Assignment w1 w2 V4H-N 121.894 8.34 C5H-N 129.143 7.994 N6H-N 123.951 8.59 T7H-N 116.601 8.052 C8H-N 126.695 9.331 E10H-N 121.6 8.535 K11H-N 115.149 8.79 W12H-N 120.206 8.505 W12HE1-NE1 132.203 10.434 I13H-N 120.783 9.86 N14H-N 125.568 9.084 N14HD21-ND2 109.276 7.206 N14HD22-ND2 109.276 6.439 F15H-N 124.322 8.357 Q16H-N 125.244 8.606 Q16HE21-NE2 110.214 6.999 Q16HE22-NE2 110.214 6.854 K18H-N 119.009 8.081 C19H-N 118.979 8.957 Y20H-N 120.353 9.78 Y21H-N 123.949 8.603 F22H-N 127.776 7.776 G23H-N 113.703 7.997 K24H-N 119.782 7.724 G25H-N 112.748 7.907 Q28H-N 122.76 7.38 W29H-N 122.887 7.489 W29HE1-NE1 128.977 10.451 V30H-N 115.034 9.259 H31H-N 118.073 6.367 A32H-N 126.582 7.868 R33H-N 119.61 7.731 Y34H-N 118.631 7.914 A35H-N 122.364 7.878 C36H-N 114.073 7.872 D38H-N 120.291 8.514 M39H-N 116.815 7.428 E40H-N 112.921 8.074 G41H-N 105.816 8.061 Q42H-N 116.419 8.998 Q42HE21-NE2 112.011 7.903 Q42HE22-NE2 112.011 6.646 L43H-N 124.969 8.592 V44H-N 120.789 8.41 S45H-N 120.786 8.052 I46H-N 117.834 3.484 H47H-N 120.905 8.774 S48H-N 111.799 7.181 E50H-N 118.771 8.88 E51H-N 121.457 7.82 Q52H-N 118.067 7.718 Q52HE21-NE2 115.2 7.091 Q52HE22-NE2 115.2 6.483 D53H-N 119.659 8.553 F54H-N 120.507 7.335 L55H-N 119.951 7.988 T56H-N 115.848 8.961 K57H-N 118.583 7.237 H58H-N 115.1 6.722 A59H-N 122.757 7.344 S60H-N 114.392 8.633 G63H-N 109.216 7.059 S64H-N 114.055 8.527 W65H-N 124.335 8.355 W65HE1-NE1 129.354 10.32 I66H-N 110.173 8.17 G67H-N 110.026 9.536 L68H-N 125.309 7.377 R69H-N 120.324 7.585 N70H-N 122.302 8.856 N70HD21-ND2 108.521 6.74 N70HD22-ND2 108.521 6.275 L71H-N 127.365 7.829 K74H-N 116.804 7.761 G75H-N 108.71 8.569 E76H-N 118.655 7.454 F77H-N 122.953 8.663 I78H-N 123.384 8.477 W79H-N 129.91 8.706 W79HE1-NE1 129.259 10.177 V80H-N 117.284 9.081 D81H-N 118.308 7.771 G82H-N 109.768 8.795 S83H-N 117.82 8.532 H84H-N 117.893 8.478 V85H-N 121.31 9.104 D86H-N 128.873 9.064 Y87H-N 125.177 9.877 S88H-N 118.77 7.186 N89H-N 115.192 2.638 N89HD21-ND2 112.024 7.078 N89HD22-ND2 112.024 6.093 W90H-N 120.373 7.44 W90HE1-NE1 127.925 10.231 A91H-N 126.195 9.417 E94H-N 119.328 7.958 C104H-N 118.152 8.478 V105H-N 119.988 7.473 M106H-N 120.871 8.797 M107H-N 119.631 9.442 R108H-N 125.16 9.106 G111H-N 112.048 8.298 R112H-N 116.236 7.272 W113H-N 120.19 8.407 W113HE1-NE1 130.068 10.944 N114H-N 116.495 9.217 N114HD21-ND2 109.887 7.355 N114HD22-ND2 109.887 6.626 D115H-N 122.975 9.245 A116H-N 126.949 