NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
8375 | 1m4f | 5501 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 131} (( segid " " and resid 3 and name HN )) (( segid " " and resid 3 and name HB2 )) 2.400 0.700 0.700 peak 131 spectrum 1 weight 0.10000E+01 volume 0.55405E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 131} (( segid " " and resid 3 and name HN )) (( segid " " and resid 3 and name HB1 )) OR { 131} (( segid " " and resid 10 and name HN )) (( segid " " and resid 10 and name HB1 )) ASSI { 369} (( segid " " and resid 22 and name HB2 )) ( segid " " and resid 8 and name HD1%) 3.700 1.700 1.700 peak 369 spectrum 1 weight 0.10000E+01 volume 0.15969E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 369} (( segid " " and resid 22 and name HB1 )) ( segid " " and resid 8 and name HD1%) OR { 369} (( segid " " and resid 9 and name HB1 )) ( segid " " and resid 8 and name HD1%) OR { 369} (( segid " " and resid 9 and name HB1 )) ( segid " " and resid 8 and name HD1%) ASSI { 38} (( segid " " and resid 11 and name HN )) (( segid " " and resid 11 and name HB2 )) 2.700 0.900 0.900 peak 38 spectrum 1 weight 0.10000E+01 volume 0.39729E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 38} (( segid " " and resid 11 and name HN )) (( segid " " and resid 11 and name HB1 )) OR { 38} (( segid " " and resid 11 and name HN )) (( segid " " and resid 10 and name HB2 )) OR { 38} (( segid " " and resid 11 and name HN )) (( segid " " and resid 10 and name HB1 )) ASSI { 54} (( segid " " and resid 17 and name HN )) (( segid " " and resid 18 and name HG2 )) 4.000 2.000 2.000 peak 54 spectrum 1 weight 0.10000E+01 volume 0.60025E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 54} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HG2 )) OR { 54} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HG1 )) ASSI { 622} (( segid " " and resid 20 and name HN )) (( segid " " and resid 21 and name HN )) 4.300 2.300 1.700 peak 622 spectrum 1 weight 0.10000E+01 volume 0.51784E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 622} (( segid " " and resid 20 and name HN )) (( segid " " and resid 19 and name HN )) ASSI { 364} (( segid " " and resid 16 and name HD1 )) (( segid " " and resid 18 and name HD1 )) 2.400 2.400 3.600 peak 364 spectrum 1 weight 0.10000E+01 volume 0.22241E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 364} (( segid " " and resid 16 and name HD1 )) (( segid " " and resid 18 and name HD1 )) OR { 364} (( segid " " and resid 16 and name HD1 )) (( segid " " and resid 18 and name HD1 )) OR { 364} (( segid " " and resid 16 and name HD1 )) (( segid " " and resid 18 and name HD1 )) OR { 364} (( segid " " and resid 16 and name HD2 )) (( segid " " and resid 18 and name HD1 )) OR { 364} (( segid " " and resid 16 and name HD2 )) (( segid " " and resid 18 and name HD1 )) OR { 364} (( segid " " and resid 16 and name HD2 )) (( segid " " and resid 18 and name HD1 )) OR { 364} (( segid " " and resid 16 and name HD2 )) (( segid " " and resid 18 and name HD1 )) OR { 364} (( segid " " and resid 19 and name HB1 )) (( segid " " and resid 21 and name HB2 )) OR { 364} (( segid " " and resid 19 and name HB1 )) (( segid " " and resid 21 and name HB1 )) OR { 364} (( segid " " and resid 19 and name HB2 )) (( segid " " and resid 21 and name HB2 )) OR { 364} (( segid " " and resid 19 and name HB2 )) (( segid " " and resid 21 and name HB1 )) ASSI { 429} (( segid " " and resid 9 and name HB2 )) (( segid " " and resid 21 and name HA )) 4.100 2.100 1.900 peak 429 spectrum 1 weight 0.10000E+01 volume 0.12222E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 429} (( segid " " and resid 9 and name HB2 )) (( segid " " and resid 21 and name HA )) OR { 429} (( segid " " and resid 22 and name HB2 )) (( segid " " and resid 21 and name HA )) OR { 429} (( segid " " and resid 9 and name HB1 )) (( segid " " and resid 21 and name HA )) OR { 429} (( segid " " and resid 9 and name HB1 )) (( segid " " and resid 21 and name HA )) ASSI { 108} (( segid " " and resid 24 and name HN )) (( segid " " and resid 23 and name HA )) 2.000 2.000 4.000 peak 108 spectrum 1 weight 0.10000E+01 volume 0.15061E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 108} (( segid " " and resid 8 and name HN )) (( segid " " and resid 23 and name HA )) ASSI { 308} (( segid " " and resid 1 and name HA )) (( segid " " and resid 1 and name HB1 )) 2.800 1.000 1.000 peak 308 spectrum 1 weight 0.10000E+01 volume 0.23464E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 308} (( segid " " and resid 1 and name HA )) (( segid " " and resid 1 and name HB2 )) ASSI { 203} (( segid " " and resid 2 and name HN )) (( segid " " and resid 2 and name HA )) 2.800 1.000 1.000 peak 203 spectrum 1 weight 0.10000E+01 volume 0.17267E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 208} (( segid " " and resid 2 and name HN )) ( segid " " and resid 2 and name HG2%) 2.900 1.000 1.000 peak 208 spectrum 1 weight 0.10000E+01 volume 0.24131E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 196} (( segid " " and resid 2 and name HN )) (( segid " " and resid 3 and name HN )) 3.800 1.800 1.800 peak 196 spectrum 1 weight 0.10000E+01 volume 0.97586E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 116} (( segid " " and resid 3 and name HN )) (( segid " " and resid 3 and name HA )) 2.300 0.700 0.700 peak 116 spectrum 1 weight 0.10000E+01 volume 0.68983E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 130} (( segid " " and resid 3 and name