Assignment w1 w2 Q3H-N 120.207 8.34 L4H-N 123.42 8.236 T5H-N 113.063 8.597 E6H-N 120.549 9.0 E7H-N 119.504 8.668 Q8H-N 120.344 7.656 I9H-N 118.976 8.236 A10H-N 121.164 7.986 E11H-N 119.797 7.785 F12H-N 120.651 8.627 K13H-N 123.625 9.213 E14H-N 120.514 7.949 A15H-N 121.882 7.992 F16H-N 118.634 8.719 S17H-N 113.302 8.133 L18H-N 120.617 7.406 F19H-N 113.234 7.143 D20H-N 116.618 7.778 K21H-N 124.138 7.791 D22H-N 114.157 8.078 G23H-N 109.303 7.681 D24H-N 120.959 8.474 G25H-N 112.858 10.563 T26H-N 112.072 8.23 I27H-N 126.462 9.94 T28H-N 116.276 8.371 T29H-N 112.721 9.14 K30H-N 120.72 7.601 E31H-N 121.916 7.687 L32H-N 120.754 8.597 G33H-N 105.85 8.744 T34H-N 118.395 8.102 V35H-N 122.6 7.589 M36H-N 117.028 8.31 R37H-N 119.01 8.597 S38H-N 119.079 8.041 L39H-N 119.079 7.235 G40H-N 106.705 7.803 Q41H-N 117.814 7.778 N42H-N 116.306 8.606 T44H-N 112.721 8.755 E45H-N 120.651 8.774 A46H-N 120.651 8.236 E47H-N 118.942 7.638 L48H-N 119.831 8.059 Q49H-N 118.566 8.287 D50H-N 120.138 8.004 M51H-N 119.489 7.852 I52H-N 119.933 7.968 N53H-N 118.156 8.78 E54H-N 116.618 7.669 V55H-N 111.559 7.174 D56H-N 121.472 7.748 A57H-N 131.624 8.078 D58H-N 114.02 8.255 G59H-N 108.585 7.595 N60H-N 118.976 8.212 G61H-N 113.507 10.587 T62H-N 108.243 7.662 I63H-N 123.83 8.761 D64H-N 128.411 8.902 F65H-N 118.498 8.951 E67H-N 117.814 8.291 F68H-N 123.522 8.676 L69H-N 120.275 8.987 T70H-N 114.84 7.62 M71H-N 120.856 7.064 A73H-N 120.002 8.267 R74H-N 115.866 7.351 K75H-N 117.712 7.931 M76H-N 118.566 7.949 K77H-N 118.464 7.595 D78H-N 119.933 7.736 T79H-N 115.592 8.084 D80H-N 125.573 8.511 S81H-N 117.848 8.548 E82H-N 122.565 8.877 E83H-N 117.541 8.523 E84H-N 120.617 7.7 I85H-N 122.36 8.181 R86H-N 121.335 8.621 E87H-N 117.951 7.992 A88H-N 121.506 8.029 F89H-N 118.874 8.584 R90H-N 116.276 7.833 V91H-N 118.224 7.369 F92H-N 113.37 6.918 D93H-N 116.754 7.839 K94H-N 125.334 7.693 D95H-N 114.293 8.249 G96H-N 109.132 7.73 N97H-N 119.694 8.401 G98H-N 112.413 10.508 Y99H-N 116.242 7.711 I100H-N 127.214 10.129 S101H-N 124.001 9.036 A102H-N 123.215 9.329 A103H-N 118.293 8.215 E104H-N 120.617 7.864 L105H-N 120.822 8.31 R106H-N 118.19 8.841 H107H-N 120.412 8.181 V108H-N 118.874 7.876 M109H-N 115.114 8.23 T110H-N 116.105 8.633 N111H-N 123.522 8.017 L112H-N 118.634 7.791 G113H-N 104.996 7.669 E114H-N 121.369 7.943 K115H-N 124.89 8.474 L116H-N 125.129 7.998 T117H-N 114.806 9.177 D118H-N 121.061 8.853 E119H-N 119.216 8.658 E120H-N 120.309 7.711 V121H-N 120.685 7.974 D122H-N 120.104 8.047 E123H-N 119.147 7.998 M124H-N 119.147 7.656 