Assignment w1 w2 Q2H-N 120.748 8.622 D3H-N 119.852 8.204 I4H-N 123.689 8.377 V5H-N 121.929 7.73 E6H-N 118.694 7.533 A7H-N 121.193 8.069 A8H-N 119.898 8.179 K9H-N 117.606 7.964 Q10H-N 115.555 8.101 Q10HE21-NE2 111.661 6.746 Q10HE22-NE2 111.661 7.669 A11H-N 121.725 8.468 A12H-N 118.62 8.407 I13H-N 115.097 7.761 A14H-N 121.989 7.864 I15H-N 119.994 8.228 F16H-N 115.172 7.14 Q17H-N 119.684 8.064 Q17HE21-NE2 110.817 7.656 Q17HE22-NE2 110.817 6.823 L18H-N 122.576 8.064 W19H-N 117.427 8.219 W19HE1-NE1 125.666 9.763 K20H-N 117.163 7.662 N21H-N 114.419 8.082 N21HD21-ND2 111.444 7.012 N21HD22-ND2 111.444 7.881 T23H-N 105.264 7.49 D24H-N 124.668 7.732 E26H-N 120.279 8.001 A27H-N 123.457 8.339 Q28H-N 113.697 7.553 Q28HE21-NE2 109.988 6.906 Q28HE22-NE2 109.988 6.783 E29H-N 118.749 7.823 L30H-N 119.025 7.583 L31H-N 116.984 8.095 N32H-N 116.487 8.382 N32HD21-ND2 111.711 7.482 N32HD22-ND2 111.711 6.78 K33H-N 115.371 7.351 I34H-N 114.075 7.461 L35H-N 118.962 8.237 S36H-N 117.652 8.366 D38H-N 114.189 8.688 V39H-N 122.338 7.457 L40H-N 121.9 8.361 D41H-N 118.18 8.137 Q42H-N 119.568 7.544 Q42HE21-NE2 110.653 7.465 Q42HE22-NE2 110.653 6.844 V43H-N 120.294 8.506 R44H-N 120.808 8.669 E45H-N 120.122 8.244 H46H-N 119.149 8.103 A47H-N 119.468 7.897 R48H-N 116.683 7.772 E49H-N 120.195 7.886 L50H-N 118.907 7.767 Q51H-N 116.39 7.676 Q51HE21-NE2 112.475 7.669 Q51HE22-NE2 112.475 6.912 K52H-N 119.682 8.082 Q53H-N 116.869 7.89 Q53HE21-NE2 111.269 7.507 Q53HE22-NE2 111.269 6.85 G54H-N 109.51 8.318 I55H-N 120.088 7.7 H56H-N 124.805 8.411 F57H-N 121.035 7.939 E58H-N 118.856 8.628 V59H-N 126.121 9.09 K60H-N 127.446 9.197 R61H-N 117.928 7.6 V62H-N 123.314 8.438 E63H-N 127.068 9.06 V64H-N 123.493 8.841 T65H-N 119.41 9.09 T66H-N 113.377 8.597 D67H-N 123.138 8.323 G68H-N 114.504 8.948 N69H-N 124.099 8.763 N69HD21-ND2 112.83 7.636 N69HD22-ND2 112.83 6.976 T70H-N 113.968 8.275 V71H-N 125.252 9.089 N72H-N 127.39 9.233 N72HD21-ND2 110.982 7.048 N72HD22-ND2 110.982 6.626 V73H-N 126.84 9.61 T74H-N 125.608 9.417 V75H-N 126.707 9.388 E76H-N 126.921 8.704 L77H-N 125.523 9.331 E78H-N 120.558 8.801 E79H-N 127.937 9.361 T80H-N 121.25 9.241 T81H-N 121.718 8.533 T84H-N 116.72 7.98 T85H-N 123.53 8.87 T86H-N 120.975 9.257 N87H-N 123.629 8.721 N87HD21-ND2 112.015 7.27 N87HD22-ND2 112.015 7.617 T88H-N 119.535 8.934 T89H-N 118.214 8.312 Y90H-N 124.975 9.315 E91H-N 119.897 9.049 L92H-N 128.209 9.668 R93H-N 123.079 8.658 F94H-N 126.142 9.635 E95H-N 122.951 8.561 V96H-N 124.179 8.757 D97H-N 125.835 8.772 G98H-N 115.487 8.932 D99H-N 124.966 8.573 T100H-N 113.312 7.787 I101H-N 124.833 8.915 R102H-N 126.453 8.914 R103H-N 117.381 7.578 V104H-N 122.852 8.54 T105H-N 121.207 8.356 V106H-N 126.668 8.939 T107H-N 121.583 9.038 Q108H-N 124.532 8.865 Q108HE21-NE2 111.205 6.905 Q108HE22-NE2 111.205 7.193 N109H-N 124.547 8.711 N109HD21-ND2 111.674 7.497 N109HD22-ND2 111.674 6.981 G110H-N 109.309 8.522 S112H-N 115.33 8.227 L113H-N 124.496 8.45 E114H-N 121.067 8.354