9.504 F117H-N 119.346 8.463 C118H-N 120.456 9.011 D119H-N 117.214 8.599 R120H-N 122.574 7.926 K121H-N 122.037 8.469 L122H-N 124.014 7.995 A124H-N 119.693 7.352 W125H-N 116.734 6.981 W125HE1-NE1 130.157 9.819 V126H-N 119.051 7.325 C127H-N 123.523 9.151 D128H-N 120.326 10.276 R129H-N 110.637 8.04 L130H-N 121.388 8.582 A131H-N 124.735 8.265 T132H-N 114.561 8.702 C133H-N 125.299 9.245 A137H-N 129.608 7.853 E139H-N 127.539 7.989 G140H-N 116.033 7.995 S141H-N 121.358 7.858 E143H-N 125.178 7.919 V4H-N 122.24 8.349 N6H-N 124.063 8.579 T7H-N 116.762 8.047 C8H-N 126.784 9.322 E10H-N 121.746 8.537 K11H-N 115.217 8.789 W12H-N 119.761 8.522 W12HE1-NE1 132.417 10.444 I13H-N 120.595 9.837 N14H-N 125.644 9.101 N14HD21-ND2 109.339 7.203 N14HD22-ND2 109.339 6.411 F15H-N 124.425 8.371 Q16H-N 125.359 8.609 Q16HE21-NE2 110.388 7.007 Q16HE22-NE2 110.388 6.857 K18H-N 119.139 8.069 C19H-N 119.133 8.949 Y20H-N 120.328 9.744 Y21H-N 123.549 8.483 F22H-N 127.557 7.61 G23H-N 112.465 7.774 K24H-N 121.139 7.632 G25H-N 114.242 8.052 Q28H-N 122.916 7.365 W29H-N 122.939 7.483 W29HE1-NE1 128.937 10.421 V30H-N 115.113 9.261 H31H-N 118.097 6.345 A32H-N 126.534 7.932 R33H-N 119.9 7.729 Y34H-N 118.574 7.874 A35H-N 122.559 7.797 C36H-N 113.721 7.814 D37H-N 123.917 7.967 D38H-N 120.45 8.508 M39H-N 116.855 7.416 E40H-N 113.0 8.059 G41H-N 105.899 8.041 Q42H-N 116.367 8.988 Q42HE21-NE2 112.146 7.88 Q42HE22-NE2 112.146 6.647 L43H-N 125.423 8.528 V44H-N 120.769 8.216 S45H-N 120.838 8.051 I46H-N 117.724 3.443 H47H-N 120.838 8.783 S48H-N 111.773 7.157 E50H-N 119.111 8.893 E51H-N 121.674 7.835 Q52H-N 118.097 7.729 Q52HE21-NE2 115.516 7.117 Q52HE22-NE2 115.516 6.468 D53H-N 120.156 8.583 F54H-N 120.033 7.326 L55H-N 119.624 8.007 T56H-N 116.367 8.988 K57H-N 118.206 7.29 H58H-N 114.55 6.902 A59H-N 123.011 7.324 S60H-N 114.052 8.513 G63H-N 109.372 7.027 S64H-N 114.429 8.571 W65H-N 124.425 8.371 W65HE1-NE1 129.423 10.314 I66H-N 110.105 8.113 G67H-N 109.971 9.5 L68H-N 125.491 7.353 R69H-N 120.234 7.565 N70H-N 122.107 8.787 N70HD21-ND2 108.668 6.79 N70HD22-ND2 108.668 6.306 L71H-N 126.838 7.866 K74H-N 117.16 7.809 G75H-N 108.703 8.559 E76H-N 119.183 7.519 F77H-N 123.672 8.704 I78H-N 122.978 8.444 W79H-N 130.007 8.671 W79HE1-NE1 129.096 10.119 V80H-N 117.919 9.05 D81H-N 118.319 7.774 G82H-N 109.883 8.776 S83H-N 117.816 8.545 H84H-N 118.527 8.46 V85H-N 121.662 9.222 D86H-N 128.952 9.084 Y87H-N 125.696 10.036 