Assignment w1 w2 A3H-N 126.741 8.44 T4H-N 116.015 8.05 K5H-N 126.35 8.332 T6H-N 118.124 8.283 E7H-N 125.934 8.487 K8H-N 123.945 8.278 D9H-N 123.624 8.277 T10H-N 116.812 8.049 L11H-N 126.61 8.191 Q12H-N 123.274 8.28 S13H-N 119.027 8.178 A14H-N 128.314 8.195 L15H-N 125.175 8.05 V17H-N 123.223 8.134 I18H-N 127.777 8.187 E19H-N 128.148 8.475 N20H-N 122.788 8.477 N20HD21-ND2 115.167 7.605 N20HD22-ND2 115.167 6.927 A21H-N 127.253 8.325 E22H-N 122.044 8.415 K23H-N 123.622 8.127 N24H-N 120.652 8.424 N24HD21-ND2 115.363 7.634 N24HD22-ND2 115.363 6.935 T25H-N 117.102 7.852 V26H-N 126.491 8.08 V27H-N 132.992 8.83 T28H-N 123.576 8.165 K29H-N 129.099 9.273 T30H-N 123.51 8.993 L31H-N 128.293 9.557 V32H-N 126.919 9.364 L33H-N 133.503 8.587 K35H-N 127.42 8.666 S36H-N 122.222 8.771 D37H-N 126.346 8.859 D38H-N 119.171 7.944 G39H-N 110.352 8.145 S40H-N 120.09 8.344 Q41H-N 122.551 8.627 Q41HE21-NE2 116.927 7.876 Q41HE22-NE2 116.927 7.032 Q42H-N 131.724 9.189 Q42HE21-NE2 111.777 7.381 Q42HE22-NE2 111.777 6.772 T43H-N 122.202 9.139 Q44H-N 127.19 9.76 Q44HE21-NE2 109.752 7.485 Q44HE22-NE2 109.752 6.599 T45H-N 123.479 9.518 I46H-N 133.908 9.83 T47H-N 124.701 8.843 Y48H-N 127.369 9.638 K49H-N 122.138 8.56 D50H-N 130.208 9.597 K51H-N 124.586 8.45 T52H-N 120.044 8.658 F53H-N 128.987 9.218 L54H-N 124.874 9.391 S55H-N 115.516 8.736 L56H-N 124.352 8.328 A57H-N 131.45 9.208 I58H-N 126.248 9.597 Q59H-N 132.065 9.389 Q59HE21-NE2 113.354 7.438 Q59HE22-NE2 113.354 6.739 Q60H-N 130.314 9.471 Q60HE21-NE2 114.334 7.284 Q60HE22-NE2 114.334 7.066 K61H-N 131.044 8.893 R62H-N 125.397 9.12 V64H-N 121.305 7.52 S65H-N 123.215 8.08 D66H-N 123.802 8.9 E67H-N 121.943 8.717 L68H-N 125.458 7.82 K69H-N 123.868 8.69 T70H-N 117.109 7.935 Y71H-N 127.006 7.683 I72H-N 125.064 9.083 D73H-N 124.9 8.751 Q74H-N 117.025 7.447 Q74HE21-NE2 113.586 6.702 Q74HE22-NE2 113.586 7.28 H75H-N 116.494 8.402 G76H-N 112.564 9.091 V77H-N 124.763 8.927 E78H-N 124.388 8.781 E79H-N 121.887 9.231 T80H-N 120.781 7.858 Q81H-N 125.303 8.765 Q81HE21-NE2 112.917 6.993 Q81HE22-NE2 112.917 6.993 K82H-N 120.458 7.521 A83H-N 125.234 7.782 L84H-N 123.348 8.59 L85H-N 122.872 7.892 E86H-N 122.713 8.124 A87H-N 123.163 7.765 E88H-N 121.945 7.846 E89H-N 117.978 7.634 K90H-N 117.519 7.247 D91H-N 124.888 7.37 K92H-N 129.311 8.795 S93H-N 118.112 8.488 I94H-N 128.95 7.722 I95H-N 123.598 8.378 E96H-N 118.317 7.68 A97H-N 124.797 7.383 R98H-N 115.469 8.229 K99H-N 120.219 7.27 L100H-N 123.8 7.837 A101H-N 130.512 8.213 G102H-N 110.659 8.738 F103H-N 123.097 7.514 K104H-N 130.652 7.473 L105H-N 127.372 8.393 E106H-N 129.358 8.849 T107H-N 131.118 9.433 K108H-N 129.114 9.41 L109H-N 129.323 8.862 L110H-N 129.123 8.373 S111H-N 114.587 8.4 A112H-N 118.269 8.556 T113H-N 102.878 8.065 E114H-N 126.514 7.357 L115H-N 128.058 8.93 Q116H-N 126.54 9.221 Q116HE21-NE2 111.244 7.14 Q116HE22-NE2 111.244 6.673 T117H-N 125.213 9.03 T118H-N 127.799 9.459 T119H-N 129.258 9.147 S120H-N 123.389 8.786 F121H-N 121.245 8.831 D122H-N 124.765 8.819 F123H-N 124.303 8.262 Q124H-N 120.792 8.954 Q124HE21-NE2 115.021 6.871 Q124HE22-NE2 115.021 7.949 V125H-N 114.091 7.026 L126H-N 125.158 8.106 D127H-N 130.026 9.129 V128H-N 128.833 8.288 K129H-N 123.914 8.226 K130H-N 121.888 7.59 A131H-N 123.088 8.506 S132H-N 110.456 7.986 Q133H-N 119.034 7.233 Q133HE21-NE2 114.775 7.406 Q133HE22-NE2 114.775 6.802 L134H-N 123.291 7.411 E135H-N 128.446 8.986 H136H-N 117.593 9.226 L137H-N 115.463 7.09 K138H-N 124.686 7.698 N139H-N 118.077 8.485 N139HD21-ND2 114.916 7.567 N139HD22-ND2 114.916 6.898 I140H-N 120.88 7.549 G141H-N 110.676 7.663 L142H-N 123.857 8.496 E143H-N 118.407 8.672 N144H-N 118.477 7.656 L145H-N 125.354 7.758 L146H-N 116.372 7.242 K147H-N 120.054 7.185 N148H-N 119.498 7.698 N148HD21-ND2 117.696 7.662 N148HD22-ND2 117.696 7.203 E149H-N 122.834 8.767 S151H-N 112.839 8.519 K152H-N 126.71 7.006 Y153H-N 123.239 8.058 I154H-N 120.253 8.193 S155H-N 117.178 8.02 D156H-N 125.479 8.638 R157H-N 121.542 7.888 L158H-N 124.257 8.442 A159H-N 124.146 8.086 N160H-N 118.093 7.445 N160HD21-ND2 117.046 6.94 N160HD22-ND2 117.046 7.662 G161H-N 108.365 7.743 A162H-N 123.928 8.035 T163H-N 113.286 8.451 E164H-N 125.905 8.716 Q165H-N 131.73 8.33 Q165HE21-NE2 113.649 6.738 Q165HE22-NE2 113.649 7.372