I125H-N 118.019 7.821 R126H-N 118.122 8.218 E127H-N 117.78 7.717 A128H-N 117.165 7.223 D129H-N 117.985 7.955 I130H-N 128.137 8.377 D131H-N 117.062 8.334 G132H-N 108.551 7.669 D133H-N 120.685 8.371 G134H-N 112.482 10.129 Q135H-N 115.49 8.01 V136H-N 125.471 9.14 N137H-N 129.128 9.573 Y138H-N 118.805 8.328 E139H-N 118.703 8.078 E140H-N 119.968 8.78 F141H-N 124.309 8.578 V142H-N 119.079 8.67 Q143H-N 119.389 7.857 M144H-N 118.088 7.607 M145H-N 114.977 7.534 T146H-N 110.157 7.699 A147H-N 127.009 7.62 K148H-N 126.291 7.888 R3H-N 121.415 8.503 R4H-N 121.897 8.321 G5H-N 109.784 8.685 R6H-N 121.897 8.623 G7H-N 109.682 8.926 G8H-N 109.428 8.263 F9H-N 125.427 9.266 Q10H-N 119.281 8.949 Q10HE21-NE2 111.761 7.516 Q10HE22-NE2 111.761 6.934 R11H-N 116.666 7.864 R11HE-NE 110.035 7.66 I12H-N 119.789 7.782 V13H-N 122.253 8.357 R14H-N 118.85 8.298 R14HE-NE 110.851 7.979 L15H-N 121.135 7.97 V16H-N 119.459 8.538 G17H-N 106.914 8.392 V18H-N 123.116 8.157 I19H-N 120.094 8.427 R20H-N 119.307 8.486 R20HE-NE 110.68 7.733 D21H-N 119.764 8.192 W22H-N 122.786 8.797 W22HE1-NE1 127.637 9.833 A23H-N 119.916 8.591 N24H-N 114.634 7.911 N24HD21-ND2 113.013 7.75 N24HD22-ND2 113.013 6.932 K25H-N 119.231 8.022 N26H-N 117.58 8.233 N26HD21-ND2 113.122 7.715 N26HD22-ND2 113.122 6.902 F27H-N 121.364 8.128 R28H-N 127.433 8.181 Q3H-N 119.968 8.346 L4H-N 123.078 8.261 T5H-N 112.994 8.651 E6H-N 120.514 8.975 E7H-N 119.386 8.609 Q8H-N 120.617 7.674 I9H-N 119.557 8.383 A10H-N 121.506 8.029 E11H-N 119.489 7.772 F12H-N 120.036 8.535 K13H-N 123.625 9.213 E14H-N 120.514 7.949 A15H-N 122.155 8.041 F16H-N 119.045 8.877 S17H-N 113.178 8.115 L18H-N 120.754 7.369 F19H-N 113.781 7.192 D20H-N 117.37 7.888 K21H-N 124.274 7.736 D22H-N 114.157 8.078 G23H-N 109.303 7.681 D24H-N 120.959 8.474 G25H-N 112.858 10.563 T26H-N 112.072 8.23 I27H-N 126.872 9.915 T28H-N 116.276 8.371 T29H-N 111.832 9.201 K30H-N 120.514 7.449 E31H-N 122.292 7.772 L32H-N 120.856 8.438 G33H-N 106.124 8.78 T34H-N 118.395 8.102 V35H-N 122.224 7.528 M36H-N 117.985 8.401 R37H-N 120.104 7.827 S38H-N 119.619 8.018 L39H-N 119.216 7.29 G40H-N 106.261 7.827 Q41H-N 118.464 7.846 N42H-N 116.243 8.648 T44H-N 112.413 8.633 E45H-N 120.651 8.774 A46H-N 120.72 8.218 E47H-N 118.942 7.676 L48H-N 119.831 8.059 Q49H-N 117.917 8.242 D50H-N 119.865 8.09 M51H-N 119.489 7.852 I52H-N 118.156 7.669 N53H-N 118.395 8.786 E54H-N 115.866 7.552 V55H-N 108.722 7.137 D56H-N 121.882 7.375 A57H-N 130.94 7.87 D58H-N 113.746 8.218 G59H-N 108.277 7.534 N60H-N 118.874 8.126 G61H-N 113.678 10.66 