S88H-N 118.934 7.187 N89H-N 115.296 2.619 N89HD21-ND2 111.894 7.083 N89HD22-ND2 111.894 6.075 W90H-N 120.478 7.455 W90HE1-NE1 127.984 10.218 A91H-N 126.272 9.404 E94H-N 119.278 7.936 T96H-N 119.9 7.729 C104H-N 118.527 8.46 V105H-N 119.937 7.446 M106H-N 120.838 8.783 M107H-N 119.783 9.442 R108H-N 125.644 9.101 G111H-N 112.327 8.286 R112H-N 116.316 7.265 W113H-N 120.271 8.396 W113HE1-NE1 130.142 10.933 N114H-N 116.317 9.216 N114HD21-ND2 110.039 7.352 N114HD22-ND2 110.039 6.62 D115H-N 122.861 9.229 A116H-N 126.694 9.461 F117H-N 119.641 8.475 C118H-N 120.581 9.047 D119H-N 117.162 8.52 R120H-N 122.693 7.925 K121H-N 122.152 8.461 L122H-N 124.434 8.054 A124H-N 119.145 7.442 W125H-N 116.173 7.63 W125HE1-NE1 132.15 10.383 V126H-N 118.206 7.29 C127H-N 122.861 9.229 D128H-N 120.399 10.278 R129H-N 110.744 7.992 L130H-N 121.39 8.581 A131H-N 124.782 8.252 T132H-N 114.594 8.703 C133H-N 125.395 9.219 E143H-N 125.229 7.913 V4H-N 121.921 8.334 N6H-N 123.96 8.591 T7H-N 116.643 8.047 C8H-N 126.711 9.326 E10H-N 121.681 8.53 K11H-N 115.186 8.788 W12H-N 119.666 8.548 W12HE1-NE1 132.244 10.434 I13H-N 120.859 9.852 N14H-N 125.599 9.082 N14HD21-ND2 109.289 7.207 N14HD22-ND2 109.289 6.434 F15H-N 124.335 8.356 Q16H-N 125.319 8.603 Q16HE21-NE2 110.299 6.999 Q16HE22-NE2 110.299 6.853 K18H-N 119.029 8.08 C19H-N 119.026 8.961 Y20H-N 120.332 9.772 Y21H-N 123.403 8.479 F22H-N 127.607 7.62 G23H-N 112.304 7.781 K24H-N 121.045 7.627 G25H-N 114.109 8.069 Q28H-N 122.805 7.338 W29H-N 122.897 7.489 W29HE1-NE1 128.945 10.447 V30H-N 115.013 9.256 H31H-N 118.072 6.367 A32H-N 126.28 7.932 R33H-N 119.773 7.707 Y34H-N 118.437 7.851 A35H-N 122.363 7.817 C36H-N 113.521 7.818 D37H-N 123.749 7.948 D38H-N 120.218 8.499 M39H-N 116.78 7.429 E40H-N 112.905 8.073 G41H-N 105.829 8.058 Q42H-N 116.391 8.997 Q42HE21-NE2 112.041 7.898 Q42HE22-NE2 112.041 6.644 L43H-N 124.935 8.597 V44H-N 120.601 8.227 S45H-N 120.804 8.05 I46H-N 117.748 3.476 H47H-N 120.888 8.793 S48H-N 111.728 7.177 E50H-N 118.816 8.878 E51H-N 121.48 7.819 Q52H-N 118.042 7.716 Q52HE21-NE2 115.271 7.099 Q52HE22-NE2 115.271 6.481 D53H-N 120.142 8.582 F54H-N 119.78 7.347 L55H-N 119.967 7.995 T56H-N 116.008 8.982 K57H-N 118.59 7.233 H58H-N 115.003 6.745 A59H-N 122.805 7.338 S60H-N 113.919 8.5 G63H-N 109.158 7.049 S64H-N 114.167 8.527 W65H-N 124.335 8.356 W65HE1-NE1 129.388 10.334 I66H-N 110.069 8.154 G67H-N 109.958 9.524 L68H-N 125.363 7.37 R69H-N 120.292 