Assignment w1 w2 Q3H-N 121.695 8.505 Q3HE21-NE2 112.64 7.55 Q3HE22-NE2 112.64 6.848 L4H-N 124.086 8.298 T5H-N 113.234 8.834 E6H-N 120.408 9.032 E7H-N 120.03 8.689 Q8H-N 119.054 7.789 Q8HE21-NE2 111.57 7.69 Q8HE22-NE2 111.57 6.788 I9H-N 120.238 8.509 A10H-N 121.962 8.044 E11H-N 118.344 7.955 F12H-N 118.531 8.499 K13H-N 123.907 9.091 E14H-N 118.741 7.883 A15H-N 121.369 7.654 F16H-N 119.149 8.591 A17H-N 120.15 8.04 L18H-N 117.318 7.065 F19H-N 112.582 6.879 D20H-N 116.629 7.663 K21H-N 123.535 7.606 D22H-N 113.925 8.096 G23H-N 109.384 7.639 D24H-N 121.104 8.484 G25H-N 112.823 10.525 T26H-N 112.109 8.212 I27H-N 126.735 9.895 T28H-N 116.405 8.415 T29H-N 112.315 9.207 K30H-N 121.213 7.57 E31H-N 122.103 7.702 L32H-N 120.033 8.665 G33H-N 105.976 8.81 T34H-N 118.712 8.059 V35H-N 121.545 7.686 M36H-N 117.205 8.458 R37H-N 118.753 8.771 R37HE-NE 85.303 7.431 S38H-N 119.151 7.949 L39H-N 119.935 7.246 G40H-N 106.701 7.846 Q41H-N 118.518 7.833 Q41HE21-NE2 110.689 6.527 Q41HE22-NE2 110.689 7.353 N42H-N 116.528 8.6 N42HD21-ND2 112.09 7.523 N42HD22-ND2 112.09 6.816 T44H-N 114.734 9.496 E45H-N 120.223 8.776 A46H-N 121.039 8.25 E47H-N 118.725 7.735 L48H-N 119.18 8.341 Q49H-N 118.104 8.009 Q49HE21-NE2 112.926 7.51 Q49HE22-NE2 112.926 6.838 D50H-N 121.031 8.119 M51H-N 121.208 8.454 I52H-N 117.544 7.882 N53H-N 117.915 8.541 N53HD21-ND2 112.402 6.95 N53HD22-ND2 112.402 7.9 E54H-N 116.988 7.447 V55H-N 114.101 7.308 D56H-N 120.664 7.983 A57H-N 130.891 8.148 D58H-N 114.621 8.261 G59H-N 108.921 7.641 N60H-N 118.959 8.195 N60HD21-ND2 115.259 7.75 N60HD22-ND2 115.259 7.058 G61H-N 112.918 10.396 T62H-N 108.26 7.624 I63H-N 122.583 8.506 D64H-N 129.123 9.195 F65H-N 118.674 8.937 E67H-N 118.357 8.355 F68H-N 123.936 8.65 L69H-N 120.301 8.863 S70H-N 113.226 7.732 L71H-N 121.434 7.347 M72H-N 114.415 7.671 A73H-N 120.746 7.901 R74H-N 119.775 7.117 R74HE-NE 84.613 7.134 K75H-N 125.067 8.541 M76H-N 123.706 8.595 K77H-N 121.588 8.744 E78H-N 123.011 8.931 Q79H-N 117.844 8.75 Q79HE21-NE2 112.786 7.743 Q79HE22-NE2 112.786 6.852 D80H-N 119.598 7.429 S81H-N 115.484 8.178 E82H-N 121.946 8.228 E83H-N 117.831 8.087 E84H-N 117.085 7.961 L85H-N 119.224 7.656 I86H-N 122.126 8.568 E87H-N 116.533 7.969 A88H-N 120.706 8.249 F89H-N 119.159 8.785 K90H-N 115.737 7.98 V91H-N 117.104 7.328 F92H-N 117.034 