HN )) (( segid " " and resid 3 and name HB2 )) 2.400 0.700 0.700 peak 130 spectrum 1 weight 0.10000E+01 volume 0.41283E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 130} (( segid " " and resid 3 and name HN )) (( segid " " and resid 3 and name HB1 )) ASSI { 199} (( segid " " and resid 2 and name HN )) (( segid " " and resid 4 and name HN )) 3.800 1.800 1.800 peak 199 spectrum 1 weight 0.10000E+01 volume 0.66177E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 179} (( segid " " and resid 4 and name HN )) (( segid " " and resid 3 and name HA )) 2.000 2.000 4.000 peak 179 spectrum 1 weight 0.10000E+01 volume 0.13572E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 167} (( segid " " and resid 4 and name HN )) (( segid " " and resid 3 and name HB2 )) 3.400 1.400 1.400 peak 167 spectrum 1 weight 0.10000E+01 volume 0.11430E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 167} (( segid " " and resid 4 and name HN )) (( segid " " and resid 3 and name HB1 )) ASSI { 190} (( segid " " and resid 4 and name HN )) (( segid " " and resid 3 and name HN )) 2.800 1.000 1.000 peak 190 spectrum 1 weight 0.10000E+01 volume 0.15507E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 351} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 4 and name HA )) 2.400 0.700 0.700 peak 351 spectrum 1 weight 0.10000E+01 volume 0.40099E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 351} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 4 and name HA )) ASSI { 181} (( segid " " and resid 4 and name HN )) (( segid " " and resid 4 and name HA )) 2.200 2.200 3.800 peak 181 spectrum 1 weight 0.10000E+01 volume 0.71430E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 164} (( segid " " and resid 4 and name HN )) (( segid " " and resid 4 and name HB2 )) 2.400 0.700 0.700 peak 164 spectrum 1 weight 0.10000E+01 volume 0.61111E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 164} (( segid " " and resid 4 and name HN )) (( segid " " and resid 4 and name HB1 )) ASSI { 362} (( segid " " and resid 3 and name HB1 )) (( segid " " and resid 5 and name HG1 )) 3.500 3.500 2.500 peak 362 spectrum 1 weight 0.10000E+01 volume 0.17980E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 362} (( segid " " and resid 3 and name HB2 )) (( segid " " and resid 5 and name HG1 )) OR { 362} (( segid " " and resid 3 and name HB1 )) (( segid " " and resid 5 and name HG2 )) OR { 362} (( segid " " and resid 3 and name HB2 )) (( segid " " and resid 5 and name HG2 )) ASSI { 330} (( segid " " and resid 5 and name HD1 )) (( segid " " and resid 4 and name HA )) 2.100 0.500 0.500 peak 330 spectrum 1 weight 0.10000E+01 volume 0.65939E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 330} (( segid " " and resid 5 and name HD2 )) (( segid " " and resid 4 and name HA )) ASSI { 354} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 5 and name HD1 )) 3.400 1.500 1.500 peak 354 spectrum 1 weight 0.10000E+01 volume 0.28082E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 354} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 5 and name HD1 )) OR { 354} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 5 and name HD2 )) OR { 354} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 5 and name HD2 )) ASSI { 171} (( segid " " and resid 4 and name HN )) (( segid " " and resid 5 and name HD1 )) 3.300 1.400 1.400 peak 171 spectrum 1 weight 0.10000E+01 volume 0.98383E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 171} (( segid " " and resid 4 and name HN )) (( segid " " and resid 5 and name HD2 )) ASSI { 471} (( segid " " and resid 5 and name HB1 )) (( segid " " and resid 5 and name HA )) 1.800 0.400 0.400 peak 471 spectrum 1 weight 0.10000E+01 volume 0.17073E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 471} (( segid " " and resid 5 and name HB2 )) (( segid " " and resid 5 and name HA )) ASSI { 489} (( segid " " and resid 5 and name HB2 )) (( segid " " and resid 5 and name HD2 )) 2.700 0.900 0.900 peak 489 spectrum 1 weight 0.10000E+01 volume 0.64011E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 489} (( segid " " and resid 5 and name HB1 )) (( segid " " and resid 5 and name HD1 )) OR { 489} (( segid " " and resid 5 and name HB1 )) (( segid " " and resid 5 and name HD2 )) OR { 489} (( segid " " and resid 5 and name HB2 )) (( segid " " and resid 5 and name HD1 )) ASSI { 491} (( segid " " and resid 5 and name HG1 )) (( segid " " and resid 5 and name HD1 )) 2.300 0.600 0.600 peak 491 spectrum 1 weight 0.10000E+01 volume 0.40519E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 491} (( segid " " and resid 5 and name HG2 )) (( segid " " and resid 5 and name HD2 )) OR { 491} (( segid " " and resid 5 and name HG2 )) (( segid " " and resid 5 and name HD1 )) OR { 491} (( segid " " and resid 5 and name HG1 )) (( segid " " and resid 5 and name HD2 )) ASSI { 137} (( segid " " and resid 6 and name HN )) (( segid " " and resid 5 and name HB2 )) 1.900 0.500 0.500 peak 137 spectrum 1 weight 0.10000E+01 volume 0.18275E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 137} (( segid " " and resid 6 and name HN )) (( segid " " and resid 5 and name HB1 )) ASSI { 484} (( segid " " and resid 6 and name HB )) (( segid " " and resid 6 and name HA )) 2.400 0.700 0.700 peak 484 spectrum 1 weight 0.10000E+01 volume 0.37988E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 301} (( segid " " and resid 6 and name HA )) ( segid " " and resid 6 and name HD1%) 4.900 2.900 1.100 peak 301 spectrum 1 weight 