7.583 N70H-N 122.251 8.842 N70HD21-ND2 108.625 6.743 N70HD22-ND2 108.625 6.283 L71H-N 126.592 7.861 K74H-N 117.303 7.799 G75H-N 108.674 8.563 E76H-N 118.637 7.461 F77H-N 123.022 8.665 I78H-N 123.403 8.479 W79H-N 129.888 8.699 W79HE1-NE1 129.223 10.164 V80H-N 117.574 9.07 D81H-N 118.287 7.772 G82H-N 109.782 8.794 S83H-N 117.774 8.528 H84H-N 118.24 8.482 V85H-N 121.36 9.123 D86H-N 128.878 9.074 Y87H-N 125.298 9.915 S88H-N 118.787 7.184 N89H-N 115.215 2.639 N89HD21-ND2 111.817 7.083 N89HD22-ND2 111.817 6.089 W90H-N 120.403 7.439 W90HE1-NE1 127.962 10.227 A91H-N 126.211 9.41 E94H-N 119.269 7.949 T96H-N 119.773 7.707 C104H-N 118.234 8.455 V105H-N 119.863 7.469 M106H-N 120.888 8.793 M107H-N 119.622 9.441 R108H-N 125.599 9.082 G111H-N 112.054 8.297 R112H-N 116.211 7.272 W113H-N 120.212 8.408 W113HE1-NE1 130.039 10.941 N114H-N 116.502 9.219 N114HD21-ND2 109.985 7.358 N114HD22-ND2 109.985 6.625 D115H-N 122.884 9.245 A116H-N 126.947 9.501 F117H-N 119.373 8.459 C118H-N 120.495 9.015 D119H-N 117.035 8.536 R120H-N 122.551 7.922 K121H-N 122.052 8.47 L122H-N 124.253 8.044 A124H-N 119.044 7.455 W125H-N 116.233 7.659 W125HE1-NE1 131.937 10.372 V126H-N 118.165 7.3 C127H-N 122.884 9.245 D128H-N 120.346 10.276 R129H-N 110.658 8.002 L130H-N 121.367 8.578 A131H-N 124.728 8.261 T132H-N 114.577 8.703 C133H-N 125.256 9.22 E143H-N 125.14 7.91 V4H-N 122.244 8.355 N6H-N 124.07 8.577 T7H-N 116.786 8.045 C8H-N 126.732 9.311 E10H-N 121.752 8.538 K11H-N 115.22 8.788 W12H-N 119.799 8.52 W12HE1-NE1 132.41 10.448 I13H-N 120.59 9.835 N14H-N 125.775 9.121 N14HD21-ND2 109.264 7.207 N14HD22-ND2 109.264 6.405 F15H-N 124.436 8.374 Q16H-N 125.35 8.611 Q16HE21-NE2 110.384 7.008 Q16HE22-NE2 110.384 6.859 K18H-N 119.124 8.069 C19H-N 119.098 8.936 Y20H-N 120.271 9.744 Y21H-N 122.969 8.45 F22H-N 127.626 7.609 G23H-N 112.484 7.779 K24H-N 121.175 7.635 G25H-N 114.197 8.049 Q28H-N 122.936 7.421 W29H-N 123.041 7.531 W29HE1-NE1 128.869 10.376 V30H-N 115.095 9.258 H31H-N 118.048 6.344 A32H-N 126.557 7.951 R33H-N 119.885 7.745 Y34H-N 118.548 7.88 A35H-N 122.792 7.802 C36H-N 113.754 7.817 D37H-N 123.9 7.97 D38H-N 120.426 8.509 M39H-N 116.83 7.42 E40H-N 113.028 8.065 G41H-N 105.931 8.051 Q42H-N 116.348 9.001 Q42HE21-NE2 112.121 7.874 Q42HE22-NE2 112.121 6.651 L43H-N 125.404 8.53 V44H-N 120.889 8.216 S45H-N 120.894 8.059 I46H-N 117.764 3.472 H47H-N 120.776 8.783 S48H-N 111.823 7.156 E50H-N 119.14 8.894 E51H-N 