T62H-N 108.243 7.662 I63H-N 124.719 8.853 D64H-N 128.581 8.847 F65H-N 118.224 8.963 E67H-N 118.122 8.413 F68H-N 124.65 8.749 L69H-N 119.318 8.786 T70H-N 115.524 7.894 M71H-N 120.07 7.516 M72H-N 115.045 7.406 A73H-N 121.437 7.913 R74H-N 117.506 7.198 K75H-N 122.839 8.126 M76H-N 122.565 8.31 T79H-N 112.858 7.894 D80H-N 122.994 8.28 S81H-N 117.744 8.55 E82H-N 121.984 8.474 E83H-N 119.181 8.12 E84H-N 118.84 7.656 I85H-N 120.617 7.864 R86H-N 121.096 8.279 E87H-N 117.951 7.992 A88H-N 121.984 8.316 F89H-N 118.258 8.474 R90H-N 115.797 7.785 V91H-N 118.703 7.552 F92H-N 113.917 7.095 D93H-N 116.071 7.907 K94H-N 126.223 8.065 D95H-N 114.225 8.187 G96H-N 109.166 7.785 N97H-N 119.694 8.401 G98H-N 112.584 10.63 Y99H-N 116.242 7.711 I100H-N 127.189 10.149 S101H-N 123.557 8.969 A102H-N 123.078 9.225 A103H-N 118.429 8.218 E104H-N 120.494 7.919 L105H-N 120.959 8.261 R106H-N 117.575 8.615 H107H-N 119.933 8.161 V108H-N 118.566 7.901 M109H-N 115.148 8.145 T110H-N 115.421 8.45 N111H-N 122.805 7.907 L112H-N 119.01 7.736 G113H-N 105.68 7.675 E114H-N 120.549 7.913 K115H-N 124.65 8.505 L116H-N 125.026 8.035 T117H-N 114.054 9.036 D118H-N 121.061 8.853 E119H-N 119.216 8.658 E120H-N 120.07 7.705 D122H-N 119.993 8.054 E123H-N 119.079 8.572 M124H-N 119.762 7.833 I125H-N 117.869 7.994 R126H-N 118.532 8.401 E127H-N 116.584 8.022 A128H-N 118.053 7.247 D129H-N 117.944 8.012 I130H-N 127.864 8.31 D131H-N 116.96 8.371 G132H-N 108.243 7.662 D133H-N 120.856 8.395 G134H-N 112.653 10.208 Q135H-N 115.148 7.98 V136H-N 125.539 9.103 N137H-N 129.265 9.653 Y138H-N 118.556 8.273 E139H-N 118.464 8.053 E140H-N 119.762 8.743 F141H-N 123.796 8.621 V142H-N 118.994 8.669 Q143H-N 119.079 7.949 M144H-N 118.224 7.461 M145H-N 115.08 7.705 T146H-N 109.816 7.65 A147H-N 126.531 7.528 K148H-N 125.71 7.748 R3H-N 121.999 8.48 R4H-N 122.351 8.404 G5H-N 110.055 8.454 R6H-N 120.678 8.31 G7H-N 112.806 9.826 G8H-N 108.286 8.609 F9H-N 123.827 8.978 Q10H-N 121.313 9.137 Q10HE21-NE2 111.631 7.285 Q10HE22-NE2 111.631 7.0 R11H-N 116.996 7.811 I12H-N 120.018 7.805 V13H-N 120.907 8.21 R14H-N 119.612 8.327 L15H-N 121.922 8.21 V16H-N 117.758 8.409 G17H-N 107.473 8.333 V18H-N 122.583 8.063 I19H-N 119.637 7.934 R20H-N 117.224 8.597 R20HE-NE 110.3 7.73 D21H-N 120.094 8.357 W22H-N 121.415 7.987 W22HE1-NE1 127.878 10.033 A23H-N 119.256 7.917 N24H-N 115.142 8.046 N24HD21-ND2 113.32 7.749 N24HD22-ND2 113.32 6.974 K25H-N 120.348 7.999 N26H-N 117.961 8.245 N26HD21-ND2 113.164 7.467 N26HD22-ND2 113.164 6.902 F27H-N 120.323 8.128 R28H-N 126.392 7.835