0.10000E+01 volume 0.76093E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 569} (( segid " " and resid 6 and name HG11)) (( segid " " and resid 6 and name HA )) 3.100 1.200 1.200 peak 569 spectrum 1 weight 0.10000E+01 volume 0.25023E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 557} (( segid " " and resid 6 and name HG11)) ( segid " " and resid 6 and name HD1%) 2.000 0.500 0.500 peak 557 spectrum 1 weight 0.10000E+01 volume 0.94216E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 538} (( segid " " and resid 6 and name HG12)) (( segid " " and resid 6 and name HA )) 3.300 1.400 1.400 peak 538 spectrum 1 weight 0.10000E+01 volume 0.18976E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 525} (( segid " " and resid 6 and name HG12)) (( segid " " and resid 6 and name HG11)) 1.200 0.200 1.000 peak 525 spectrum 1 weight 0.10000E+01 volume 0.22894E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 587} ( segid " " and resid 6 and name HG2%) (( segid " " and resid 6 and name HA )) 2.100 0.600 0.600 peak 587 spectrum 1 weight 0.10000E+01 volume 0.89598E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 520} (( segid " " and resid 6 and name HB )) ( segid " " and resid 6 and name HG2%) 1.800 0.400 0.400 peak 520 spectrum 1 weight 0.10000E+01 volume 0.18132E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 579} ( segid " " and resid 6 and name HG2%) (( segid " " and resid 6 and name HG11)) 2.700 0.900 0.900 peak 579 spectrum 1 weight 0.10000E+01 volume 0.72735E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 582} ( segid " " and resid 6 and name HG2%) (( segid " " and resid 6 and name HG12)) 2.200 0.600 0.600 peak 582 spectrum 1 weight 0.10000E+01 volume 0.61468E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 127} (( segid " " and resid 6 and name HN )) (( segid " " and resid 6 and name HA )) 2.400 0.700 0.700 peak 127 spectrum 1 weight 0.10000E+01 volume 0.24363E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 158} (( segid " " and resid 6 and name HN )) ( segid " " and resid 6 and name HD1%) 4.200 2.200 1.800 peak 158 spectrum 1 weight 0.10000E+01 volume 0.83016E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 149} (( segid " " and resid 6 and name HN )) (( segid " " and resid 6 and name HG11)) 2.700 0.900 0.900 peak 149 spectrum 1 weight 0.10000E+01 volume 0.16714E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 145} (( segid " " and resid 6 and name HN )) (( segid " " and resid 6 and name HG12)) 1.900 0.400 0.400 peak 145 spectrum 1 weight 0.10000E+01 volume 0.29107E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 153} (( segid " " and resid 6 and name HN )) ( segid " " and resid 6 and name HG2%) 2.600 0.900 0.900 peak 153 spectrum 1 weight 0.10000E+01 volume 0.36754E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 503} (( segid " " and resid 5 and name HG2 )) (( segid " " and resid 7 and name HB2 )) 2.800 2.800 3.200 peak 503 spectrum 1 weight 0.10000E+01 volume 0.83707E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 503} (( segid " " and resid 5 and name HG2 )) (( segid " " and resid 7 and name HB1 )) OR { 503} (( segid " " and resid 5 and name HG1 )) (( segid " " and resid 7 and name HB2 )) OR { 503} (( segid " " and resid 5 and name HG1 )) (( segid " " and resid 7 and name HB1 )) ASSI { 76} (( segid " " and resid 7 and name HN )) (( segid " " and resid 6 and name HA )) 1.900 1.900 4.100 peak 76 spectrum 1 weight 0.10000E+01 volume 0.19631E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 613} (( segid " " and resid 6 and name HB )) (( segid " " and resid 7 and name HN )) 3.200 1.300 1.300 peak 613 spectrum 1 weight 0.10000E+01 volume 0.15886E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 53} (( segid " " and resid 7 and name HN )) (( segid " " and resid 6 and name HG12)) 3.200 1.300 1.300 peak 53 spectrum 1 weight 0.10000E+01 volume 0.95876E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 48} (( segid " " and resid 7 and name HN )) ( segid " " and resid 6 and name HG2%) 3.300 1.300 1.300 peak 48 spectrum 1 weight 0.10000E+01 volume 0.48125E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 607} (( segid " " and resid 6 and name HN )) (( segid " " and resid 7 and name HN )) 2.000 0.500 0.500 peak 607 spectrum 1 weight 0.10000E+01 volume 0.22718E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 457} (( segid " " and resid 7 and name HB1 )) (( segid " " and resid 7 and name HA )) 2.400 0.700 0.700 peak 457 spectrum 1 weight 0.10000E+01 volume 0.45481E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 457} (( segid " " and resid 7 and name HB2 )) (( segid " " and resid 7 and name HA )) ASSI { 85} (( segid " " and resid 7 and name HN )) (( segid " " and resid 7 and name HA )) 2.200 0.600 0.600 peak 85 spectrum 1 weight 0.10000E+01 volume 0.31384E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 67} (( segid " " and resid 7 and name HN )) (( segid " " and resid 7 and name HB2 )) 2.500 0.800 0.800 peak 67 spectrum 1 weight 0.10000E+01 volume 0.52530E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 67} (( segid " " and resid 7 and name HN )) (( segid " " and resid 7 and name HB1 )) ASSI { 152} (( segid " " and resid 8 and name HN )) ( segid " " and resid 6 and name HG2%) 2.300 2.300 3.700 peak 152 spectrum 1 weight 0.10000E+01 volume 0.14357E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 135} (( segid " " and resid 8 and name HN )) (( segid " " and resid 7 and name HB2 )) 3.000 