121.658 7.835 Q52H-N 118.073 7.726 Q52HE21-NE2 115.459 7.126 Q52HE22-NE2 115.459 6.461 D53H-N 120.135 8.582 F54H-N 120.006 7.33 L55H-N 119.639 8.014 T56H-N 116.348 9.001 K57H-N 118.183 7.263 H58H-N 114.53 6.92 A59H-N 123.059 7.317 S60H-N 114.165 8.504 G63H-N 109.307 7.025 S64H-N 114.434 8.579 W65H-N 124.436 8.374 W65HE1-NE1 129.307 10.302 I66H-N 110.099 8.043 G67H-N 109.847 9.478 L68H-N 125.639 7.357 R69H-N 120.069 7.573 N70H-N 121.49 8.63 N70HD21-ND2 108.785 6.744 N70HD22-ND2 108.785 6.352 L71H-N 126.806 7.879 K74H-N 117.582 7.933 G75H-N 108.631 8.472 E76H-N 119.435 7.593 F77H-N 123.659 8.704 I78H-N 122.969 8.45 W79H-N 129.46 8.65 W79HE1-NE1 129.072 10.116 V80H-N 118.192 8.995 D81H-N 118.18 7.786 G82H-N 109.771 8.741 S83H-N 117.793 8.548 H84H-N 119.117 8.435 V85H-N 121.65 9.183 D86H-N 128.939 9.1 Y87H-N 125.692 10.03 S88H-N 118.881 7.172 N89H-N 115.356 2.614 N89HD21-ND2 111.888 7.075 N89HD22-ND2 111.888 6.096 W90H-N 120.428 7.442 W90HE1-NE1 127.895 10.179 A91H-N 126.192 9.392 E94H-N 119.135 7.923 T96H-N 119.788 7.769 C104H-N 119.118 8.435 V105H-N 119.97 7.481 M106H-N 120.797 8.813 M107H-N 119.817 9.425 R108H-N 125.519 9.099 G111H-N 112.33 8.286 R112H-N 116.368 7.254 W113H-N 120.356 8.353 W113HE1-NE1 130.023 10.901 N114H-N 115.797 9.233 N114HD21-ND2 110.009 7.352 N114HD22-ND2 110.009 6.619 D115H-N 122.178 9.31 A116H-N 125.331 9.366 F117H-N 119.363 8.461 C118H-N 120.68 9.029 D119H-N 117.221 8.397 R120H-N 122.841 7.942 K121H-N 122.214 8.471 L122H-N 124.925 8.033 A124H-N 119.125 7.444 W125H-N 116.195 7.632 W125HE1-NE1 132.147 10.385 V126H-N 118.196 7.289 C127H-N 123.158 9.2 D128H-N 120.422 10.282 R129H-N 110.755 7.992 L130H-N 121.4 8.589 A131H-N 124.772 8.253 T132H-N 114.652 8.71 C133H-N 125.335 9.212 E143H-N 125.208 7.911 V4H-N 122.08 8.343 C5H-N 129.515 7.993 N6H-N 124.103 8.596 T7H-N 116.753 8.056 C8H-N 126.73 9.321 E10H-N 121.647 8.546 K11H-N 115.241 8.785 W12H-N 120.208 8.501 W12HE1-NE1 132.347 10.45 I13H-N 120.673 9.843 N14H-N 125.261 9.1 N14HD21-ND2 109.32 7.204 N14HD22-ND2 109.32 6.418 F15H-N 124.426 8.354 K18H-N 119.061 8.069 C19H-N 119.118 8.967 Y20H-N 120.307 9.763 Y21H-N 123.498 8.445 F22H-N 127.684 7.607 G23H-N 112.414 7.773 K24H-N 121.064 7.627 G25H-N 114.181 8.05 Q28H-N 122.887 7.381 W29H-N 122.935 7.49 W29HE1-NE1 129.035 10.43 V30H-N 115.095 9.254 H31H-N 118.096 6.349 A32H-N 126.34 7.94 R33H-N 119.942 7.739 Y34H-N 118.427 7.853 A35H-N 122.792 