NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
502985 |
2l9s   |
17485 | cing | 1-original | 3 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 4}
( segid "PAH2" and resid 325 and name HD% )
( segid "PF1 " and resid 217 and name HB% )
4.100 2.100 1.900 peak 4 spectrum 1 weight 0.10000E+01 volume 0.44415E-03 ppm1 1.374 ppm2 7.047 CV 1
ASSI { 7}
(( segid "PAH2" and resid 307 and name HA ))
( segid "PF1 " and resid 213 and name HD2%)
4.300 2.300 1.700 peak 7 spectrum 1 weight 0.10000E+01 volume 0.33548E-03 ppm1 0.634 ppm2 3.999 CV 1
ASSI { 8}
(( segid "PAH2" and resid 311 and name HA ))
( segid "PF1 " and resid 213 and name HD2%)
4.200 2.200 1.800 peak 8 spectrum 1 weight 0.10000E+01 volume 0.38119E-03 ppm1 0.641 ppm2 3.414 CV 1
OR { 8}
(( segid "PAH2" and resid 308 and name HA ))
( segid "PF1 " and resid 213 and name HD2%)
ASSI { 14}
( segid "PAH2" and resid 304 and name HE% )
( segid "PF1 " and resid 217 and name HB% )
3.800 3.800 2.200 peak 14 spectrum 1 weight 0.10000E+01 volume 0.60025E-03 ppm1 1.378 ppm2 7.231 CV 1
OR { 14}
( segid "PAH2" and resid 376 and name HE% )
( segid "PF1 " and resid 217 and name HB% )
ASSI { 15}
(( segid "PAH2" and resid 332 and name HA ))
( segid "PF1 " and resid 214 and name HG2%)
4.000 2.000 2.000 peak 15 spectrum 1 weight 0.10000E+01 volume 0.53557E-03 ppm1 0.790 ppm2 3.914 CV 1
ASSI { 16}
(( segid "PAH2" and resid 336 and name HG1 ))
( segid "PF1 " and resid 214 and name HG2%)
3.500 1.500 1.500 peak 16 spectrum 1 weight 0.10000E+01 volume 0.83569E-03 ppm1 0.804 ppm2 2.513 CV 1
ASSI { 17}
(( segid "PAH2" and resid 303 and name HG2 ))
( segid "PF1 " and resid 212 and name HD2%)
3.400 1.400 1.400 peak 17 spectrum 1 weight 0.10000E+01 volume 0.11470E-02 ppm1 0.871 ppm2 2.357 CV 1
OR { 17}
(( segid "PAH2" and resid 303 and name HG1 ))
( segid "PF1 " and resid 212 and name HD2%)
ASSI { 19}
( segid "PAH2" and resid 307 and name HB% )
( segid "PF1 " and resid 212 and name HD2%)
3.400 1.500 1.500 peak 19 spectrum 1 weight 0.10000E+01 volume 0.98316E-03 ppm1 0.883 ppm2 1.373 CV 1
ASSI { 22}
(( segid "PAH2" and resid 304 and name HA ))
( segid "PF1 " and resid 212 and name HD2%)
3.400 1.500 1.500 peak 22 spectrum 1 weight 0.10000E+01 volume 0.13023E-02 ppm1 0.863 ppm2 4.340 CV 1
ASSI { 23}
(( segid "PAH2" and resid 304 and name HB2 ))
( segid "PF1 " and resid 212 and name HD2%)
4.100 2.100 1.900 peak 23 spectrum 1 weight 0.10000E+01 volume 0.50193E-03 ppm1 0.871 ppm2 3.179 CV 1
OR { 23}
(( segid "PAH2" and resid 304 and name HB1 ))
( segid "PF1 " and resid 212 and name HD2%)
ASSI { 24}
( segid "PAH2" and resid 304 and name HD% )
( segid "PF1 " and resid 212 and name HD2%)
3.200 1.200 1.200 peak 24 spectrum 1 weight 0.10000E+01 volume 0.27943E-02 ppm1 0.866 ppm2 7.203 CV 1
ASSI { 27}
( segid "PAH2" and resid 304 and name HD% )
(( segid "PF1 " and resid 219 and name HB2 ))
3.600 3.600 2.400 peak 27 spectrum 1 weight 0.10000E+01 volume 0.87967E-03 ppm1 2.164 ppm2 7.197 CV 1
OR { 27}
( segid "PAH2" and resid 304 and name HD% )
(( segid "PF1 " and resid 211 and name HB1 ))
ASSI { 28}
( segid "PAH2" and resid 308 and name HD1%)
(( segid "PF1 " and resid 219 and name HB2 ))
3.600 1.600 1.600 peak 28 spectrum 1 weight 0.10000E+01 volume 0.44070E-03 ppm1 2.158 ppm2 0.612 CV 1
ASSI { 29}
(( segid "PAH2" and resid 303 and name HB1 ))
( segid "PF1 " and resid 212 and name HD1%)
3.300 1.400 1.400 peak 29 spectrum 1 weight 0.10000E+01 volume 0.10177E-02 ppm1 0.945 ppm2 2.166 CV 1
ASSI { 30}
( segid "PAH2" and resid 302 and name HG2%)
( segid "PF1 " and resid 212 and name HD1%)
4.200 2.200 1.800 peak 30 spectrum 1 weight 0.10000E+01 volume 0.41914E-03 ppm1 0.937 ppm2 0.914 CV 1
ASSI { 31}
(( segid "PAH2" and resid 303 and name HB2 ))
( segid "PF1 " and resid 212 and name HD1%)
3.700 1.700 1.700 peak 31 spectrum 1 weight 0.10000E+01 volume 0.13109E-02 ppm1 0.948 ppm2 2.039 CV 1
ASSI { 32}
(( segid "PAH2" and resid 303 and name HG2 ))
( segid "PF1 " and resid 212 and name HD1%)
3.600 1.600 1.600 peak 32 spectrum 1 weight 0.10000E+01 volume 0.80292E-03 ppm1 0.946 ppm2 2.362 CV 1
OR { 32}
(( segid "PAH2" and resid 303 and name HG1 ))
( segid "PF1 " and resid 212 and name HD1%)
ASSI { 33}
(( segid "PAH2" and resid 304 and name HA ))
( segid "PF1 " and resid 212 and name HD1%)
3.200 1.300 1.300 peak 33 spectrum 1 weight 0.10000E+01 volume 0.12764E-02 ppm1 0.948 ppm2 4.352 CV 1
ASSI { 35}
( segid "PAH2" and resid 304 and name HD% )
( segid "PF1 " and resid 212 and name HD1%)
