Assignment w1 w2 A2H-N 123.32 8.691 D3H-N 117.21 8.454 D4H-N 118.836 7.929 E5H-N 120.263 8.203 E6H-N 121.664 8.414 R7H-N 122.093 8.118 E8H-N 121.021 8.459 T9H-N 106.438 8.096 G10H-N 109.328 9.163 I11H-N 118.281 8.749 E13H-N 132.184 9.311 K14H-N 116.379 7.627 L15H-N 124.118 8.498 L16H-N 127.153 8.468 H17H-N 120.25 8.309 S18H-N 119.952 9.242 G20H-N 104.916 7.6 F21H-N 112.033 8.494 I22H-N 124.504 9.614 Q23H-N 126.61 9.234 Q23HE21-NE2 111.607 7.812 Q23HE22-NE2 111.607 6.693 C24H-N 127.512 8.699 C25H-N 119.244 8.844 E26H-N 118.626 9.13 R27H-N 114.721 7.586 Q28H-N 120.06 8.511 Q28HE21-NE2 113.067 7.614 Q28HE22-NE2 113.067 6.788 A29H-N 124.846 8.045 R30H-N 122.668 8.425 L31H-N 124.583 9.177 F32H-N 125.775 8.573 F33H-N 122.96 7.558 H34H-N 121.989 9.343 F35H-N 125.734 7.676 S36H-N 118.242 9.204 Q37H-N 120.136 8.317 Q37HE21-NE2 114.685 7.832 Q37HE22-NE2 114.685 6.96 F38H-N 121.61 7.871 S39H-N 124.367 8.224 G40H-N 110.875 7.194 N41H-N 118.067 8.528 N41HD21-ND2 110.659 7.322 N41HD22-ND2 110.659 6.887 I42H-N 129.608 8.832 D43H-N 120.245 7.967 H44H-N 115.178 7.517 L45H-N 124.205 7.226 K46H-N 125.589 8.792 I47H-N 119.163 8.147 G48H-N 115.941 9.049 D49H-N 122.081 7.982 V51H-N 115.17 8.886 E52H-N 119.6 9.087 F53H-N 116.323 8.112 E54H-N 117.414 8.841 M55H-N 128.784 9.588 T56H-N 121.853 8.768 Y57H-N 117.799 8.318 D58H-N 125.681 8.892 R59H-N 127.483 8.968 R60H-N 118.142 8.607 T61H-N 106.018 7.924 G62H-N 111.417 8.425 K63H-N 120.125 7.615 I65H-N 118.448 8.933 A66H-N 122.9 8.701 S67H-N 115.15 8.891 V69H-N 120.244 8.301 S70H-N 119.95 9.16 K71H-N 122.67 8.974 I72H-N 124.57 7.844 A73H-N 128.623 8.339 V76H-N 120.52 8.034 V77H-N 124.977 8.236 L78H-N 127.421 8.489 S79H-N 116.882 8.241 E80H-N 122.857 8.612 E81H-N 120.181 8.076 R82H-N 122.633 8.295 V83H-N 122.06 8.484 T84H-N 111.194 7.836 G85H-N 109.282 8.93 T86H-N 115.873 8.695 V87H-N 126.873 9.036 T88H-N 123.807 9.072 T89H-N 117.488 8.069 E90H-N 125.302 8.916 L91H-N 120.132 8.012 R92H-N 123.395 8.235 T93H-N 115.238 8.361 D94H-N 122.224 8.415 S95H-N 115.79 8.242 A96H-N 125.116 8.27 N97H-N 115.936 8.169 N97HD21-ND2 112.868 7.606 N97HD22-ND2 112.868 6.866 N98H-N 118.34 8.267 N98HD21-ND2 113.147 7.655 N98HD22-ND2 113.147 6.861 V99H-N 119.774 8.043 L100H-N 124.3 8.181 N101H-N 118.44 8.333 N101HD21-ND2 112.849 7.589 N101HD22-ND2 112.849 6.897 S102H-N 115.658 8.245 S103H-N 117.261 8.379 E104H-N 121.614 8.267 T105H-N 114.192 8.066 T106H-N 115.198 7.91 G107H-N 111.546 7.845 R108H-N 119.575 8.91 I109H-N 125.953 9.308 S110H-N 121.399 9.397 Y111H-N 125.0 8.893 E112H-N 123.784 8.547 N113H-N 120.439 8.638 N113HD21-ND2 111.806 7.437 N113HD22-ND2 111.806 6.87 R114H-N 124.898 9.296 G115H-N 104.904 8.666 E116H-N 120.794 7.688 C117H-N 120.706 8.18 F118H-N 125.623 8.844 F119H-N 118.177 8.676 L120H-N 124.508 9.624 Y122H-N 113.18 7.298 T123H-N 111.801 9.372 K124H-N 120.559 9.072 D125H-N 116.213 7.709 D126H-N 117.198 7.814 V127H-N 119.597 7.217 E128H-N 128.978 8.963 G129H-N 109.864 8.679 N130H-N 116.193 8.583 N130HD21-ND2 112.015 7.502 N130HD22-ND2 112.015 6.852 V131H-N 115.619 6.799 N132H-N 122.782 8.52 N132HD21-ND2 113.446 7.515 N132HD22-ND2 113.446 6.941 L133H-N 124.08 8.42 R134H-N 124.263 9.398 A135H-N 123.365 9.16 G136H-N 112.161 9.222 D137H-N 123.05 8.458 K138H-N 122.367 8.559 V139H-N 116.196 8.658 S140H-N 114.533 9.301 F141H-N 115.889 8.508 Q142H-N 116.466 8.845 Q142HE21-NE2 111.72 7.667 Q142HE22-NE2 111.72 6.844 I143H-N 124.249 8.884 A144H-N 130.666 8.77 T145H-N 115.552 8.469 N146H-N 124.65 8.647 N146HD21-ND2 111.355 7.718 N146HD22-ND2 111.355 7.14 Q147H-N 117.627 8.749 Q147HE21-NE2 112.418 7.54 Q147HE22-NE2 112.418 6.879 R148H-N 116.793 7.675 G149H-N 106.591 7.999 N150H-N 118.208 7.793 L151H-N 122.832 8.457 G152H-N 109.277 8.656 A153H-N 121.934 7.893 C154H-N 115.731 8.976 H155H-N 118.812 8.983 I156H-N 120.031 8.855 R157H-N 124.904 9.037 L158H-N 123.252 8.685 E159H-N 125.873 8.731 N160H-N 118.197 8.113 N160HD21-ND2 112.576 7.569 N160HD22-ND2 112.576 6.91 A162H-N 124.499 8.74 Q163H-N 120.246 8.286 V165H-N 124.104 7.736