Assignment w1 w2 A5H-N 125.629 8.362 S6H-N 114.872 8.494 M7H-N 121.99 8.55 E8H-N 119.636 8.546 D9H-N 120.559 8.038 L10H-N 121.721 8.121 Q11H-N 119.951 8.47 Q11HE21-NE2 110.971 6.978 Q11HE22-NE2 110.971 7.216 A12H-N 122.293 7.876 E13H-N 118.79 8.137 A14H-N 123.4 8.277 R15H-N 114.353 8.025 A16H-N 119.536 7.631 F17H-N 117.975 7.854 L18H-N 118.203 7.626 S19H-N 116.496 7.944 E20H-N 121.478 9.092 E21H-N 119.539 8.902 M22H-N 120.929 7.755 I23H-N 118.523 8.127 A24H-N 120.266 7.923 E25H-N 120.982 7.759 F26H-N 120.29 8.757 K27H-N 121.71 9.297 A28H-N 119.589 7.768 A29H-N 119.198 7.411 F30H-N 118.845 8.466 D31H-N 115.711 8.952 M32H-N 117.938 7.442 F33H-N 115.212 7.526 D34H-N 121.938 7.388 A35H-N 126.308 8.231 D36H-N 113.706 8.396 G37H-N 109.791 7.994 G38H-N 109.755 8.606 G39H-N 112.33 10.213 D40H-N 117.339 7.941 I41H-N 113.627 8.652 S42H-N 115.899 8.486 Y43H-N 119.738 8.321 K44H-N 118.116 8.314 A45H-N 122.264 7.861 V46H-N 118.195 7.579 G47H-N 104.831 8.014 T48H-N 119.639 7.52 V49H-N 124.261 7.929 F50H-N 116.642 8.373 R51H-N 118.587 7.799 M52H-N 120.953 8.465 L53H-N 117.624 7.946 G54H-N 108.442 7.969 I55H-N 121.238 8.225 N56H-N 125.557 8.705 N56HD21-ND2 113.151 6.867 N56HD22-ND2 113.151 7.566 S58H-N 117.243 7.934 K59H-N 122.546 8.81 E60H-N 117.041 8.713 V61H-N 120.869 7.541 L62H-N 120.412 8.022 D63H-N 120.602 8.775 Y64H-N 122.683 7.759 L65H-N 119.067 8.243 K66H-N 117.994 7.857 E67H-N 116.184 7.929 K68H-N 116.318 7.749 I69H-N 115.191 7.524 D70H-N 119.154 8.02 V71H-N 122.03 8.494 D72H-N 118.189 8.112 G73H-N 110.43 8.218 S74H-N 115.761 8.514 G75H-N 121.667 9.3 T76H-N 110.14 7.926 I77H-N 117.456 7.938 D78H-N 125.339 8.759 F79H-N 118.628 8.579 E80H-N 116.362 7.934 E81H-N 119.77 8.333 F82H-N 120.976 8.634 L83H-N 118.479 8.116 V84H-N 118.437 7.352 L85H-N 120.973 7.806 M86H-N 116.554 8.163 V87H-N 120.184 8.186 Y88H-N 120.397 7.951 I89H-N 118.401 8.074 M90H-N 119.196 8.38 K91H-N 118.284 8.069 Q92H-N 118.566 7.538 Q92HE21-NE2 112.356 6.517 Q92HE22-NE2 112.356 7.082 D93H-N 120.48 7.968 A94H-N 129.186 7.642