3.700 1.700 1.700 peak 35 spectrum 1 weight 0.10000E+01 volume 0.72616E-03 ppm1 0.947 ppm2 7.203 CV 1
ASSI { 36}
( segid "PAH2" and resid 307 and name HB% )
( segid "PF1 " and resid 212 and name HD1%)
4.200 2.200 1.800 peak 36 spectrum 1 weight 0.10000E+01 volume 0.30271E-03 ppm1 0.942 ppm2 1.390 CV 1
ASSI { 37}
( segid "PAH2" and resid 307 and name HB% )
(( segid "PF1 " and resid 213 and name HA ))
3.000 1.100 1.100 peak 37 spectrum 1 weight 0.10000E+01 volume 0.20353E-02 ppm1 3.833 ppm2 1.377 CV 1
ASSI { 38}
(( segid "PAH2" and resid 376 and name HZ ))
( segid "PF1 " and resid 213 and name HD1%)
3.900 1.900 1.900 peak 38 spectrum 1 weight 0.10000E+01 volume 0.44587E-03 ppm1 0.771 ppm2 6.826 CV 1
OR { 38}
( segid "PAH2" and resid 328 and name HD% )
( segid "PF1 " and resid 213 and name HD1%)
OR { 38}
( segid "PAH2" and resid 310 and name HE% )
( segid "PF1 " and resid 213 and name HD1%)
ASSI { 39}
( segid "PAH2" and resid 328 and name HE% )
( segid "PF1 " and resid 213 and name HD1%)
3.600 1.600 1.600 peak 39 spectrum 1 weight 0.10000E+01 volume 0.73996E-03 ppm1 0.771 ppm2 6.976 CV 1
ASSI { 40}
( segid "PAH2" and resid 376 and name HE% )
( segid "PF1 " and resid 213 and name HD1%)
3.000 1.100 1.100 peak 40 spectrum 1 weight 0.10000E+01 volume 0.21388E-02 ppm1 0.771 ppm2 7.194 CV 1
ASSI { 41}
( segid "PAH2" and resid 332 and name HD1%)
( segid "PF1 " and resid 213 and name HD1%)
3.500 1.600 1.600 peak 41 spectrum 1 weight 0.10000E+01 volume 0.52780E-03 ppm1 0.773 ppm2 0.494 CV 1
ASSI { 42}
( segid "PAH2" and resid 307 and name HB% )
( segid "PF1 " and resid 213 and name HD2%)
3.100 1.200 1.200 peak 42 spectrum 1 weight 0.10000E+01 volume 0.16817E-02 ppm1 0.639 ppm2 1.376 CV 1
ASSI { 43}
( segid "PAH2" and resid 311 and name HG2%)
( segid "PF1 " and resid 213 and name HD2%)
2.900 1.000 1.000 peak 43 spectrum 1 weight 0.10000E+01 volume 0.28891E-02 ppm1 0.642 ppm2 1.057 CV 1
ASSI { 44}
( segid "PAH2" and resid 332 and name HD2%)
( segid "PF1 " and resid 213 and name HD2%)
3.700 1.700 1.700 peak 44 spectrum 1 weight 0.10000E+01 volume 0.35963E-03 ppm1 0.638 ppm2 0.375 CV 1
ASSI { 45}
( segid "PAH2" and resid 310 and name HE% )
( segid "PF1 " and resid 213 and name HD2%)
3.300 1.300 1.300 peak 45 spectrum 1 weight 0.10000E+01 volume 0.11729E-02 ppm1 0.643 ppm2 6.821 CV 1
OR { 45}
(( segid "PAH2" and resid 376 and name HZ ))
( segid "PF1 " and resid 213 and name HD2%)
OR { 45}
( segid "PAH2" and resid 359 and name HE% )
( segid "PF1 " and resid 213 and name HD2%)
ASSI { 46}
( segid "PAH2" and resid 310 and name HD% )
( segid "PF1 " and resid 213 and name HD2%)
3.000 1.100 1.100 peak 46 spectrum 1 weight 0.10000E+01 volume 0.19922E-02 ppm1 0.640 ppm2 6.953 CV 1
ASSI { 47}
( segid "PAH2" and resid 376 and name HE% )
( segid "PF1 " and resid 213 and name HD2%)
3.000 1.100 1.100 peak 47 spectrum 1 weight 0.10000E+01 volume 0.15006E-02 ppm1 0.640 ppm2 7.191 CV 1
ASSI { 48}
(( segid "PAH2" and resid 336 and name HB2 ))
( segid "PF1 " and resid 214 and name HD1%)
3.700 1.700 1.700 peak 48 spectrum 1 weight 0.10000E+01 volume 0.45536E-03 ppm1 0.586 ppm2 2.259 CV 1
ASSI { 49}
( segid "PAH2" and resid 335 and name HD% )
( segid "PF1 " and resid 214 and name HD1%)
3.300 1.300 1.300 peak 49 spectrum 1 weight 0.10000E+01 volume 0.13023E-02 ppm1 0.591 ppm2 6.844 CV 1
ASSI { 50}
( segid "PAH2" and resid 335 and name HE% )
( segid "PF1 " and resid 214 and name HD1%)
3.500 1.500 1.500 peak 50 spectrum 1 weight 0.10000E+01 volume 0.10780E-02 ppm1 0.586 ppm2 6.698 CV 1
ASSI { 51}
( segid "PAH2" and resid 304 and name HE% )
( segid "PF1 " and resid 215 and name HB% )
2.800 1.000 1.000 peak 51 spectrum 1 weight 0.10000E+01 volume 0.32168E-02 ppm1 1.562 ppm2 7.234 CV 1
ASSI { 52}
( segid "PAH2" and resid 304 and name HE% )
(( segid "PF1 " and resid 216 and name HA ))
2.900 1.100 1.100 peak 52 spectrum 1 weight 0.10000E+01 volume 0.26821E-02 ppm1 3.971 ppm2 7.214 CV 1
ASSI { 53}
(( segid "PAH2" and resid 308 and name HG12))
(( segid "PF1 " and resid 216 and name HA ))
3.400 1.400 1.400 peak 53 spectrum 1 weight 0.10000E+01 volume 0.10004E-02 ppm1 3.993 ppm2 0.777 CV 1
OR { 53}
( segid "PAH2" and resid 308 and name HG2%)
(( segid "PF1 " and resid 216 and name HA ))
ASSI { 54}
( segid "PAH2" and resid 308 and name HD1%)
(( segid "PF1 " and resid 216 and name HA ))
3.700 1.700 1.700 peak 54 spectrum 1 weight 0.10000E+01 volume 0.66148E-03 ppm1 3.985 ppm2 0.604 CV 1
ASSI { 55}
( segid "PAH2" and resid 304 and name HE% )
( segid "PF1 " and resid 216 and name HB% )
