Assignment w1 w2 D3H-N 122.553 8.437 E4H-N 125.121 8.726 L5H-N 120.976 8.381 Y6H-N 123.977 8.342 R7H-N 118.301 8.452 R7HE-NE 82.59 7.601 Q8H-N 119.421 8.894 Q8HE21-NE2 110.218 7.352 Q8HE22-NE2 110.218 7.041 S9H-N 113.384 8.018 L10H-N 121.112 8.599 E11H-N 120.653 7.806 I12H-N 117.297 7.401 I13H-N 117.56 8.378 S14H-N 113.892 9.048 R15H-N 118.89 7.655 R15HE-NE 85.6 7.562 Y16H-N 119.757 8.351 L17H-N 118.494 8.578 R18H-N 115.962 8.044 R18HE-NE 84.061 7.604 E19H-N 120.998 8.268 Q20H-N 119.903 8.193 Q20HE21-NE2 116.984 7.07 Q20HE22-NE2 116.984 7.471 A21H-N 117.771 7.883 T22H-N 103.721 8.024 G23H-N 111.61 8.155 A24H-N 123.004 7.763 K25H-N 121.392 8.349 D26H-N 124.433 8.803 T27H-N 116.332 8.363 K28H-N 125.551 8.346 M30H-N 121.136 8.585 G31H-N 109.849 8.93 R32H-N 121.001 8.447 S33H-N 119.991 8.667 G34H-N 108.582 8.216 A35H-N 123.445 8.506 T36H-N 115.716 8.262 S37H-N 117.911 8.389 R38H-N 120.924 8.278 K39H-N 119.172 7.93 A40H-N 125.586 9.192 L41H-N 120.08 8.209 E42H-N 117.875 8.197 T43H-N 116.912 8.183 L44H-N 123.099 8.509 R45H-N 116.885 8.398 R45HE-NE 87.139 9.799 R46H-N 117.297 7.421 R46HE-NE 85.083 7.702 V47H-N 114.304 8.515 G48H-N 110.132 8.89 D49H-N 121.292 7.392 G50H-N 106.682 8.132 V51H-N 121.747 7.476 Q52H-N 118.494 8.439 Q52HE21-NE2 110.457 6.993 Q52HE22-NE2 110.457 6.864 R53H-N 116.807 7.873 N54H-N 116.356 8.123 N54HD21-ND2 111.757 6.851 N54HD22-ND2 111.757 7.36 H55H-N 114.809 7.558 E56H-N 121.943 7.071 T57H-N 112.827 8.324 A58H-N 126.52 7.91 F59H-N 119.326 9.017 Q60H-N 119.67 8.678 Q60HE21-NE2 110.723 7.712 Q60HE22-NE2 110.723 6.901 G61H-N 106.14 7.975 M62H-N 120.973 8.007 L63H-N 119.043 8.394 R64H-N 117.294 7.912 K65H-N 116.84 7.506 L66H-N 119.257 7.736 D67H-N 119.743 8.068 I68H-N 120.055 8.275 K69H-N 126.186 9.722 N70H-N 115.056 7.959 N70HD21-ND2 113.297 6.937 N70HD22-ND2 113.297 7.529 E71H-N 118.214 8.831 D72H-N 120.319 8.167 D73H-N 119.793 8.153 V74H-N 117.572 7.629 K75H-N 119.403 7.961 S76H-N 114.355 7.919 L77H-N 121.954 7.883 S78H-N 115.268 8.185 R79H-N 119.021 7.684 R79HE-NE 84.566 7.19 V80H-N 116.979 7.479 M81H-N 117.822 8.104 I82H-N 116.348 7.789 H83H-N 118.994 7.543 V84H-N 117.112 7.713 F85H-N 115.531 7.743 S86H-N 114.812 7.634 D87H-N 120.986 8.043 G88H-N 108.171 8.163 V89H-N 121.716 7.886 T90H-N 121.669 8.201 W92H-N 118.437 8.942 W92HE1-NE1 129.115 10.256 G93H-N 108.154 8.697 R94H-N 122.547 8.353 I95H-N 120.13 7.545 V96H-N 119.403 8.99 T97H-N 122.016 8.605 L98H-N 122.476 7.769 I99H-N 117.997 8.175 S100H-N 116.934 8.989 F101H-N 124.64 8.513 G102H-N 106.116 8.111 A103H-N 124.56 8.437 F104H-N 120.981 8.213 V105H-N 120.473 8.513 A106H-N 123.948 8.807 K107H-N 115.836 7.934 H108H-N 120.459 7.254 L109H-N 118.336 8.709 K110H-N 118.036 7.752 T111H-N 115.985 7.832 I112H-N 112.606 7.262 N113H-N 116.297 7.816 N113HD21-ND2 112.309 7.645 N113HD22-ND2 112.309 6.86 Q114H-N 117.958 8.522 Q114HE21-NE2 109.961 7.268 Q114HE22-NE2 109.961 6.586 E115H-N 120.597 8.881 S116H-N 115.352 8.702 S117H-N 116.944 7.963 I118H-N 122.505 7.945 E119H-N 119.604 8.244 L121H-N 120.974 7.587 A122H-N 121.982 8.593 E123H-N 120.516 8.568 S124H-N 116.054 8.282 I125H-N 120.575 8.343 T126H-N 116.459 8.056 D127H-N 120.236 8.813 V128H-N 116.904 7.949 L129H-N 121.043 8.198 V130H-N 114.37 8.858 R131H-N 115.89 8.619 T132H-N 106.654 7.53 K133H-N 117.426 7.691 R134H-N 120.904 7.341 R134HE-NE 83.544 7.476 D135H-N 114.262 8.386 W136H-N 121.564 7.844 L137H-N 117.395 8.623 V138H-N 118.341 8.631 K139H-N 122.096 7.695 Q140H-N 115.416 7.344 Q140HE21-NE2 111.757 6.538 Q140HE22-NE2 111.757 5.821 R141H-N 110.16 7.677 R141HE-NE 84.601 7.359 G142H-N 107.741 8.931 W143H-N 123.871 9.004 W143HE1-NE1 127.507 10.451 D144H-N 119.481 8.071 G145H-N 109.653 7.493 F146H-N 124.053 7.257 V147H-N 116.525 7.7 E148H-N 118.404 7.801 F149H-N 120.305 8.358 F150H-N 112.582 6.927 H151H-N 118.966 7.483 V152H-N 120.499 8.103 E153H-N 123.58 8.446 D154H-N 120.964 8.325 L155H-N 122.311 8.21 E156H-N 120.023 8.396 G157H-N 109.371 8.323 G158H-N 108.074 8.226 H159H-N 117.875 8.21 H161H-N 125.094 8.162