1.100 1.100 peak 135 spectrum 1 weight 0.10000E+01 volume 0.23180E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 135} (( segid " " and resid 8 and name HN )) (( segid " " and resid 7 and name HB1 )) ASSI { 591} ( segid " " and resid 8 and name HD1%) (( segid " " and resid 8 and name HA )) 4.400 2.500 1.600 peak 591 spectrum 1 weight 0.10000E+01 volume 0.15262E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 522} (( segid " " and resid 8 and name HB )) ( segid " " and resid 8 and name HD1%) 2.600 0.900 0.900 peak 522 spectrum 1 weight 0.10000E+01 volume 0.29608E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 519} (( segid " " and resid 8 and name HB )) (( segid " " and resid 8 and name HG11)) 2.500 0.800 0.800 peak 519 spectrum 1 weight 0.10000E+01 volume 0.18064E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 599} ( segid " " and resid 8 and name HD1%) (( segid " " and resid 8 and name HG11)) 1.800 1.800 4.200 peak 599 spectrum 1 weight 0.10000E+01 volume 0.15261E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 567} (( segid " " and resid 8 and name HG12)) (( segid " " and resid 8 and name HA )) 3.400 1.400 1.400 peak 567 spectrum 1 weight 0.10000E+01 volume 0.15584E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 517} (( segid " " and resid 8 and name HB )) (( segid " " and resid 8 and name HG12)) 2.400 0.700 0.700 peak 517 spectrum 1 weight 0.10000E+01 volume 0.65949E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 555} (( segid " " and resid 8 and name HG12)) ( segid " " and resid 8 and name HD1%) 2.100 0.600 0.600 peak 555 spectrum 1 weight 0.10000E+01 volume 0.58446E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 559} (( segid " " and resid 8 and name HG12)) (( segid " " and resid 8 and name HG11)) 1.300 0.200 0.900 peak 559 spectrum 1 weight 0.10000E+01 volume 0.18921E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 590} ( segid " " and resid 8 and name HG2%) (( segid " " and resid 8 and name HA )) 2.100 0.500 0.500 peak 590 spectrum 1 weight 0.10000E+01 volume 0.94107E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 521} (( segid " " and resid 8 and name HB )) ( segid " " and resid 8 and name HG2%) 1.700 0.400 0.500 peak 521 spectrum 1 weight 0.10000E+01 volume 0.23625E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 118} (( segid " " and resid 8 and name HN )) (( segid " " and resid 8 and name HA )) 2.300 0.600 0.600 peak 118 spectrum 1 weight 0.10000E+01 volume 0.41804E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 157} (( segid " " and resid 8 and name HN )) ( segid " " and resid 8 and name HD1%) 4.500 2.500 1.500 peak 157 spectrum 1 weight 0.10000E+01 volume 0.12323E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 150} (( segid " " and resid 8 and name HN )) (( segid " " and resid 8 and name HG11)) 2.800 1.000 1.000 peak 150 spectrum 1 weight 0.10000E+01 volume 0.33203E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 147} (( segid " " and resid 8 and name HN )) (( segid " " and resid 8 and name HG12)) 2.400 0.700 0.700 peak 147 spectrum 1 weight 0.10000E+01 volume 0.10144E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 155} (( segid " " and resid 8 and name HN )) ( segid " " and resid 8 and name HG2%) 2.400 0.800 0.800 peak 155 spectrum 1 weight 0.10000E+01 volume 0.40701E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 36} (( segid " " and resid 9 and name HN )) (( segid " " and resid 8 and name HA )) 1.500 0.300 0.700 peak 36 spectrum 1 weight 0.10000E+01 volume 0.25974E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 42} (( segid " " and resid 9 and name HN )) (( segid " " and resid 8 and name HB )) 2.200 2.200 3.800 peak 42 spectrum 1 weight 0.10000E+01 volume 0.78315E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 44} (( segid " " and resid 9 and name HN )) (( segid " " and resid 8 and name HG11)) 3.900 1.900 1.900 peak 44 spectrum 1 weight 0.10000E+01 volume 0.71389E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 43} (( segid " " and resid 9 and name HN )) (( segid " " and resid 8 and name HG12)) 4.300 2.300 1.700 peak 43 spectrum 1 weight 0.10000E+01 volume 0.10906E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 45} (( segid " " and resid 9 and name HN )) ( segid " " and resid 8 and name HG2%) 3.500 1.600 1.600 peak 45 spectrum 1 weight 0.10000E+01 volume 0.34119E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 35} (( segid " " and resid 9 and name HN )) (( segid " " and resid 9 and name HA )) 2.400 0.700 0.700 peak 35 spectrum 1 weight 0.10000E+01 volume 0.27715E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 368} (( segid " " and resid 10 and name HB1 )) ( segid " " and resid 8 and name HD1%) 2.800 2.800 3.200 peak 368 spectrum 1 weight 0.10000E+01 volume 0.39663E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 368} (( segid " " and resid 10 and name HB2 )) ( segid " " and resid 8 and name HD1%) ASSI { 566} (( segid " " and resid 8 and name HG12)) (( segid " " and resid 10 and name HB1 )) 3.900 1.900 1.900 peak 566 spectrum 1 weight 0.10000E+01 volume 0.10843E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 566} (( segid " " and resid 8 and name HG12)) (( segid " " and resid 10 and name HB2 )) ASSI { 371} (( segid " " and resid 10 and name HB1 )) ( segid " " and resid 8 and name HG2%) 2.300 2.300 3.700 peak 371 spectrum 1 weight 0.10000E+01 volume 0.16873E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 371} (( segid " " and resid 