7.812 C36H-N 113.704 7.808 D37H-N 123.898 7.96 D38H-N 120.56 8.536 M39H-N 116.775 7.429 E40H-N 113.083 8.063 G41H-N 105.693 8.059 Q42H-N 116.449 9.039 Q42HE21-NE2 112.049 7.879 Q42HE22-NE2 112.049 6.641 L43H-N 125.213 8.6 V44H-N 121.032 8.448 S45H-N 120.911 8.04 I46H-N 117.803 3.463 H47H-N 121.022 8.76 S48H-N 111.756 7.165 E50H-N 119.001 8.881 E51H-N 121.563 7.816 Q52H-N 118.104 7.715 Q52HE21-NE2 115.381 7.104 Q52HE22-NE2 115.381 6.469 D53H-N 119.67 8.55 F54H-N 120.39 7.336 L55H-N 120.336 8.014 T56H-N 116.381 8.994 K57H-N 118.414 7.255 H58H-N 114.865 6.8 A59H-N 122.981 7.328 S60H-N 114.537 8.616 G63H-N 109.313 7.042 S64H-N 114.184 8.498 W65H-N 124.455 8.373 W65HE1-NE1 129.452 10.319 I66H-N 110.354 8.176 G67H-N 110.017 9.562 L68H-N 125.483 7.358 R69H-N 120.258 7.573 N70H-N 122.192 8.796 L71H-N 127.365 7.807 K74H-N 117.08 7.807 G75H-N 108.738 8.563 E76H-N 118.958 7.5 F77H-N 123.416 8.683 I78H-N 123.582 8.481 W79H-N 129.949 8.682 W79HE1-NE1 129.263 10.135 V80H-N 117.794 9.056 D81H-N 118.353 7.775 G82H-N 109.844 8.779 S83H-N 117.765 8.537 H84H-N 118.31 8.446 V85H-N 121.536 9.169 D86H-N 128.986 9.085 Y87H-N 125.528 9.983 S88H-N 118.892 7.188 N89H-N 115.318 2.633 N89HD21-ND2 112.133 7.084 N89HD22-ND2 112.133 6.079 W90H-N 120.562 7.455 W90HE1-NE1 128.055 10.217 A91H-N 126.204 9.399 E94H-N 119.259 7.951 C104H-N 118.406 8.477 V105H-N 119.868 7.452 M106H-N 120.876 8.787 M107H-N 119.704 9.432 R108H-N 125.631 9.089 G111H-N 112.173 8.287 R112H-N 116.345 7.251 W113H-N 120.202 8.41 W113HE1-NE1 130.097 10.935 N114H-N 116.44 9.217 D115H-N 122.813 9.242 A116H-N 126.678 9.47 F117H-N 119.556 8.478 C118H-N 120.579 9.044 D119H-N 117.41 8.606 R120H-N 122.642 7.906 K121H-N 122.042 8.472 L122H-N 124.106 7.978 A124H-N 119.044 7.455 W125H-N 116.224 7.647 W125HE1-NE1 130.249 9.815 V126H-N 118.361 7.282 C127H-N 123.181 9.215 D128H-N 120.413 10.27 R129H-N 110.652 8.031 L130H-N 121.381 8.594 A131H-N 124.83 8.252 T132H-N 114.585 8.702 C133H-N 125.371 9.217 A137H-N 129.7 7.852 E139H-N 127.488 7.979 G140H-N 115.987 7.983 S141H-N 121.34 7.836 E143H-N 125.138 7.911 V4H-N 121.911 8.336 C5H-N 129.515 7.993 N6H-N 123.956 8.602 T7H-N 116.633 8.049 C8H-N 126.701 9.328 E10H-N 121.671 8.532 K11H-N 115.176 8.79 W12H-N 120.208 8.501 W12HE1-NE1 132.234 10.436 I13H-N 120.842 9.857 N14H-N 125.589 9.084 N14HD21-ND2 109.284 7.209 N14HD22-ND2 109.284 6.433 F15H-N 124.325 8.358 K18H-N 119.014 8.08 C19H-N 