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OrdParsPOPG.dat
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OrdParsPOPG.dat
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# OP_name resname atom1 atom2 OP_mean OP_stddev OP_stem
#--------------------------------------------------------------------
gamma1 POPG C13 H13B -0.01344 0.07927 0.00701
beta1 POPG C12 H12A -0.01895 0.11047 0.00976
alpha1 POPG C11 H11A 0.01172 0.15947 0.01409
alpha2 POPG C11 H11B -0.01031 0.14128 0.01249
g3_1 POPG C1 HA 0.04977 0.29734 0.02628
g3_2 POPG C1 HB 0.18914 0.27566 0.02436
g2_1 POPG C2 HS 0.04449 0.30529 0.02698
g1_1 POPG C3 HX 0.07729 0.28321 0.02503
g1_2 POPG C3 HY -0.14261 0.21120 0.01867
palmitoyl_C2a POPG C32 H2X -0.24140 0.09221 0.00815
palmitoyl_C2b POPG C32 H2Y -0.24411 0.08726 0.00771
palmitoyl_C3a POPG C33 H3X -0.22863 0.06770 0.00598
palmitoyl_C3b POPG C33 H3Y -0.24602 0.06045 0.00534
palmitoyl_C4a POPG C34 H4X -0.26665 0.03811 0.00337
palmitoyl_C4b POPG C34 H4Y -0.26806 0.04428 0.00391
palmitoyl_C5a POPG C35 H5X -0.26579 0.03413 0.00302
palmitoyl_C5b POPG C35 H5Y -0.26548 0.03804 0.00336
palmitoyl_C6a POPG C36 H6X -0.27515 0.03235 0.00286
palmitoyl_C6b POPG C36 H6Y -0.27494 0.03311 0.00293
palmitoyl_C7a POPG C37 H7X -0.26775 0.03507 0.00310
palmitoyl_C7b POPG C37 H7Y -0.26827 0.03465 0.00306
palmitoyl_C8a POPG C38 H8X -0.26628 0.03525 0.00312
palmitoyl_C8b POPG C38 H8Y -0.26654 0.03479 0.00308
palmitoyl_C9a POPG C39 H9X -0.25402 0.03835 0.00339
palmitoyl_C9b POPG C39 H9Y -0.25389 0.03792 0.00335
palmitoyl_C10a POPG C310 H10X -0.24343 0.03869 0.00342
palmitoyl_C10b POPG C310 H10Y -0.24348 0.03824 0.00338
palmitoyl_C11a POPG C311 H11X -0.22371 0.04264 0.00377
palmitoyl_C11b POPG C311 H11Y -0.22474 0.04207 0.00372
palmitoyl_C12a POPG C312 H12X -0.20585 0.04190 0.00370
palmitoyl_C12b POPG C312 H12Y -0.20664 0.04145 0.00366
palmitoyl_C13a POPG C313 H13X -0.17927 0.04265 0.00377
palmitoyl_C13b POPG C313 H13Y -0.17950 0.04254 0.00376
palmitoyl_C14a POPG C314 H14X -0.15154 0.03717 0.00329
palmitoyl_C14b POPG C314 H14Y -0.15077 0.03646 0.00322
palmitoyl_C15a POPG C315 H15X -0.11009 0.03220 0.00285
palmitoyl_C15b POPG C315 H15Y -0.10984 0.03078 0.00272
palmitoyl_C16a POPG C316 H16X -0.03249 0.00996 0.00088
palmitoyl_C16b POPG C316 H16Y -0.03264 0.00983 0.00087
palmitoyl_C16c POPG C316 H16Z -0.03168 0.01108 0.00098
oleoyl_C2a POPG C22 H2R -0.23486 0.13650 0.01207
oleoyl_C2b POPG C22 H2S -0.16987 0.10898 0.00963
oleoyl_C3a POPG C23 H3R -0.25264 0.06672 0.00590
oleoyl_C3b POPG C23 H3S -0.18181 0.07852 0.00694
oleoyl_C4a POPG C24 H4R -0.25386 0.05215 0.00461
oleoyl_C4b POPG C24 H4S -0.24425 0.04813 0.00425
oleoyl_C5a POPG C25 H5R -0.24604 0.04322 0.00382
oleoyl_C5b POPG C25 H5S -0.24302 0.04170 0.00369
oleoyl_C6a POPG C26 H6R -0.23252 0.04030 0.00356
oleoyl_C6b POPG C26 H6S -0.23405 0.03759 0.00332
oleoyl_C7a POPG C27 H7R -0.21987 0.03632 0.00321
oleoyl_C7b POPG C27 H7S -0.22024 0.03407 0.00301
oleoyl_C8a POPG C28 H8R -0.16782 0.03534 0.00312
oleoyl_C8b POPG C28 H8S -0.16552 0.03360 0.00297
oleoyl_C9a POPG C29 H91 -0.12964 0.03372 0.00298
oleoyl_C10a POPG C210 H101 -0.06912 0.04622 0.00408
oleoyl_C11a POPG C211 H11R -0.10749 0.03748 0.00331
oleoyl_C11b POPG C211 H11S -0.10629 0.03656 0.00323
oleoyl_C12a POPG C212 H12R -0.16199 0.03911 0.00346
oleoyl_C12b POPG C212 H12S -0.16057 0.03993 0.00353
oleoyl_C13a POPG C213 H13R -0.16097 0.04140 0.00366
oleoyl_C13b POPG C213 H13S -0.16068 0.04179 0.00369
oleoyl_C14a POPG C214 H14R -0.16988 0.04228 0.00374
oleoyl_C14b POPG C214 H14S -0.17003 0.04149 0.00367
oleoyl_C15a POPG C215 H15R -0.14943 0.04043 0.00357
oleoyl_C15b POPG C215 H15S -0.14950 0.04031 0.00356
oleoyl_C16a POPG C216 H16R -0.13488 0.03597 0.00318
oleoyl_C16b POPG C216 H16S -0.13411 0.03653 0.00323
oleoyl_C17a POPG C217 H17R -0.09752 0.02701 0.00239
oleoyl_C17b POPG C217 H17S -0.09538 0.02738 0.00242
oleoyl_C18a POPG C218 H18R -0.03405 0.01066 0.00094
oleoyl_C18b POPG C218 H18S -0.03365 0.00956 0.00085
oleoyl_C18c POPG C218 H18T -0.03474 0.01066 0.00094