Assignment w1 w2 K3H-N 124.855 8.483 V5H-N 120.806 8.259 S6H-N 119.332 8.345 L7H-N 124.942 8.334 S8H-N 116.07 8.198 Y9H-N 122.102 8.005 R10H-N 122.105 8.142 C11H-N 121.511 8.185 C13H-N 115.047 8.719 F15H-N 116.487 7.607 F16H-N 119.591 8.202 E17H-N 122.719 8.749 S18H-N 118.765 8.764 H19H-N 119.651 8.617 V20H-N 121.352 7.36 A21H-N 131.401 8.57 R22H-N 124.465 7.838 A23H-N 117.242 8.203 N24H-N 112.861 7.739 N24HD21-ND2 112.192 7.703 N24HD22-ND2 112.192 7.133 V25H-N 119.883 7.524 K26H-N 128.312 9.527 H27H-N 109.505 7.214 L28H-N 116.963 8.066 K29H-N 123.299 9.549 I30H-N 123.823 9.14 L31H-N 128.835 8.866 N32H-N 120.696 8.211 N32HD21-ND2 111.827 7.629 N32HD22-ND2 111.827 6.295 T33H-N 116.303 7.925 N35H-N 120.212 8.294 C36H-N 116.986 7.561 A37H-N 125.167 8.52 C38H-N 118.786 8.343 Q39H-N 128.825 8.988 Q39HE21-NE2 113.029 7.264 Q39HE22-NE2 113.029 6.894 I40H-N 124.006 8.967 V41H-N 125.973 9.13 A42H-N 128.264 9.558 R43H-N 121.647 7.707 L44H-N 128.821 9.183 K45H-N 119.659 8.449 R49H-N 120.086 7.926 Q50H-N 120.774 8.542 V51H-N 117.392 8.71 C52H-N 124.238 9.184 I53H-N 122.034 8.434 D54H-N 125.815 7.702 K56H-N 112.456 7.889 L57H-N 120.452 7.157 K58H-N 125.307 8.731 W59H-N 113.503 7.884 I60H-N 124.379 6.449 Q61H-N 118.966 7.646 Q61HE21-NE2 115.755 7.984 Q61HE22-NE2 115.755 7.127 E62H-N 117.105 8.075 Y63H-N 121.402 7.922 L64H-N 116.209 8.227 E65H-N 118.559 8.472 K66H-N 117.056 7.554 C67H-N 115.236 7.918 L68H-N 121.13 7.558 N69H-N 120.313 8.306 N69HD21-ND2 112.192 7.595 N69HD22-ND2 112.192 6.857 K70H-N 127.077 7.913 K3H-N 124.855 8.483 V5H-N 120.806 8.259 S6H-N 119.332 8.345 L7H-N 124.942 8.334 S8H-N 116.07 8.198 Y9H-N 122.102 8.005 R10H-N 122.105 8.142 C11H-N 121.511 8.185 C13H-N 115.047 8.719 F15H-N 116.487 7.607 F16H-N 119.591 8.202 E17H-N 122.719 8.749 S18H-N 118.765 8.764 H19H-N 119.651 8.617 V20H-N 121.352 7.36 A21H-N 131.401 8.57 R22H-N 124.465 7.838 A23H-N 117.242 8.203 N24H-N 112.861 7.739 N24HD21-ND2 112.192 7.703 N24HD22-ND2 112.192 7.133 V25H-N 119.883 7.529 K26H-N 128.312 9.527 H27H-N 109.505 7.214 L28H-N 116.963 8.068 K29H-N 123.299 9.549 I30H-N 123.823 9.138 L31H-N 128.835 8.866 N32H-N 120.696 8.211 N32HD21-ND2 111.827 7.629 N32HD22-ND2 111.827 6.295 T33H-N 116.303 7.925 N35H-N 120.212 8.294 C36H-N 116.986 7.561 A37H-N 125.167 8.52 C38H-N 118.786 8.343 Q39H-N 128.825 8.988 Q39HE21-NE2 113.029 7.264 Q39HE22-NE2 113.029 6.894 I40H-N 124.006 8.967 V41H-N 125.973 9.13 A42H-N 128.264 9.558 R43H-N 121.647 7.707 L44H-N 128.821 9.183 K45H-N 119.659 8.449 R49H-N 120.086 7.926 Q50H-N 120.774 8.542 V51H-N 117.392 8.71 C52H-N 124.238 9.184 I53H-N 122.034 8.434 D54H-N 125.815 7.702 K56H-N 112.456 7.889 L57H-N 120.452 7.157 K58H-N 125.307 8.731 W59H-N 113.503 7.884 I60H-N 124.379 6.449 Q61H-N 118.966 7.65 Q61HE21-NE2 115.755 7.984 Q61HE22-NE2 115.755 7.144 E62H-N 117.105 8.075 Y63H-N 121.402 7.922 L64H-N 116.209 8.231 E65H-N 118.559 8.467 K66H-N 117.056 7.554 C67H-N 115.236 7.925 L68H-N 121.13 7.541 N69H-N 120.313 8.306 N69HD21-ND2 112.192 7.595 N69HD22-ND2 112.192 6.857 K70H-N 127.077 7.913