118.999 8.961 Y20H-N 120.307 9.777 Y21H-N 123.411 8.447 F22H-N 127.597 7.622 G23H-N 112.294 7.783 K24H-N 121.035 7.629 G25H-N 114.109 8.069 Q28H-N 122.815 7.375 W29H-N 122.887 7.491 W29HE1-NE1 128.935 10.449 V30H-N 115.009 9.256 H31H-N 118.065 6.366 A32H-N 126.249 7.934 R33H-N 119.744 7.801 Y34H-N 118.427 7.853 A35H-N 122.792 7.832 C36H-N 113.511 7.82 D37H-N 123.739 7.95 D38H-N 120.56 8.536 M39H-N 116.775 7.429 E40H-N 112.895 8.075 G41H-N 105.636 8.069 Q42H-N 116.381 8.999 Q42HE21-NE2 112.031 7.9 Q42HE22-NE2 112.031 6.646 L43H-N 124.878 8.589 V44H-N 121.032 8.448 S45H-N 120.794 8.052 I46H-N 117.841 3.484 H47H-N 120.85 8.756 S48H-N 111.718 7.179 E50H-N 118.806 8.88 E51H-N 121.47 7.821 Q52H-N 118.032 7.718 Q52HE21-NE2 115.261 7.101 Q52HE22-NE2 115.261 6.483 D53H-N 119.67 8.55 F54H-N 120.491 7.335 L55H-N 119.957 7.997 T56H-N 115.876 8.975 K57H-N 118.545 7.243 H58H-N 114.983 6.739 A59H-N 122.788 7.34 S60H-N 114.346 8.621 G63H-N 109.148 7.051 S64H-N 113.895 8.501 W65H-N 124.399 8.355 W65HE1-NE1 129.52 10.307 I66H-N 110.288 8.198 G67H-N 109.971 9.574 L68H-N 125.348 7.375 R69H-N 120.282 7.585 N70H-N 122.241 8.844 L71H-N 127.363 7.83 K74H-N 116.815 7.773 G75H-N 108.664 8.565 E76H-N 118.637 7.469 F77H-N 123.012 8.667 I78H-N 123.393 8.481 W79H-N 129.988 8.725 W79HE1-NE1 129.238 10.171 V80H-N 117.564 9.072 D81H-N 118.277 7.774 G82H-N 109.772 8.796 S83H-N 117.764 8.53 H84H-N 118.164 8.458 V85H-N 121.35 9.125 D86H-N 128.868 9.076 Y87H-N 125.288 9.917 S88H-N 118.777 7.186 N89H-N 115.21 2.641 N89HD21-ND2 112.123 7.076 N89HD22-ND2 112.123 6.091 W90H-N 120.393 7.441 W90HE1-NE1 127.952 10.229 A91H-N 126.198 9.413 E94H-N 119.259 7.951 C104H-N 118.236 8.482 V105H-N 119.853 7.471 M106H-N 120.878 8.795 M107H-N 119.621 9.442 R108H-N 125.165 9.105 G111H-N 112.044 8.299 R112H-N 116.201 7.273 W113H-N 120.202 8.41 W113HE1-NE1 130.027 10.942 N114H-N 116.492 9.221 D115H-N 122.889 9.245 A116H-N 127.217 9.544 F117H-N 119.363 8.461 C118H-N 120.485 9.017 D119H-N 117.194 8.595 R120H-N 122.541 7.924 K121H-N 122.042 8.472 L122H-N 123.84 7.978 A124H-N 119.044 7.455 W125H-N 116.224 7.661 W125HE1-NE1 130.16 9.823 V126H-N 118.148 7.303 C127H-N 123.113 9.216 D128H-N 120.328 10.277 R129H-N 110.649 8.0 L130H-N 121.357 8.58 A131H-N 124.718 8.263 T132H-N 114.567 8.705 C133H-N 125.258 9.221 A137H-N 129.58 7.847 E139H-N 127.488 7.979 G140H-N 115.987 7.983 S141H-N 121.292 7.862 E143H-N 125.138 7.911