10 and name HB2 )) ( segid " " and resid 8 and name HG2%) ASSI { 115} (( segid " " and resid 10 and name HN )) (( segid " " and resid 9 and name HA )) 1.700 0.400 0.500 peak 115 spectrum 1 weight 0.10000E+01 volume 0.12221E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 602} (( segid " " and resid 9 and name HN )) (( segid " " and resid 10 and name HN )) 4.100 2.100 1.900 peak 602 spectrum 1 weight 0.10000E+01 volume 0.89150E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 424} (( segid " " and resid 10 and name HB1 )) (( segid " " and resid 10 and name HA )) 2.200 0.600 0.600 peak 424 spectrum 1 weight 0.10000E+01 volume 0.72128E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 424} (( segid " " and resid 10 and name HB2 )) (( segid " " and resid 10 and name HA )) ASSI { 114} (( segid " " and resid 10 and name HN )) (( segid " " and resid 10 and name HA )) 2.300 0.600 0.600 peak 114 spectrum 1 weight 0.10000E+01 volume 0.43930E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 129} (( segid " " and resid 10 and name HN )) (( segid " " and resid 10 and name HB1 )) 3.600 1.600 1.600 peak 129 spectrum 1 weight 0.10000E+01 volume 0.65309E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 129} (( segid " " and resid 10 and name HN )) (( segid " " and resid 10 and name HB2 )) ASSI { 33} (( segid " " and resid 11 and name HN )) (( segid " " and resid 10 and name HA )) 2.000 0.500 0.500 peak 33 spectrum 1 weight 0.10000E+01 volume 0.78512E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 37} (( segid " " and resid 11 and name HN )) (( segid " " and resid 10 and name HB2 )) 3.200 1.300 1.300 peak 37 spectrum 1 weight 0.10000E+01 volume 0.33158E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 37} (( segid " " and resid 11 and name HN )) (( segid " " and resid 10 and name HB1 )) ASSI { 31} (( segid " " and resid 11 and name HN )) (( segid " " and resid 10 and name HN )) 4.200 2.200 1.800 peak 31 spectrum 1 weight 0.10000E+01 volume 0.52538E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 427} (( segid " " and resid 11 and name HB2 )) (( segid " " and resid 11 and name HA )) 2.600 0.800 0.800 peak 427 spectrum 1 weight 0.10000E+01 volume 0.23074E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 427} (( segid " " and resid 11 and name HB1 )) (( segid " " and resid 11 and name HA )) ASSI { 32} (( segid " " and resid 11 and name HN )) (( segid " " and resid 11 and name HA )) 2.900 1.000 1.000 peak 32 spectrum 1 weight 0.10000E+01 volume 0.87705E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 39} (( segid " " and resid 11 and name HN )) (( segid " " and resid 11 and name HB2 )) 3.000 1.100 1.100 peak 39 spectrum 1 weight 0.10000E+01 volume 0.14699E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 39} (( segid " " and resid 11 and name HN )) (( segid " " and resid 11 and name HB1 )) ASSI { 180} (( segid " " and resid 12 and name HN )) (( segid " " and resid 11 and name HA )) 1.800 0.400 0.400 peak 180 spectrum 1 weight 0.10000E+01 volume 0.79018E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 163} (( segid " " and resid 12 and name HN )) (( segid " " and resid 11 and name HB1 )) 3.700 1.700 1.700 peak 163 spectrum 1 weight 0.10000E+01 volume 0.12875E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 163} (( segid " " and resid 12 and name HN )) (( segid " " and resid 11 and name HB2 )) ASSI { 350} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HA )) 2.200 0.600 0.600 peak 350 spectrum 1 weight 0.10000E+01 volume 0.74620E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 350} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HA )) ASSI { 225} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HB1 )) 3.400 1.500 1.500 peak 225 spectrum 1 weight 0.10000E+01 volume 0.43844E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 225} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HB2 )) ASSI { 414} (( segid " " and resid 14 and name HB1 )) (( segid " " and resid 14 and name HA )) 3.300 1.400 1.400 peak 414 spectrum 1 weight 0.10000E+01 volume 0.70883E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 414} (( segid " " and resid 14 and name HB2 )) (( segid " " and resid 14 and name HA )) ASSI { 79} (( segid " " and resid 15 and name HN )) (( segid " " and resid 14 and name HA )) 3.900 1.900 1.900 peak 79 spectrum 1 weight 0.10000E+01 volume 0.69279E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 345} (( segid " " and resid 15 and name HB1 )) (( segid " " and resid 15 and name HA )) 3.000 1.200 1.200 peak 345 spectrum 1 weight 0.10000E+01 volume 0.12084E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 345} (( segid " " and resid 15 and name HB2 )) (( segid " " and resid 15 and name HA )) ASSI { 255} (( segid " " and resid 15 and name HD1 )) (( segid " " and resid 15 and name HB2 )) 3.000 1.100 1.100 peak 255 spectrum 1 weight 0.10000E+01 volume 0.16233E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 255} (( segid " " and resid 15 and name HD2 )) (( segid " " and resid 15 and name HB1 )) OR { 255} (( segid " " and resid 15 and name HD1 )) (( segid " " and resid 15 and name HB1 )) ASSI { 75} (( segid " " and resid 15 and name HN )) (( segid " " and resid 15 and name HA )) 2.500 0.800 0.800 peak 75 spectrum 1 weight 0.10000E+01 volume 0.36053E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 68} (( segid " " and resid 15 and name HN )) (( segid " " and resid 15 and name HB2 )) 3.000 1.100 1.100 peak 68 spectrum 1 