3.100 1.200 1.200 peak 55 spectrum 1 weight 0.10000E+01 volume 0.21043E-02 ppm1 1.194 ppm2 7.224 CV 1
OR { 55}
( segid "PAH2" and resid 304 and name HD% )
( segid "PF1 " and resid 216 and name HB% )
ASSI { 56}
( segid "PAH2" and resid 307 and name HB% )
( segid "PF1 " and resid 216 and name HB% )
2.800 1.000 1.000 peak 56 spectrum 1 weight 0.10000E+01 volume 0.29409E-02 ppm1 1.194 ppm2 1.379 CV 1
ASSI { 57}
(( segid "PAH2" and resid 308 and name HA ))
( segid "PF1 " and resid 216 and name HB% )
3.000 1.100 1.100 peak 57 spectrum 1 weight 0.10000E+01 volume 0.20871E-02 ppm1 1.196 ppm2 3.422 CV 1
ASSI { 58}
(( segid "PAH2" and resid 308 and name HG12))
( segid "PF1 " and resid 216 and name HB% )
3.000 1.100 1.100 peak 58 spectrum 1 weight 0.10000E+01 volume 0.20008E-02 ppm1 1.194 ppm2 0.781 CV 1
ASSI { 59}
( segid "PAH2" and resid 308 and name HD1%)
( segid "PF1 " and resid 216 and name HB% )
3.300 1.400 1.400 peak 59 spectrum 1 weight 0.10000E+01 volume 0.16127E-02 ppm1 1.191 ppm2 0.614 CV 1
ASSI { 60}
( segid "PAH2" and resid 311 and name HG2%)
( segid "PF1 " and resid 216 and name HB% )
2.900 1.000 1.000 peak 60 spectrum 1 weight 0.10000E+01 volume 0.26476E-02 ppm1 1.196 ppm2 1.055 CV 1
ASSI { 61}
( segid "PAH2" and resid 311 and name HG1%)
(( segid "PF1 " and resid 217 and name HA ))
2.900 1.000 1.000 peak 61 spectrum 1 weight 0.10000E+01 volume 0.25700E-02 ppm1 4.023 ppm2 1.079 CV 1
OR { 61}
( segid "PAH2" and resid 311 and name HG2%)
(( segid "PF1 " and resid 217 and name HA ))
ASSI { 62}
( segid "PAH2" and resid 311 and name HG2%)
( segid "PF1 " and resid 217 and name HB% )
3.200 1.200 1.200 peak 62 spectrum 1 weight 0.10000E+01 volume 0.21216E-02 ppm1 1.369 ppm2 1.068 CV 1
OR { 62}
( segid "PAH2" and resid 311 and name HG1%)
( segid "PF1 " and resid 217 and name HB% )
ASSI { 63}
( segid "PAH2" and resid 329 and name HD1%)
( segid "PF1 " and resid 217 and name HB% )
2.800 1.000 1.000 peak 63 spectrum 1 weight 0.10000E+01 volume 0.35014E-02 ppm1 1.372 ppm2 0.739 CV 1
ASSI { 64}
( segid "PAH2" and resid 332 and name HD2%)
( segid "PF1 " and resid 217 and name HB% )
3.000 1.100 1.100 peak 64 spectrum 1 weight 0.10000E+01 volume 0.24320E-02 ppm1 1.369 ppm2 0.367 CV 1
ASSI { 65}
( segid "PAH2" and resid 304 and name HE% )
(( segid "PF1 " and resid 219 and name HG2 ))
3.600 1.600 1.600 peak 65 spectrum 1 weight 0.10000E+01 volume 0.10177E-02 ppm1 2.341 ppm2 7.209 CV 1
OR { 65}
( segid "PAH2" and resid 304 and name HE% )
(( segid "PF1 " and resid 219 and name HG1 ))
ASSI { 66}
( segid "PAH2" and resid 308 and name HD1%)
(( segid "PF1 " and resid 219 and name HG2 ))
3.400 1.400 1.400 peak 66 spectrum 1 weight 0.10000E+01 volume 0.68132E-03 ppm1 2.329 ppm2 0.614 CV 1
OR { 66}
( segid "PAH2" and resid 308 and name HD1%)
(( segid "PF1 " and resid 219 and name HG1 ))
ASSI { 67}
( segid "PAH2" and resid 308 and name HD1%)
(( segid "PF1 " and resid 220 and name HG2 ))
3.700 1.800 1.800 peak 67 spectrum 1 weight 0.10000E+01 volume 0.49417E-03 ppm1 1.697 ppm2 0.615 CV 1
OR { 67}
( segid "PAH2" and resid 308 and name HD1%)
(( segid "PF1 " and resid 220 and name HG1 ))
ASSI { 68}
( segid "PAH2" and resid 308 and name HG2%)
(( segid "PF1 " and resid 220 and name HG1 ))
3.200 1.300 1.300 peak 68 spectrum 1 weight 0.10000E+01 volume 0.14661E-02 ppm1 1.684 ppm2 0.809 CV 1
OR { 68}
( segid "PAH2" and resid 308 and name HG2%)
(( segid "PF1 " and resid 220 and name HG2 ))
ASSI { 69}
( segid "PAH2" and resid 311 and name HG1%)
(( segid "PF1 " and resid 220 and name HG1 ))
3.600 1.700 1.700 peak 69 spectrum 1 weight 0.10000E+01 volume 0.67528E-03 ppm1 1.694 ppm2 1.080 CV 1
OR { 69}
( segid "PAH2" and resid 311 and name HG1%)
(( segid "PF1 " and resid 220 and name HG2 ))
ASSI { 71}
( segid "PAH2" and resid 329 and name HD2%)
(( segid "PF1 " and resid 224 and name HG2 ))
3.300 1.400 1.400 peak 71 spectrum 1 weight 0.10000E+01 volume 0.72271E-03 ppm1 2.103 ppm2 0.599 CV 1
OR { 71}
( segid "PAH2" and resid 329 and name HD2%)
(( segid "PF1 " and resid 224 and name HG1 ))
ASSI { 72}
(( segid "PAH2" and resid 336 and name HB2 ))
( segid "PF1 " and resid 214 and name HG2%)
3.300 1.300 1.300 peak 72 spectrum 1 weight 0.10000E+01 volume 0.11384E-02 ppm1 0.798 ppm2 2.248 CV 1
ASSI { 73}
( segid "PAH2" and resid 325 and name HE% )
( segid "PF1 " and resid 217 and name HB% )
3.800 1.800 1.800 peak 73 spectrum 1 weight 0.10000E+01 volume 0.55109E-03 ppm1 1.367 ppm2 6.819 CV 1
OR { 73}
( segid "PAH2" and resid 328 and name HD% )
( segid "PF1 " and resid 217 and name HB% )
