Assignment w1 w2 A3H-N 125.481 8.524 E4H-N 118.931 8.276 V6H-N 120.923 8.278 S7H-N 118.842 8.457 E8H-N 122.475 8.496 M9H-N 120.11 8.334 D10H-N 121.388 8.335 I11H-N 119.22 8.038 Y12H-N 122.149 8.216 E13H-N 120.149 8.697 E15H-N 120.832 8.625 S16H-N 118.49 9.268 W17H-N 116.331 7.967 W17HE1-NE1 129.728 10.311 V18H-N 122.413 6.896 S19H-N 115.239 7.718 C20H-N 115.76 7.267 L21H-N 116.267 7.325 D22H-N 123.716 7.178 Q25H-N 124.901 8.747 Q25HE21-NE2 111.281 7.432 Q25HE22-NE2 111.281 6.925 V26H-N 128.351 8.762 T27H-N 122.694 8.733 C28H-N 125.38 9.122 E29H-N 123.271 8.449 S30H-N 110.997 7.953 Q31H-N 125.052 9.068 Q31HE21-NE2 112.972 7.577 Q31HE22-NE2 112.972 6.863 E32H-N 119.207 8.163 G33H-N 106.528 8.195 T34H-N 110.45 8.419 H35H-N 114.095 9.077 A36H-N 120.247 9.326 S37H-N 116.207 9.1 Y38H-N 129.811 11.132 N39H-N 127.143 8.229 N39HD21-ND2 113.723 8.33 N39HD22-ND2 113.723 7.049 R40H-N 124.068 9.035 K41H-N 117.487 8.508 T42H-N 104.707 7.064 G43H-N 110.53 8.563 Q44H-N 114.27 7.244 Q44HE21-NE2 111.389 7.548 Q44HE22-NE2 111.389 6.931 C45H-N 119.831 9.115 E46H-N 119.776 9.154 Q48H-N 122.363 8.989 K49H-N 120.971 8.61 G50H-N 112.664 8.2 T51H-N 115.024 8.721 E52H-N 118.05 8.689 C53H-N 120.236 8.167 G54H-N 110.234 8.474 G55H-N 108.026 8.391 G56H-N 113.207 8.004 E57H-N 114.431 9.033 N58H-N 118.453 8.546 N58HD21-ND2 109.506 8.401 N58HD22-ND2 109.506 7.723 H59H-N 117.525 7.695 F60H-N 118.402 9.334 E61H-N 121.28 9.791 T62H-N 100.366 7.109 L63H-N 123.689 9.28 L64H-N 118.899 8.103 K65H-N 118.229 7.965 C66H-N 120.111 7.843 N67H-N 121.384 8.889 N67HD21-ND2 112.989 7.711 N67HD22-ND2 112.989 6.926 E68H-N 118.517 8.201 S69H-N 113.315 7.685 C70H-N 113.799 8.514 N71H-N 122.69 8.096 N71HD21-ND2 110.595 7.332 N71HD22-ND2 110.595 7.033 D72H-N 116.292 8.437 A73H-N 119.551 7.172 K75H-N 126.101 8.456 C78H-N 124.217 7.909 S79H-N 103.949 7.17 L80H-N 123.352 7.629 E81H-N 123.937 9.438 V82H-N 121.113 8.248 D83H-N 125.666 7.791 G85H-N 106.559 8.96 G87H-N 109.398 8.556 A89H-N 122.086 8.369 N90H-N 115.795 8.244 R93H-N 127.858 8.783 W94H-N 118.503 9.195 W94HE1-NE1 130.595 10.562 Y95H-N 122.008 10.32 Y96H-N 124.442 10.738 D97H-N 128.392 8.299 T98H-N 116.686 8.216 N99H-N 117.639 8.429 N99HD21-ND2 114.702 8.032 N99HD22-ND2 114.702 7.082 N100H-N 112.306 7.236 N100HD21-ND2 112.29 7.655 N100HD22-ND2 112.29 6.965 A101H-N 124.221 8.27 T102H-N 109.183 7.239 E104H-N 112.145 7.935 M105H-N 121.877 8.419 F106H-N 123.112 9.599 T107H-N 116.684 8.588 Y108H-N 130.214 9.17 G109H-N 113.961 9.149 G110H-N 108.066 7.66 I111H-N 115.921 8.359 N117H-N 117.782 6.348 N117HD21-ND2 111.661 7.308 N117HD22-ND2 111.661 6.754 F118H-N 123.834 10.294 E119H-N 120.248 9.53 S120H-N 108.952 7.61 E121H-N 123.04 7.967 E122H-N 117.148 8.569 E123H-N 119.647 7.926 C124H-N 120.236 7.278 K125H-N 120.498 8.664 E126H-N 116.053 7.92 T127H-N 114.626 7.518 C128H-N 119.659 8.171 K129H-N 118.53 7.419 G130H-N 106.413 8.458 F131H-N 118.831 7.72 S132H-N 117.651 9.177 L133H-N 123.561 8.745 L134H-N 115.053 7.719 K135H-N 121.359 8.991 K136H-N 124.038 8.606 V137H-N 120.755 8.281 N138H-N 122.739 8.639 N138HD21-ND2 112.78 7.665 N138HD22-ND2 112.78 7.014 V139H-N 120.648 8.255 T140H-N 118.918 8.393 I141H-N 123.87 8.327 N142H-N 127.955 8.119