weight 0.10000E+01 volume 0.11210E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 68} (( segid " " and resid 15 and name HN )) (( segid " " and resid 15 and name HB1 )) ASSI { 478} (( segid " " and resid 16 and name HB1 )) (( segid " " and resid 16 and name HA )) 2.100 0.600 0.600 peak 478 spectrum 1 weight 0.10000E+01 volume 0.71495E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 478} (( segid " " and resid 16 and name HB2 )) (( segid " " and resid 16 and name HA )) ASSI { 272} (( segid " " and resid 16 and name HE )) (( segid " " and resid 16 and name HB1 )) 3.500 1.500 1.500 peak 272 spectrum 1 weight 0.10000E+01 volume 0.12059E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 272} (( segid " " and resid 16 and name HE )) (( segid " " and resid 16 and name HB2 )) ASSI { 511} (( segid " " and resid 16 and name HB2 )) (( segid " " and resid 16 and name HG1 )) 2.100 0.600 0.600 peak 511 spectrum 1 weight 0.10000E+01 volume 0.64904E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 511} (( segid " " and resid 16 and name HB1 )) (( segid " " and resid 16 and name HG1 )) OR { 511} (( segid " " and resid 16 and name HB2 )) (( segid " " and resid 16 and name HG2 )) OR { 511} (( segid " " and resid 16 and name HB1 )) (( segid " " and resid 16 and name HG2 )) ASSI { 269} (( segid " " and resid 16 and name HE )) (( segid " " and resid 16 and name HG1 )) 2.800 1.000 1.000 peak 269 spectrum 1 weight 0.10000E+01 volume 0.21016E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 269} (( segid " " and resid 16 and name HE )) (( segid " " and resid 16 and name HG2 )) ASSI { 540} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 16 and name HA )) 3.500 1.500 1.500 peak 540 spectrum 1 weight 0.10000E+01 volume 0.10836E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 540} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 16 and name HA )) ASSI { 174} (( segid " " and resid 12 and name HN )) (( segid " " and resid 17 and name HA )) 3.700 1.700 1.700 peak 174 spectrum 1 weight 0.10000E+01 volume 0.12041E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 81} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HA )) 2.200 0.600 0.600 peak 81 spectrum 1 weight 0.10000E+01 volume 0.50035E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 59} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HB2 )) 3.400 1.400 1.400 peak 59 spectrum 1 weight 0.10000E+01 volume 0.19473E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 59} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HB1 )) ASSI { 618} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HG2 )) 4.300 2.400 1.700 peak 618 spectrum 1 weight 0.10000E+01 volume 0.50605E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 618} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HG1 )) ASSI { 78} (( segid " " and resid 17 and name HN )) (( segid " " and resid 17 and name HA )) 2.400 0.700 0.700 peak 78 spectrum 1 weight 0.10000E+01 volume 0.51278E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 175} (( segid " " and resid 12 and name HN )) (( segid " " and resid 18 and name HA )) 3.700 1.700 1.700 peak 175 spectrum 1 weight 0.10000E+01 volume 0.58166E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 185} (( segid " " and resid 12 and name HN )) (( segid " " and resid 18 and name HN )) 2.900 1.100 1.100 peak 185 spectrum 1 weight 0.10000E+01 volume 0.12274E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 220} (( segid " " and resid 18 and name HN )) (( segid " " and resid 16 and name HA )) 4.100 2.100 1.900 peak 220 spectrum 1 weight 0.10000E+01 volume 0.46058E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 231} (( segid " " and resid 18 and name HN )) (( segid " " and resid 16 and name HB2 )) 3.800 1.800 1.800 peak 231 spectrum 1 weight 0.10000E+01 volume 0.42424E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 231} (( segid " " and resid 18 and name HN )) (( segid " " and resid 16 and name HB1 )) ASSI { 230} (( segid " " and resid 18 and name HN )) (( segid " " and resid 16 and name HG2 )) 3.300 1.400 1.400 peak 230 spectrum 1 weight 0.10000E+01 volume 0.10173E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 230} (( segid " " and resid 18 and name HN )) (( segid " " and resid 16 and name HG1 )) ASSI { 222} (( segid " " and resid 18 and name HN )) (( segid " " and resid 17 and name HA )) 2.700 0.900 0.900 peak 222 spectrum 1 weight 0.10000E+01 volume 0.14796E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 91} (( segid " " and resid 17 and name HN )) (( segid " " and resid 18 and name HN )) 2.700 0.900 0.900 peak 91 spectrum 1 weight 0.10000E+01 volume 0.45481E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 545} (( segid " " and resid 18 and name HG2 )) (( segid " " and resid 18 and name HA )) 3.300 1.400 1.400 peak 545 spectrum 1 weight 0.10000E+01 volume 0.15055E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 545} (( segid " " and resid 18 and name HG1 )) (( segid " " and resid 18 and name HA )) ASSI { 221} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HA )) 2.200 2.200 3.800 peak 221 spectrum 1 weight 0.10000E+01 volume 0.55992E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 233} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HG2 )) 2.300 0.700 0.700 peak 233 spectrum 1 weight 0.10000E+01 volume 0.36908E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 233} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HG1 )) ASSI { 266} (( segid " " and