ASSI { 74}
( segid "PAH2" and resid 329 and name HD2%)
(( segid "PF1 " and resid 221 and name HB2 ))
3.900 1.900 1.900 peak 74 spectrum 1 weight 0.10000E+01 volume 0.53643E-03 ppm1 2.765 ppm2 0.600 CV 1
ASSI { 75}
( segid "PAH2" and resid 329 and name HD2%)
(( segid "PF1 " and resid 221 and name HB1 ))
3.900 1.900 1.900 peak 75 spectrum 1 weight 0.10000E+01 volume 0.38895E-03 ppm1 2.851 ppm2 0.604 CV 1
ASSI { 76}
( segid "PAH2" and resid 308 and name HD1%)
(( segid "PF1 " and resid 220 and name HD2 ))
3.400 1.500 1.500 peak 76 spectrum 1 weight 0.10000E+01 volume 0.60628E-03 ppm1 3.216 ppm2 0.604 CV 1
OR { 76}
( segid "PAH2" and resid 308 and name HD1%)
(( segid "PF1 " and resid 220 and name HD1 ))
ASSI { 77}
( segid "PAH2" and resid 308 and name HG2%)
(( segid "PF1 " and resid 220 and name HD2 ))
3.400 1.400 1.400 peak 77 spectrum 1 weight 0.10000E+01 volume 0.10953E-02 ppm1 3.219 ppm2 0.784 CV 1
OR { 77}
( segid "PAH2" and resid 308 and name HG2%)
(( segid "PF1 " and resid 220 and name HD1 ))
ASSI { 78}
( segid "PAH2" and resid 311 and name HG1%)
(( segid "PF1 " and resid 220 and name HD1 ))
3.400 1.400 1.400 peak 78 spectrum 1 weight 0.10000E+01 volume 0.65286E-03 ppm1 3.220 ppm2 1.077 CV 1
OR { 78}
( segid "PAH2" and resid 311 and name HG1%)
(( segid "PF1 " and resid 220 and name HD2 ))
ASSI { 79}
(( segid "PAH2" and resid 332 and name HA ))
( segid "PF1 " and resid 214 and name HD1%)
3.700 1.700 1.700 peak 79 spectrum 1 weight 0.10000E+01 volume 0.67700E-03 ppm1 0.588 ppm2 3.878 CV 1
ASSI { 80}
(( segid "PAH2" and resid 336 and name HA ))
( segid "PF1 " and resid 214 and name HD1%)
3.700 1.700 1.700 peak 80 spectrum 1 weight 0.10000E+01 volume 0.66665E-03 ppm1 0.590 ppm2 3.949 CV 1
ASSI { 81}
( segid "PAH2" and resid 304 and name HD% )
(( segid "PF1 " and resid 212 and name HA ))
3.600 1.600 1.600 peak 81 spectrum 1 weight 0.10000E+01 volume 0.87105E-03 ppm1 4.137 ppm2 7.222 CV 1
OR { 81}
( segid "PAH2" and resid 304 and name HE% )
(( segid "PF1 " and resid 212 and name HA ))
ASSI { 82}
( segid "PAH2" and resid 329 and name HD1%)
( segid "PF1 " and resid 218 and name HE% )
3.500 1.500 1.500 peak 82 spectrum 1 weight 0.10000E+01 volume 0.57006E-03 ppm1 1.954 ppm2 0.734 CV 1
ASSI { 83}
(( segid "PAH2" and resid 333 and name HD2 ))
( segid "PF1 " and resid 218 and name HE% )
4.200 2.200 1.800 peak 83 spectrum 1 weight 0.10000E+01 volume 0.30444E-03 ppm1 1.966 ppm2 7.271 CV 1
ASSI { 84}
(( segid "PAH2" and resid 333 and name HA ))
( segid "PF1 " and resid 218 and name HE% )
4.800 2.900 1.200 peak 84 spectrum 1 weight 0.10000E+01 volume 0.14230E-03 ppm1 1.951 ppm2 4.400 CV 1
ASSI { 6}
( segid "PF1 " and resid 206 and name HD2%)
(( segid "PAH2" and resid 300 and name HG2 ))
3.300 1.400 1.400 peak 6 spectrum 1 weight 0.10000E+01 volume 0.13958E-02 ppm1 2.249 ppm2 0.866 CV 1
ASSI { 15}
( segid "PF1 " and resid 206 and name HD2%)
(( segid "PAH2" and resid 299 and name HB2 ))
3.400 1.400 1.400 peak 15 spectrum 1 weight 0.10000E+01 volume 0.12961E-02 ppm1 2.791 ppm2 0.870 CV 1
ASSI { 16}
( segid "PF1 " and resid 206 and name HD1%)
(( segid "PAH2" and resid 301 and name HG1 ))
4.100 2.100 1.900 peak 16 spectrum 1 weight 0.10000E+01 volume 0.48819E-03 ppm1 2.059 ppm2 0.896 CV 1
OR { 16}
( segid "PF1 " and resid 206 and name HD2%)
(( segid "PAH2" and resid 301 and name HG1 ))
OR { 16}
( segid "PF1 " and resid 206 and name HD1%)
(( segid "PAH2" and resid 301 and name HG2 ))
OR { 16}
( segid "PF1 " and resid 206 and name HD2%)
(( segid "PAH2" and resid 301 and name HG2 ))
ASSI { 17}
( segid "PF1 " and resid 212 and name HD1%)
(( segid "PAH2" and resid 303 and name HG2 ))
3.400 1.400 1.400 peak 17 spectrum 1 weight 0.10000E+01 volume 0.11724E-02 ppm1 2.368 ppm2 0.933 CV 1
OR { 17}
( segid "PF1 " and resid 212 and name HD1%)
(( segid "PAH2" and resid 303 and name HG1 ))
ASSI { 18}
( segid "PF1 " and resid 212 and name HD2%)
(( segid "PAH2" and resid 304 and name HB2 ))
3.700 1.700 1.700 peak 18 spectrum 1 weight 0.10000E+01 volume 0.93169E-03 ppm1 3.162 ppm2 0.890 CV 1
OR { 18}
( segid "PF1 " and resid 212 and name HD2%)
(( segid "PAH2" and resid 304 and name HB1 ))
ASSI { 19}
( segid "PF1 " and resid 217 and name HB% )
( segid "PAH2" and resid 307 and name HB% )
4.100 2.100 1.900 peak 19 spectrum 1 weight 0.10000E+01 volume 0.55351E-03 ppm1 1.387 ppm2 1.398 CV 1
ASSI { 20}
(( segid "PF1 " and resid 212 and name HA ))
( segid "PAH2" and resid 307 and name HB% )
