585 8.101 S163H-N 116.624 8.199 K164H-N 122.9 8.253 E165H-N 125.351 8.029