resid 9 and name HZ )) (( segid " " and resid 19 and name HB1 )) 2.700 0.900 0.900 peak 266 spectrum 1 weight 0.10000E+01 volume 0.27546E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 266} (( segid " " and resid 9 and name HZ )) (( segid " " and resid 19 and name HB2 )) ASSI { 600} (( segid " " and resid 19 and name HA )) (( segid " " and resid 11 and name HA )) 2.200 0.600 0.600 peak 600 spectrum 1 weight 0.10000E+01 volume 0.10055E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 432} (( segid " " and resid 11 and name HB2 )) (( segid " " and resid 19 and name HA )) 3.900 1.900 1.900 peak 432 spectrum 1 weight 0.10000E+01 volume 0.66637E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 432} (( segid " " and resid 11 and name HB1 )) (( segid " " and resid 19 and name HA )) ASSI { 443} (( segid " " and resid 19 and name HB1 )) (( segid " " and resid 11 and name HA )) 4.300 2.300 1.700 peak 443 spectrum 1 weight 0.10000E+01 volume 0.54985E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 443} (( segid " " and resid 19 and name HB2 )) (( segid " " and resid 11 and name HA )) ASSI { 80} (( segid " " and resid 19 and name HN )) (( segid " " and resid 18 and name HA )) 1.800 0.400 0.400 peak 80 spectrum 1 weight 0.10000E+01 volume 0.14024E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 51} (( segid " " and resid 19 and name HN )) (( segid " " and resid 18 and name HG1 )) 3.900 1.900 1.900 peak 51 spectrum 1 weight 0.10000E+01 volume 0.12750E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 51} (( segid " " and resid 19 and name HN )) (( segid " " and resid 18 and name HG2 )) ASSI { 211} (( segid " " and resid 18 and name HN )) (( segid " " and resid 19 and name HN )) 3.900 1.900 1.900 peak 211 spectrum 1 weight 0.10000E+01 volume 0.93004E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 442} (( segid " " and resid 19 and name HB1 )) (( segid " " and resid 19 and name HA )) 2.400 0.700 0.700 peak 442 spectrum 1 weight 0.10000E+01 volume 0.28112E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 442} (( segid " " and resid 19 and name HB2 )) (( segid " " and resid 19 and name HA )) ASSI { 84} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HA )) 2.400 0.700 0.700 peak 84 spectrum 1 weight 0.10000E+01 volume 0.23879E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 282} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 20 and name HA2 )) 3.200 1.300 1.300 peak 282 spectrum 1 weight 0.10000E+01 volume 0.20746E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 282} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 20 and name HA1 )) ASSI { 250} ( segid " " and resid 9 and name HE% ) (( segid " " and resid 20 and name HA2 )) 2.600 0.800 0.800 peak 250 spectrum 1 weight 0.10000E+01 volume 0.30698E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 250} ( segid " " and resid 9 and name HE% ) (( segid " " and resid 20 and name HA1 )) ASSI { 126} (( segid " " and resid 10 and name HN )) (( segid " " and resid 20 and name HA2 )) 3.600 1.700 1.700 peak 126 spectrum 1 weight 0.10000E+01 volume 0.98489E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 126} (( segid " " and resid 10 and name HN )) (( segid " " and resid 20 and name HA1 )) ASSI { 623} (( segid " " and resid 20 and name HN )) (( segid " " and resid 10 and name HN )) 3.200 1.300 1.300 peak 623 spectrum 1 weight 0.10000E+01 volume 0.51784E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 182} (( segid " " and resid 20 and name HN )) (( segid " " and resid 19 and name HA )) 1.800 0.400 0.400 peak 182 spectrum 1 weight 0.10000E+01 volume 0.83737E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 161} (( segid " " and resid 20 and name HN )) (( segid " " and resid 19 and name HB1 )) 3.100 1.200 1.200 peak 161 spectrum 1 weight 0.10000E+01 volume 0.20331E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 161} (( segid " " and resid 20 and name HN )) (( segid " " and resid 19 and name HB2 )) ASSI { 172} (( segid " " and resid 20 and name HN )) (( segid " " and resid 20 and name HA2 )) 2.700 0.900 0.900 peak 172 spectrum 1 weight 0.10000E+01 volume 0.18774E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 172} (( segid " " and resid 20 and name HN )) (( segid " " and resid 20 and name HA1 )) ASSI { 274} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 21 and name HB1 )) 4.400 2.400 1.600 peak 274 spectrum 1 weight 0.10000E+01 volume 0.77396E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 274} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 21 and name HB2 )) ASSI { 276} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 21 and name HG2 )) 3.100 1.200 1.200 peak 276 spectrum 1 weight 0.10000E+01 volume 0.12500E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 276} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 21 and name HG1 )) ASSI { 267} ( segid " " and resid 9 and name HE% ) (( segid " " and resid 21 and name HG1 )) 4.300 2.300 1.700 peak 267 spectrum 1 weight 0.10000E+01 volume 0.54362E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 267} ( segid " " and resid 9 and name HE% ) (( segid " " and resid 21 and name HG2 )) ASSI { 289} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 21 and name HN )) 3.100 1.200 1.200 peak 289 spectrum 1 weight 0.10000E+01 volume 0.18087E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 113} (( segid " " and resid 10 and name HN )) (( segid " " and resid 21 and name HA )) 2.700 0.900 0.900 peak 113 