Assignment w1 w2 A6H-N 126.296 8.356 G7H-N 108.319 8.366 A8H-N 124.567 8.037 L9H-N 121.507 8.119 E10H-N 119.664 8.748 S11H-N 112.229 7.89 S12H-N 118.305 7.797 L13H-N 122.085 8.209 D14H-N 118.289 8.149 R15H-N 117.904 7.36 K16H-N 119.344 8.027 F17H-N 115.977 8.375 Q18H-N 117.467 7.071 Q18HE21-NE2 111.351 6.907 Q18HE22-NE2 111.351 6.63 S19H-N 109.286 6.963 V20H-N 123.721 6.89 T21H-N 119.822 8.337 N22H-N 115.079 8.168 N22HD21-ND2 112.008 7.592 N22HD22-ND2 112.008 7.152 T23H-N 111.528 7.958 M24H-N 121.093 8.71 E25H-N 115.84 8.369 S26H-N 115.037 7.734 I27H-N 117.832 7.93 Q28H-N 115.616 8.602 Q28HE21-NE2 112.56 7.892 Q28HE22-NE2 112.56 6.749 G29H-N 106.783 7.833 L30H-N 123.696 7.523 S31H-N 118.503 8.85 S32H-N 113.91 8.091 W33H-N 123.15 7.671 W33HE1-NE1 130.103 10.023 C34H-N 119.026 8.786 I35H-N 117.942 7.762 E36H-N 121.82 8.12 N37H-N 117.566 7.147 N37HD21-ND2 114.364 6.021 N37HD22-ND2 114.364 5.709 K38H-N 116.229 6.806 K39H-N 123.098 8.608 H40H-N 117.513 8.058 H41H-N 119.375 7.434 S42H-N 115.564 6.85 T43H-N 120.133 7.478 I44H-N 124.141 8.566 V45H-N 119.75 8.188 Y46H-N 120.166 8.101 H47H-N 118.337 8.616 W48H-N 125.925 8.945 W48HE1-NE1 126.845 9.623 M49H-N 118.029 8.322 K50H-N 120.661 7.765 W51H-N 117.863 7.874 W51HE1-NE1 130.592 11.57 L52H-N 127.681 8.663 R53H-N 115.029 8.001 R54H-N 112.56 6.798 S55H-N 115.792 6.982 A56H-N 123.483 8.622 Y57H-N 116.573 7.908 H59H-N 116.959 7.211 R60H-N 117.688 8.297 L61H-N 118.32 7.681 N62H-N 118.217 6.964 N62HD21-ND2 110.356 7.597 N62HD22-ND2 110.356 6.887 L63H-N 118.641 8.018 F64H-N 127.057 8.707 Y65H-N 121.782 8.818 L66H-N 120.659 8.018 A67H-N 120.969 8.224 N68H-N 112.73 8.927 N68HD21-ND2 110.315 8.687 N68HD22-ND2 110.315 5.719 D69H-N 121.518 8.269 V70H-N 117.767 8.177 I71H-N 118.699 8.856 Q72H-N 116.054 8.264 N73H-N 114.327 7.8 N73HD21-ND2 114.043 7.125 N73HD22-ND2 114.043 7.001 C74H-N 114.085 8.252 K75H-N 124.288 6.545 R76H-N 120.284 8.639 K77H-N 115.413 6.775 N78H-N 114.542 7.769 N78HD21-ND2 112.231 7.568 N78HD22-ND2 112.231 6.775 A79H-N 119.975 8.266 I80H-N 121.339 7.677 I81H-N 124.363 8.031 F82H-N 117.256 7.589 R83H-N 117.375 8.384 E84H-N 121.199 7.325 S85H-N 116.177 8.271 F86H-N 116.731 8.524 A87H-N 120.69 7.476 D88H-N 112.681 6.889 V89H-N 107.235 7.161 L90H-N 122.908 7.564 E92H-N 118.158 7.482 A93H-N 121.402 8.469 A94H-N 118.867 8.963 A95H-N 114.668 6.906 L96H-N 117.102 7.607 V97H-N 111.993 7.186 K98H-N 114.324 7.23 D99H-N 120.042 6.455 S101H-N 114.865 8.362 V102H-N 111.617 7.376 S103H-N 119.027 8.342 K104H-N 121.187 8.143 S105H-N 117.029 7.323 V106H-N 122.876 7.393 E107H-N 120.512 8.373 R108H-N 117.86 7.068 I109H-N 118.948 6.894 F110H-N 115.822 7.262 K111H-N 120.689 7.863 I112H-N 121.979 8.085 W113H-N 118.835 8.661 W113HE1-NE1 126.716 10.762 E114H-N 121.624 8.328 D115H-N 122.168 8.987 R116H-N 114.998 7.919 R116HE-NE 83.303 6.74 N117H-N 117.004 7.884 N117HD21-ND2 111.491 7.368 N117HD22-ND2 111.491 6.724 V118H-N 118.482 8.686 Y119H-N 111.298 6.782 E121H-N 123.446 8.923 E122H-N 115.569 9.297 M123H-N 119.596 7.108 I124H-N 119.296 7.458 V125H-N 119.302 8.498 A126H-N 121.606 6.986 L127H-N 119.764 7.981 R128H-N 117.87 8.183 E129H-N 120.2 8.252 A130H-N 122.062 7.526 L131H-N 115.909 7.411 S132H-N 111.419 7.446 T133H-N 116.073 8.09