7.353 D93H-N 116.866 7.948 R94H-N 125.413 7.722 R94HE-NE 83.501 7.238 D95H-N 113.893 8.127 G96H-N 108.767 7.806 N97H-N 119.255 8.185 N97HD21-ND2 115.049 7.963 N97HD22-ND2 115.049 6.803 G98H-N 113.794 10.959 L99H-N 118.641 7.459 I100H-N 127.871 9.952 S101H-N 124.652 9.293 A102H-N 123.243 9.233 A103H-N 118.608 8.218 E104H-N 120.353 7.895 L105H-N 120.738 8.808 R106H-N 118.001 8.774 R106HE-NE 84.473 7.314 H107H-N 118.839 7.799 V108H-N 119.26 8.257 M109H-N 116.436 8.566 T110H-N 115.474 7.897 N111H-N 122.222 7.514 N111HD21-ND2 112.2 6.449 N111HD22-ND2 112.2 6.843 L112H-N 118.584 7.908 G113H-N 108.247 7.879 E114H-N 118.278 7.786 K115H-N 125.734 8.868 L116H-N 124.95 8.266 T117H-N 115.451 9.395 D118H-N 121.237 8.917 D119H-N 118.259 8.292 E120H-N 121.364 7.765 V121H-N 121.914 8.198 D122H-N 119.2 7.94 E123H-N 120.208 8.101 M124H-N 120.008 7.835 I125H-N 118.004 7.923 R126H-N 118.644 8.402 R126HE-NE 84.376 7.537 E127H-N 115.568 7.99 A128H-N 118.685 7.238 D129H-N 118.364 8.043 I130H-N 127.497 8.424 D131H-N 117.009 8.214 G132H-N 108.743 7.575 D133H-N 121.026 8.378 G134H-N 115.536 10.528 H135H-N 116.296 8.329 I136H-N 124.645 9.251 N137H-N 129.549 9.543 N137HD21-ND2 107.898 6.708 N137HD22-ND2 107.898 7.267 Y138H-N 119.351 8.708 E139H-N 118.978 8.11 E140H-N 119.821 8.847 F141H-N 125.45 8.978 V142H-N 119.651 8.494 R143H-N 117.374 7.513 R143HE-NE 84.709 7.384 M144H-N 119.057 7.921 M145H-N 117.493 7.656 V146H-N 115.365 8.004 S147H-N 119.128 7.779 K148H-N 128.701 8.124 G3H-N 109.855 8.645 S4H-N 115.303 8.191 S5H-N 119.23 8.505 A6H-N 124.819 8.559 A7H-N 120.61 8.138 A8H-N 120.792 7.912 R9H-N 116.803 7.94 R9HE-NE 83.701 9.04 K10H-N 120.151 7.432 E11H-N 116.964 8.353 I12H-N 121.235 7.599 I13H-N 120.044 8.433 R14H-N 118.396 8.377 R14HE-NE 82.975 7.245 N15H-N 117.188 8.362 N15HD21-ND2 109.576 6.745 N15HD22-ND2 109.576 5.826 K16H-N 121.416 8.565 I17H-N 118.738 8.42 R18H-N 119.132 8.792 R18HE-NE 84.945 7.755 A19H-N 121.612 8.459 I20H-N 115.893 8.309 G21H-N 108.95 8.881 K22H-N 120.332 8.435 M23H-N 116.825 8.158 A24H-N 121.207 9.133 R25H-N 119.205 8.33 R25HE-NE 84.922 7.762 V26H-N 119.708 7.857 F27H-N 117.898 8.047 S28H-N 114.451 8.328 V29H-N 121.268 8.078 L30H-N 120.299 7.855 R31H-N 117.798 7.658 R31HE-NE 86.155 8.1 E32H-N 120.72 7.854 E33H-N 121.022 8.157 S34H-N 122.389 7.864