Assignment w1 w2 N3H-N 120.255 8.413 N3HD21-ND2 112.56 7.485 N3HD22-ND2 112.56 6.827 R4H-N 120.741 8.147 R4HE-NE 84.186 7.39 L5H-N 122.306 7.895 G6H-N 108.512 9.139 I7H-N 121.189 9.078 I8H-N 124.831 8.632 Y9H-N 132.719 9.542 E10H-N 116.471 7.428 I11H-N 126.354 8.83 Q12H-N 127.562 8.709 Q12HE21-NE2 111.22 7.712 Q12HE22-NE2 111.22 6.602 G13H-N 117.118 9.111 M14H-N 125.806 8.958 K15H-N 122.274 8.158 A16H-N 122.921 9.091 V17H-N 121.848 8.908 V18H-N 120.519 9.163 L19H-N 122.832 7.945 T20H-N 115.406 9.211 S21H-N 112.553 8.375 E22H-N 117.826 7.511 G23H-N 105.046 7.913 E24H-N 115.096 7.472 F25H-N 119.026 6.208 L26H-N 121.857 8.777 I27H-N 121.049 9.167 I28H-N 118.985 9.224 R29H-N 120.249 8.325 R29HE-NE 84.58 7.619 R30H-N 124.702 7.943 R30HE-NE 84.2 7.232 R31H-N 125.552 8.198 R31HE-NE 84.61 7.749 K32H-N 121.525 8.713 D33H-N 116.572 8.577 M34H-N 118.11 7.399 K35H-N 119.915 7.788 V36H-N 120.787 8.467 G37H-N 116.381 9.58 Q38H-N 117.197 7.574 Q38HE21-NE2 110.87 7.604 Q38HE22-NE2 110.87 6.854 Q39H-N 120.452 8.773 Q39HE21-NE2 113.48 7.89 Q39HE22-NE2 113.48 7.31 V40H-N 120.476 9.778 S41H-N 117.15 8.435 F42H-N 119.472 8.186 E43H-N 118.914 9.282 N44H-N 121.188 9.093 N44HD21-ND2 112.4 7.705 N44HD22-ND2 112.4 6.965 E45H-N 117.222 9.061 D46H-N 117.381 7.998 I47H-N 119.826 7.437 Y48H-N 129.511 9.126 N49H-N 123.259 8.613 N49HD21-ND2 112.61 7.596 N49HD22-ND2 112.61 6.894 V50H-N 121.819 8.097 R51H-N 122.845 8.286 G52H-N 109.932 8.237 K53H-N 125.862 7.879 D3H-N 121.422 8.57 I4H-N 118.313 7.935 E5H-N 124.752 9.01 A6H-N 127.414 9.311 R7H-N 126.362 8.626 R7HE-NE 84.605 7.63 E8H-N 117.75 9.832 D9H-N 118.509 7.093 I10H-N 124.867 7.561 E11H-N 119.388 8.572 E12H-N 120.307 7.961 L13H-N 122.037 7.622 K14H-N 119.172 8.472 K15H-N 119.68 7.905 K16H-N 121.043 8.249 L17H-N 118.725 8.891 Q18H-N 119.557 7.904 Q18HE21-NE2 111.29 7.388 Q18HE22-NE2 111.29 6.809 E19H-N 120.447 7.775 F20H-N 115.493 7.784 G21H-N 110.088 8.164 I22H-N 119.857 7.682 T23H-N 116.49 8.314 F24H-N 118.46 8.81 L25H-N 119.618 8.277 D26H-N 117.379 7.682 L27H-N 118.868 7.468 V28H-N 118.655 7.79 L29H-N 116.533 7.679 N30H-N 117.432 7.791 N30HD21-ND2 113.099 7.277 N30HD22-ND2 113.099 7.992 V31H-N 121.945 7.433 K33H-N 124.927 8.646 H34H-N 117.419 7.957 D36H-N 118.779 9.456 S37H-N 116.593 7.619 R38H-N 123.582 8.609 R38HE-NE 81.09 6.645 Q39H-N 115.883 8.982 Q39HE21-NE2 110.31 6.596 Q39HE22-NE2 110.31 6.371 L40H-N 120.453 7.875 C41H-N 116.137 8.331 I42H-N 120.254 8.413 R43H-N 119.383 8.047 R43HE-NE 84.91 7.406 L44H-N 120.106 8.779 A45H-N 121.457 8.447 K46H-N 118.913 8.221 M47H-N 117.608 7.805 L48H-N 119.403 8.038 A49H-N 115.405 7.816 E50H-N 114.18 7.817 D51H-N 122.057 7.372 E52H-N 126.389 8.822 Q53H-N 115.845 8.061 Q53HE21-NE2 112.9 7.738 Q53HE22-NE2 112.9 6.927 M54H-N 121.6 8.776 Y55H-N 122.213 9.291 N56H-N 116.185 8.462 N56HD21-ND2 111.91 7.667 N56HD22-ND2 111.91 7.062 A57H-N 123.472 7.659 L58H-N 121.142 8.263 M59H-N 114.208 7.929 K60H-N 119.594 8.221 N61H-N 113.675 8.442 N61HD21-ND2 114.128 7.819 N61HD22-ND2 114.128 7.153 K62H-N 115.607 8.104 N63H-N 111.957 7.5 N63HD21-ND2 114.06 7.544 N63HD22-ND2 114.06 7.003 I64H-N 124.235 9.121 R66H-N 127.658 8.054 N67H-N 117.621 8.831 N67HD21-ND2 113.31 7.725 N67HD22-ND2 113.31 7.058 E68H-N 121.043 8.557 L69H-N 121.152 8.265 K70H-N 118.379 8.562 K71H-N 118.664 7.362 K72H-N 119.04 7.868 A73H-N 117.893 8.457 K74H-N 115.868 7.799 V75H-N 111.477 7.341 H76H-N 121.466 8.447 T79H-N 116.267 7.681 I80H-N 119.087 7.418 G81H-N 103.699 8.079 N82H-N 118.132 8.565 N82HD21-ND2 111.03 7.614 N82HD22-ND2 111.03 6.935 N83H-N 115.569 7.359 N83HD21-ND2 114.96 7.895 N83HD22-ND2 114.96 7.146 R84H-N 119.182 7.044 K85H-N 116.633 8.166 Y86H-N 119.185 8.141 I87H-N 115.809 8.349 I88H-N 118.827 8.257 A89H-N 119.071 8.002 L90H-N 114.738 8.022 C91H-N 121.452 8.544 L92H-N 116.89 8.047 I93H-N 120.961 8.138 F94H-N 121.099 8.735 R95H-N 119.111 7.793 R95HE-NE 83.76 6.651 S96H-N 117.684 7.568 N97H-N 115.671 8.66 N97HD21-ND2 114.57 7.949 N97HD22-ND2 114.57 6.949 L98H-N 122.642 8.591 N99H-N 121.506 7.963 N99HD21-ND2 114.68 7.801 N99HD22-ND2 114.68 7.118 L100H-N 125.712 9.096 S101H-N 119.104 9.269 K102H-N 118.883 8.143 R103H-N 119.585 7.591 R103HE-NE 84.23 7.193 Y104H-N 119.835 8.415 L105H-N 117.931 7.713 E106H-N 119.131 8.848 Y107H-N 119.992 8.781 Y108H-N 118.443 7.984 T109H-N 107.249 7.685 M110H-N 120.336 7.547 L111H-N 121.767 7.762 E112H-N 120.586 8.265 H118H-N 125.434 8.122