4.600 2.600 1.400 peak 20 spectrum 1 weight 0.10000E+01 volume 0.25991E-03 ppm1 1.386 ppm2 4.133 CV 1
ASSI { 21}
( segid "PF1 " and resid 212 and name HD2%)
( segid "PAH2" and resid 307 and name HB% )
3.100 1.200 1.200 peak 21 spectrum 1 weight 0.10000E+01 volume 0.20284E-02 ppm1 1.386 ppm2 0.888 CV 1
ASSI { 22}
(( segid "PF1 " and resid 213 and name HA ))
( segid "PAH2" and resid 307 and name HB% )
3.200 1.300 1.300 peak 22 spectrum 1 weight 0.10000E+01 volume 0.14818E-02 ppm1 1.385 ppm2 3.837 CV 1
ASSI { 23}
( segid "PF1 " and resid 213 and name HD2%)
( segid "PAH2" and resid 307 and name HB% )
3.100 1.200 1.200 peak 23 spectrum 1 weight 0.10000E+01 volume 0.16502E-02 ppm1 1.382 ppm2 0.639 CV 1
ASSI { 24}
(( segid "PF1 " and resid 216 and name HA ))
( segid "PAH2" and resid 307 and name HB% )
4.600 2.600 1.400 peak 24 spectrum 1 weight 0.10000E+01 volume 0.35067E-03 ppm1 1.381 ppm2 3.961 CV 1
ASSI { 25}
( segid "PF1 " and resid 216 and name HB% )
( segid "PAH2" and resid 307 and name HB% )
3.000 1.100 1.100 peak 25 spectrum 1 weight 0.10000E+01 volume 0.20284E-02 ppm1 1.386 ppm2 1.186 CV 1
ASSI { 26}
( segid "PF1 " and resid 216 and name HB% )
(( segid "PAH2" and resid 308 and name HA ))
3.400 1.400 1.400 peak 26 spectrum 1 weight 0.10000E+01 volume 0.96951E-03 ppm1 3.411 ppm2 1.194 CV 1
ASSI { 27}
( segid "PF1 " and resid 216 and name HB% )
(( segid "PAH2" and resid 308 and name HB ))
5.000 3.100 1.000 peak 27 spectrum 1 weight 0.10000E+01 volume 0.25991E-03 ppm1 1.841 ppm2 1.202 CV 1
ASSI { 28}
(( segid "PF1 " and resid 216 and name HA ))
(( segid "PAH2" and resid 308 and name HG11))
4.900 3.000 1.100 peak 28 spectrum 1 weight 0.10000E+01 volume 0.16262E-03 ppm1 1.236 ppm2 3.977 CV 1
ASSI { 29}
( segid "PF1 " and resid 216 and name HB% )
(( segid "PAH2" and resid 308 and name HG11))
3.800 1.900 1.900 peak 29 spectrum 1 weight 0.10000E+01 volume 0.45381E-03 ppm1 1.234 ppm2 1.193 CV 1
ASSI { 30}
(( segid "PF1 " and resid 216 and name HA ))
(( segid "PAH2" and resid 308 and name HG12))
4.600 2.600 1.400 peak 30 spectrum 1 weight 0.10000E+01 volume 0.16296E-03 ppm1 0.787 ppm2 3.980 CV 1
ASSI { 31}
( segid "PF1 " and resid 216 and name HB% )
(( segid "PAH2" and resid 308 and name HG12))
3.900 1.900 1.900 peak 31 spectrum 1 weight 0.10000E+01 volume 0.39881E-03 ppm1 0.778 ppm2 1.194 CV 1
ASSI { 32}
(( segid "PF1 " and resid 212 and name HB2 ))
( segid "PAH2" and resid 308 and name HD1%)
4.600 2.600 1.400 peak 32 spectrum 1 weight 0.10000E+01 volume 0.35067E-03 ppm1 0.635 ppm2 1.401 CV 1
ASSI { 33}
( segid "PF1 " and resid 212 and name HD2%)
( segid "PAH2" and resid 308 and name HD1%)
4.500 2.600 1.500 peak 33 spectrum 1 weight 0.10000E+01 volume 0.29635E-03 ppm1 0.634 ppm2 0.851 CV 1
ASSI { 34}
(( segid "PF1 " and resid 216 and name HA ))
( segid "PAH2" and resid 308 and name HD1%)
3.400 1.500 1.500 peak 34 spectrum 1 weight 0.10000E+01 volume 0.10623E-02 ppm1 0.627 ppm2 3.979 CV 1
ASSI { 35}
( segid "PF1 " and resid 216 and name HB% )
( segid "PAH2" and resid 308 and name HD1%)
3.300 1.400 1.400 peak 35 spectrum 1 weight 0.10000E+01 volume 0.16365E-02 ppm1 0.627 ppm2 1.193 CV 1
ASSI { 36}
(( segid "PF1 " and resid 219 and name HB2 ))
( segid "PAH2" and resid 308 and name HD1%)
4.200 2.200 1.800 peak 36 spectrum 1 weight 0.10000E+01 volume 0.42631E-03 ppm1 0.628 ppm2 2.161 CV 1
ASSI { 37}
(( segid "PF1 " and resid 219 and name HG2 ))
( segid "PAH2" and resid 308 and name HD1%)
4.000 2.000 2.000 peak 37 spectrum 1 weight 0.10000E+01 volume 0.44694E-03 ppm1 0.626 ppm2 2.330 CV 1
OR { 37}
(( segid "PF1 " and resid 219 and name HG1 ))
( segid "PAH2" and resid 308 and name HD1%)
ASSI { 38}
(( segid "PF1 " and resid 220 and name HB1 ))
( segid "PAH2" and resid 308 and name HD1%)
4.500 2.500 1.500 peak 38 spectrum 1 weight 0.10000E+01 volume 0.40568E-03 ppm1 0.628 ppm2 1.997 CV 1
ASSI { 39}
(( segid "PF1 " and resid 220 and name HG2 ))
( segid "PAH2" and resid 308 and name HD1%)
3.600 1.600 1.600 peak 39 spectrum 1 weight 0.10000E+01 volume 0.11002E-02 ppm1 0.627 ppm2 1.698 CV 1
OR { 39}
(( segid "PF1 " and resid 220 and name HG1 ))
( segid "PAH2" and resid 308 and name HD1%)
ASSI { 40}
(( segid "PF1 " and resid 220 and name HD2 ))
( segid "PAH2" and resid 308 and name HD1%)
4.000 2.000 2.000 peak 40 spectrum 1 weight 0.10000E+01 volume 0.60852E-03 ppm1 0.630 ppm2 3.215 CV 1
OR { 40}
(( segid "PF1 " and resid 220 and name HD1 ))
( segid "PAH2" and resid 308 and name HD1%)
ASSI { 41}
(( segid "PF1 " and resid 220 and name HG1 ))
( segid "PAH2" and resid 308 and name HG2%)
3.700 1.700 1.700 peak 41 spectrum 1 weight 0.10000E+01 volume 0.50538E-03 ppm1 0.808 ppm2 1.713 CV 1
ASSI { 42}
(( segid "PF1 " and resid 216 and name HA ))
( segid "PAH2" and resid 308 and name HG2%)
5.000 3.100 1.000 peak 42 spectrum 1 weight 0.10000E+01 volume 0.19081E-03 ppm1 0.807 ppm2 3.989 CV 1
OR { 42}
(( segid "PF1 " and resid 217 and name HA ))
( segid "PAH2" and resid 308 and name HG2%)
ASSI { 43}
( segid "PF1 " and resid 216 and name HB% )
( segid "PAH2" and resid 308 and name HG2%)
4.100 2.100 1.900 peak 43 spectrum 1 weight 0.10000E+01 volume 0.73229E-03 ppm1 0.809 ppm2 1.197 CV 1
ASSI { 44}
(( segid "PF1 " and resid 220 and name HB1 ))
( segid "PAH2" and resid 308 and name HG2%)
4.900 3.100 1.100 peak 44 spectrum 1 weight 0.10000E+01 volume 0.21453E-03 ppm1 0.810 ppm2 1.974 CV 1
ASSI { 45}
(( segid "PF1 " and resid 220 and name HD2 ))
( segid "PAH2" and resid 308 and name HG2%)
3.500 1.600 1.600 peak 45 spectrum 1 weight 0.10000E+01 volume 0.84574E-03 ppm1 0.809 ppm2 3.216 CV 1
OR { 45}
(( segid "PF1 " and resid 220 and name HD1 ))
( segid "PAH2" and resid 308 and name HG2%)
ASSI { 46}
( segid "PF1 " and resid 216 and name HB% )
(( segid "PAH2" and resid 311 and name HB ))
4.100 2.200 1.900 peak 46 spectrum 1 weight 0.10000E+01 volume 0.50538E-03 ppm1 2.193 ppm2 1.202 CV 1
ASSI { 47}
(( segid "PF1 " and resid 217 and name HA ))
(( segid "PAH2" and resid 311 and name HB ))
5.400 3.600 0.600 peak 47 spectrum 1 weight 0.10000E+01 volume 0.12170E-03 ppm1 2.196 ppm2 4.027 CV 1
ASSI { 48}
( segid "PF1 " and resid 217 and name HB% )
(( segid "PAH2" and resid 311 and name HB ))
4.900 2.900 1.100 peak 48 spectrum 1 weight 0.10000E+01 volume 0.25544E-03 ppm1 2.194 ppm2 1.383 CV 1
ASSI { 50}
(( segid "PF1 " and resid 213 and name HA ))
( segid "PAH2" and resid 311 and name HG1%)
4.500 2.500 1.500 peak 50 spectrum 1 weight 0.10000E+01 volume 0.34105E-03 ppm1 1.069 ppm2 3.837 CV 1
OR { 50}
(( segid "PF1 " and resid 214 and name HA ))
( segid "PAH2" and resid 311 and name HG1%)
ASSI { 51}
( segid "PF1 " and resid 213 and name HD2%)
( segid "PAH2" and resid 311 and name HG1%)
3.300 1.400 1.400 peak 51 spectrum 1 weight 0.10000E+01 volume 0.21178E-02 ppm1 1.054 ppm2 0.641 CV 1
ASSI { 52}
( segid "PF1 " and resid 216 and name HB% )
( segid "PAH2" and resid 311 and name HG1%)
3.200 1.200 1.200 peak 52 spectrum 1 weight 0.10000E+01 volume 0.23619E-02 ppm1 1.065 ppm2 1.206 CV 1
ASSI { 53}
(( segid "PF1 " and resid 217 and name HA ))
( segid "PAH2" and resid 311 and name HG1%)
3.100 1.200 1.200 peak 53 spectrum 1 weight 0.10000E+01 volume 0.16984E-02 ppm1 1.061 ppm2 4.034 CV 1
ASSI { 54}
( segid "PF1 " and resid 217 and name HB% )
( segid "PAH2" and resid 311 and name HG1%)
3.200 1.200 1.200 peak 54 spectrum 1 weight 0.10000E+01 volume 0.24616E-02 ppm1 1.064 ppm2 1.384 CV 1
ASSI { 56}
(( segid "PF1 " and resid 220 and name HB2 ))
( segid "PAH2" and resid 311 and name HG2%)
3.700 1.700 1.700 peak 56 spectrum 1 weight 0.10000E+01 volume 0.77698E-03 ppm1 1.098 ppm2 1.767 CV 1
ASSI { 57}
(( segid "PF1 " and resid 220 and name HG1 ))
( segid "PAH2" and resid 311 and name HG2%)
3.700 1.700 1.700 peak 57 spectrum 1 weight 0.10000E+01 volume 0.90419E-03 ppm1 1.098 ppm2 1.699 CV 1
OR { 57}
(( segid "PF1 " and resid 220 and name HG2 ))
( segid "PAH2" and resid 311 and name HG2%)
ASSI { 59}
( segid "PF1 " and resid 213 and name HD2%)
( segid "PAH2" and resid 311 and name HG2%)
3.900 1.900 1.900 peak 59 spectrum 1 weight 0.10000E+01 volume 0.46413E-03 ppm1 1.096 ppm2 0.637 CV 1
ASSI { 60}
( segid "PF1 " and resid 216 and name HB% )
( segid "PAH2" and resid 311 and name HG2%)
3.300 1.400 1.400 peak 60 spectrum 1 weight 0.10000E+01 volume 0.12033E-02 ppm1 1.102 ppm2 1.211 CV 1
ASSI { 61}
(( segid "PF1 " and resid 217 and name HA ))
( segid "PAH2" and resid 311 and name HG2%)
3.200 1.200 1.200 peak 61 spectrum 1 weight 0.10000E+01 volume 0.16949E-02 ppm1 1.096 ppm2 4.029 CV 1
ASSI { 62}
( segid "PF1 " and resid 217 and name HB% )
( segid "PAH2" and resid 311 and name HG2%)
3.200 1.200 1.200 peak 62 spectrum 1 weight 0.10000E+01 volume 0.18599E-02 ppm1 1.096 ppm2 1.372 CV 1
ASSI { 63}
(( segid "PF1 " and resid 220 and name HD2 ))
( segid "PAH2" and resid 311 and name HG2%)
4.500 2.500 1.500 peak 63 spectrum 1 weight 0.10000E+01 volume 0.36443E-03 ppm1 1.095 ppm2 3.221 CV 1
OR { 63}
(( segid "PF1 " and resid 220 and name HD1 ))
( segid "PAH2" and resid 311 and name HG2%)
ASSI { 64}
(( segid "PF1 " and resid 220 and name HB1 ))
( segid "PAH2" and resid 311 and name HG2%)
5.000 3.200 1.000 peak 64 spectrum 1 weight 0.10000E+01 volume 0.19562E-03 ppm1 1.099 ppm2 1.960 CV 1
ASSI { 69}
(( segid "PF1 " and resid 217 and name HA ))
( segid "PAH2" and resid 329 and name HD1%)
3.900 1.900 1.900 peak 69 spectrum 1 weight 0.10000E+01 volume 0.55351E-03 ppm1 0.752 ppm2 4.030 CV 1
OR { 69}
(( segid "PF1 " and resid 218 and name HA ))
( segid "PAH2" and resid 329 and name HD1%)
ASSI { 70}
( segid "PF1 " and resid 217 and name HB% )
( segid "PAH2" and resid 329 and name HD1%)
2.900 1.000 1.000 peak 70 spectrum 1 weight 0.10000E+01 volume 0.27504E-02 ppm1 0.751 ppm2 1.377 CV 1
ASSI { 71}
( segid "PF1 " and resid 218 and name HE% )
( segid "PAH2" and resid 329 and name HD1%)
4.000 2.000 2.000 peak 71 spectrum 1 weight 0.10000E+01 volume 0.51913E-03 ppm1 0.752 ppm2 1.960 CV 1
OR { 71}
(( segid "PF1 " and resid 218 and name HB2 ))
( segid "PAH2" and resid 329 and name HD1%)
ASSI { 73}
(( segid "PF1 " and resid 224 and name HG2 ))
( segid "PAH2" and resid 329 and name HD1%)
4.800 2.900 1.200 peak 73 spectrum 1 weight 0.10000E+01 volume 0.19046E-03 ppm1 0.751 ppm2 2.090 CV 1
OR { 73}
(( segid "PF1 " and resid 224 and name HG1 ))
( segid "PAH2" and resid 329 and name HD1%)
ASSI { 74}
( segid "PF1 " and resid 225 and name HE% )
( segid "PAH2" and resid 329 and name HD1%)
3.600 1.600 1.600 peak 74 spectrum 1 weight 0.10000E+01 volume 0.10451E-02 ppm1 0.750 ppm2 7.148 CV 1
ASSI { 75}
(( segid "PF1 " and resid 225 and name HZ ))
( segid "PAH2" and resid 329 and name HD1%)
3.900 1.900 1.900 peak 75 spectrum 1 weight 0.10000E+01 volume 0.67384E-03 ppm1 0.750 ppm2 7.249 CV 1
ASSI { 76}
( segid "PF1 " and resid 217 and name HB% )
( segid "PAH2" and resid 329 and name HD2%)
4.100 2.100 1.900 peak 76 spectrum 1 weight 0.10000E+01 volume 0.43662E-03 ppm1 0.612 ppm2 1.377 CV 1
ASSI { 77}
(( segid "PF1 " and resid 221 and name HB1 ))
( segid "PAH2" and resid 329 and name HD2%)
3.900 1.900 1.900 peak 77 spectrum 1 weight 0.10000E+01 volume 0.38505E-03 ppm1 0.610 ppm2 2.849 CV 1
ASSI { 78}
(( segid "PF1 " and resid 221 and name HB2 ))
( segid "PAH2" and resid 329 and name HD2%)
4.000 2.000 2.000 peak 78 spectrum 1 weight 0.10000E+01 volume 0.44350E-03 ppm1 0.610 ppm2 2.785 CV 1
ASSI { 79}
(( segid "PF1 " and resid 224 and name HB1 ))
( segid "PAH2" and resid 329 and name HD2%)
3.700 1.800 1.800 peak 79 spectrum 1 weight 0.10000E+01 volume 0.90419E-03 ppm1 0.613 ppm2 1.908 CV 1
OR { 79}
(( segid "PF1 " and resid 224 and name HB2 ))
( segid "PAH2" and resid 329 and name HD2%)
ASSI { 80}
(( segid "PF1 " and resid 224 and name HG2 ))
( segid "PAH2" and resid 329 and name HD2%)
3.700 1.800 1.800 peak 80 spectrum 1 weight 0.10000E+01 volume 0.62915E-03 ppm1 0.609 ppm2 2.098 CV 1
OR { 80}
(( segid "PF1 " and resid 224 and name HG1 ))
( segid "PAH2" and resid 329 and name HD2%)
ASSI { 81}
( segid "PF1 " and resid 225 and name HE% )
( segid "PAH2" and resid 329 and name HD2%)
4.000 2.000 2.000 peak 81 spectrum 1 weight 0.10000E+01 volume 0.39193E-03 ppm1 0.612 ppm2 7.156 CV 1
ASSI { 83}
( segid "PF1 " and resid 210 and name HD% )
( segid "PAH2" and resid 332 and name HD1%)
4.600 2.600 1.400 peak 83 spectrum 1 weight 0.10000E+01 volume 0.27229E-03 ppm1 0.514 ppm2 7.043 CV 1
ASSI { 84}
( segid "PF1 " and resid 210 and name HE% )
( segid "PAH2" and resid 332 and name HD1%)
3.500 1.500 1.500 peak 84 spectrum 1 weight 0.10000E+01 volume 0.10005E-02 ppm1 0.516 ppm2 6.667 CV 1
OR { 84}
(( segid "PF1 " and resid 210 and name HZ ))
( segid "PAH2" and resid 332 and name HD1%)
ASSI { 85}
(( segid "PF1 " and resid 214 and name HG12))
( segid "PAH2" and resid 332 and name HD1%)
2.900 1.100 1.100 peak 85 spectrum 1 weight 0.10000E+01 volume 0.18256E-02 ppm1 0.517 ppm2 0.649 CV 1
ASSI { 86}
( segid "PF1 " and resid 214 and name HG2%)
( segid "PAH2" and resid 332 and name HD1%)
3.200 1.300 1.300 peak 86 spectrum 1 weight 0.10000E+01 volume 0.17327E-02 ppm1 0.522 ppm2 0.783 CV 1
OR { 86}
( segid "PF1 " and resid 213 and name HD1%)
( segid "PAH2" and resid 332 and name HD1%)
ASSI { 87}
( segid "PF1 " and resid 217 and name HB% )
( segid "PAH2" and resid 332 and name HD1%)
3.600 1.600 1.600 peak 87 spectrum 1 weight 0.10000E+01 volume 0.92482E-03 ppm1 0.516 ppm2 1.358 CV 1
OR { 87}
(( segid "PF1 " and resid 213 and name HG ))
( segid "PAH2" and resid 332 and name HD1%)
ASSI { 89}
( segid "PF1 " and resid 214 and name HG2%)
( segid "PAH2" and resid 332 and name HD2%)
3.300 1.400 1.400 peak 89 spectrum 1 weight 0.10000E+01 volume 0.13821E-02 ppm1 0.380 ppm2 0.787 CV 1
OR { 89}
( segid "PF1 " and resid 213 and name HD1%)
( segid "PAH2" and resid 332 and name HD2%)
ASSI { 90}
(( segid "PF1 " and resid 214 and name HG12))
( segid "PAH2" and resid 332 and name HD2%)
3.200 1.300 1.300 peak 90 spectrum 1 weight 0.10000E+01 volume 0.12652E-02 ppm1 0.378 ppm2 0.635 CV 1
ASSI { 92}
( segid "PF1 " and resid 217 and name HB% )
( segid "PAH2" and resid 332 and name HD2%)
3.000 1.100 1.100 peak 92 spectrum 1 weight 0.10000E+01 volume 0.22209E-02 ppm1 0.381 ppm2 1.367 CV 1
ASSI { 94}
( segid "PF1 " and resid 225 and name HE% )
( segid "PAH2" and resid 332 and name HD2%)
4.100 2.100 1.900 peak 94 spectrum 1 weight 0.10000E+01 volume 0.39881E-03 ppm1 0.378 ppm2 7.143 CV 1
ASSI { 95}
(( segid "PF1 " and resid 210 and name HZ ))
( segid "PAH2" and resid 358 and name HG2%)
3.500 1.500 1.500 peak 95 spectrum 1 weight 0.10000E+01 volume 0.11139E-02 ppm1 0.823 ppm2 6.690 CV 1
ASSI { 97}
(( segid "PF1 " and resid 210 and name HA ))
(( segid "PAH2" and resid 379 and name HB2 ))
4.700 2.800 1.300 peak 97 spectrum 1 weight 0.10000E+01 volume 0.25957E-03 ppm1 2.671 ppm2 4.453 CV 1
ASSI { 98}
( segid "PF1 " and resid 213 and name HD1%)
(( segid "PAH2" and resid 379 and name HB2 ))
4.400 2.500 1.600 peak 98 spectrum 1 weight 0.10000E+01 volume 0.34173E-03 ppm1 2.652 ppm2 0.790 CV 1
ASSI { 99}
(( segid "PF1 " and resid 210 and name HA ))
( segid "PAH2" and resid 380 and name HD2%)
4.700 2.800 1.300 peak 99 spectrum 1 weight 0.10000E+01 volume 0.18840E-03 ppm1 0.473 ppm2 4.443 CV 1
ASSI { 100}
(( segid "PF1 " and resid 210 and name HB1 ))
( segid "PAH2" and resid 380 and name HD2%)
5.800 4.200 0.200 peak 100 spectrum 1 weight 0.10000E+01 volume 0.16365E-03 ppm1 0.475 ppm2 3.578 CV 1
ASSI { 101}
(( segid "PF1 " and resid 210 and name HB2 ))
( segid "PAH2" and resid 380 and name HD2%)
4.500 2.600 1.500 peak 101 spectrum 1 weight 0.10000E+01 volume 0.21522E-03 ppm1 0.472 ppm2 2.896 CV 1
ASSI { 102}
( segid "PF1 " and resid 210 and name HD% )
( segid "PAH2" and resid 380 and name HD2%)
3.600 1.600 1.600 peak 102 spectrum 1 weight 0.10000E+01 volume 0.74604E-03 ppm1 0.479 ppm2 7.056 CV 1
ASSI { 103}
( segid "PF1 " and resid 210 and name HE% )
( segid "PAH2" and resid 380 and name HD2%)
3.500 1.600 1.600 peak 103 spectrum 1 weight 0.10000E+01 volume 0.82511E-03 ppm1 0.480 ppm2 6.645 CV 1
ASSI { 105}
( segid "PF1 " and resid 214 and name HD1%)
(( segid "PAH2" and resid 336 and name HG1 ))
4.400 2.500 1.600 peak 105 spectrum 1 weight 0.10000E+01 volume 0.20147E-03 ppm1 2.535 ppm2 0.588 CV 1
ASSI { 106}
( segid "PF1 " and resid 214 and name HG2%)
(( segid "PAH2" and resid 336 and name HG1 ))
4.000 2.000 2.000 peak 106 spectrum 1 weight 0.10000E+01 volume 0.41600E-03 ppm1 2.531 ppm2 0.800 CV 1
ASSI { 108}
( segid "PF1 " and resid 214 and name HD1%)
(( segid "PAH2" and resid 336 and name HG2 ))
4.900 3.000 1.100 peak 108 spectrum 1 weight 0.10000E+01 volume 0.19940E-03 ppm1 2.272 ppm2 0.590 CV 1
ASSI { 109}
( segid "PF1 " and resid 214 and name HG2%)
(( segid "PAH2" and resid 336 and name HG2 ))
3.900 1.900 1.900 peak 109 spectrum 1 weight 0.10000E+01 volume 0.74948E-03 ppm1 2.275 ppm2 0.782 CV 1
ASSI { 110}
( segid "PF1 " and resid 206 and name HD2%)
(( segid "PAH2" and resid 300 and name HG1 ))
3.800 1.800 1.800 peak 110 spectrum 1 weight 0.10000E+01 volume 0.63603E-03 ppm1 2.355 ppm2 0.870 CV 1
ASSI { 111}
( segid "PF1 " and resid 214 and name HG2%)
(( segid "PAH2" and resid 336 and name HB1 ))
5.200 3.400 0.800 peak 111 spectrum 1 weight 0.10000E+01 volume 0.14508E-03 ppm1 2.463 ppm2 0.795 CV 1
ASSI { 112}
( segid "PF1 " and resid 214 and name HG2%)
(( segid "PAH2" and resid 336 and name HB2 ))
3.600 1.700 1.700 peak 112 spectrum 1 weight 0.10000E+01 volume 0.62571E-03 ppm1 2.218 ppm2 0.813 CV 1
ASSI { 113}
( segid "PF1 " and resid 206 and name HD1%)
(( segid "PAH2" and resid 300 and name HB2 ))
3.300 1.300 1.300 peak 113 spectrum 1 weight 0.10000E+01 volume 0.13030E-02 ppm1 1.961 ppm2 0.914 CV 1
ASSI { 114}
( segid "PF1 " and resid 206 and name HD1%)
(( segid "PAH2" and resid 300 and name HB1 ))
3.500 1.600 1.600 peak 114 spectrum 1 weight 0.10000E+01 volume 0.10726E-02 ppm1 2.173 ppm2 0.917 CV 1
ASSI { 115}
( segid "PF1 " and resid 212 and name HD1%)
(( segid "PAH2" and resid 303 and name HB2 ))
4.000 2.000 2.000 peak 115 spectrum 1 weight 0.10000E+01 volume 0.73573E-03 ppm1 2.050 ppm2 0.938 CV 1
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