spectrum 1 weight 0.10000E+01 volume 0.20183E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 72} (( segid " " and resid 21 and name HN )) (( segid " " and resid 20 and name HA2 )) 2.100 0.500 0.500 peak 72 spectrum 1 weight 0.10000E+01 volume 0.88644E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 72} (( segid " " and resid 21 and name HN )) (( segid " " and resid 20 and name HA1 )) ASSI { 473} (( segid " " and resid 21 and name HB1 )) (( segid " " and resid 21 and name HA )) 2.300 0.600 0.600 peak 473 spectrum 1 weight 0.10000E+01 volume 0.32859E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 473} (( segid " " and resid 21 and name HB2 )) (( segid " " and resid 21 and name HA )) ASSI { 82} (( segid " " and resid 21 and name HN )) (( segid " " and resid 21 and name HA )) 2.300 0.700 0.700 peak 82 spectrum 1 weight 0.10000E+01 volume 0.32692E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 7} (( segid " " and resid 22 and name HN )) (( segid " " and resid 7 and name HA )) 2.600 2.600 3.400 peak 7 spectrum 1 weight 0.10000E+01 volume 0.29681E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 375} (( segid " " and resid 22 and name HB2 )) (( segid " " and resid 8 and name HG12)) 3.100 1.200 1.200 peak 375 spectrum 1 weight 0.10000E+01 volume 0.16230E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 375} (( segid " " and resid 22 and name HB1 )) (( segid " " and resid 8 and name HG12)) ASSI { 17} (( segid " " and resid 22 and name HN )) (( segid " " and resid 8 and name HG11)) 3.100 1.200 1.200 peak 17 spectrum 1 weight 0.10000E+01 volume 0.61931E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 10} (( segid " " and resid 22 and name HN )) (( segid " " and resid 9 and name HA )) 3.200 1.200 1.200 peak 10 spectrum 1 weight 0.10000E+01 volume 0.12713E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 4} (( segid " " and resid 22 and name HN )) (( segid " " and resid 10 and name HN )) 3.600 1.600 1.600 peak 4 spectrum 1 weight 0.10000E+01 volume 0.72700E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 9} (( segid " " and resid 22 and name HN )) (( segid " " and resid 21 and name HA )) 1.600 0.300 0.600 peak 9 spectrum 1 weight 0.10000E+01 volume 0.13463E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 16} (( segid " " and resid 22 and name HN )) (( segid " " and resid 21 and name HB1 )) 3.200 1.300 1.300 peak 16 spectrum 1 weight 0.10000E+01 volume 0.12864E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 16} (( segid " " and resid 22 and name HN )) (( segid " " and resid 21 and name HB2 )) ASSI { 1} (( segid " " and resid 22 and name HN )) (( segid " " and resid 21 and name HN )) 4.300 2.400 1.700 peak 1 spectrum 1 weight 0.10000E+01 volume 0.61852E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 431} (( segid " " and resid 22 and name HB1 )) (( segid " " and resid 22 and name HA )) 2.800 0.900 0.900 peak 431 spectrum 1 weight 0.10000E+01 volume 0.22208E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 431} (( segid " " and resid 22 and name HB2 )) (( segid " " and resid 22 and name HA )) ASSI { 8} (( segid " " and resid 22 and name HN )) (( segid " " and resid 22 and name HA )) 2.700 0.900 0.900 peak 8 spectrum 1 weight 0.10000E+01 volume 0.19787E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 446} (( segid " " and resid 23 and name HB1 )) (( segid " " and resid 5 and name HB2 )) 2.700 2.700 3.300 peak 446 spectrum 1 weight 0.10000E+01 volume 0.10118E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 446} (( segid " " and resid 23 and name HB2 )) (( segid " " and resid 5 and name HB2 )) ASSI { 467} (( segid " " and resid 5 and name HB2 )) (( segid " " and resid 23 and name HB1 )) 3.600 1.600 1.600 peak 467 spectrum 1 weight 0.10000E+01 volume 0.11439E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 467} (( segid " " and resid 5 and name HB2 )) (( segid " " and resid 23 and name HB2 )) OR { 467} (( segid " " and resid 5 and name HB1 )) (( segid " " and resid 23 and name HB1 )) OR { 467} (( segid " " and resid 5 and name HB1 )) (( segid " " and resid 23 and name HB2 )) ASSI { 447} (( segid " " and resid 23 and name HB1 )) (( segid " " and resid 5 and name HG2 )) 2.800 1.000 1.000 peak 447 spectrum 1 weight 0.10000E+01 volume 0.15262E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 447} (( segid " " and resid 23 and name HB1 )) (( segid " " and resid 5 and name HG1 )) OR { 447} (( segid " " and resid 23 and name HB2 )) (( segid " " and resid 5 and name HG2 )) ASSI { 502} (( segid " " and resid 5 and name HG2 )) (( segid " " and resid 23 and name HB1 )) 3.200 1.300 1.300 peak 502 spectrum 1 weight 0.10000E+01 volume 0.11553E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 502} (( segid " " and resid 5 and name HG1 )) (( segid " " and resid 23 and name HB1 )) OR { 502} (( segid " " and resid 5 and name HG2 )) (( segid " " and resid 23 and name HB2 )) OR { 502} (( segid " " and resid 5 and name HG1 )) (( segid " " and resid 23 and name HB2 )) ASSI { 292} (( segid " " and resid 23 and name HA )) (( segid " " and resid 7 and name HA )) 2.200 0.600 0.600 peak 292 spectrum 1 weight 0.10000E+01 volume 0.51921E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 458} (( segid " " and resid 7 and name HB2 )) (( segid " " and resid 23 and name HA )) 3.500 1.500 1.500 peak 458 spectrum 1 weight 0.10000E+01 volume 0.11591E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 458} (( segid " " and resid 7 and name HB1 )) (( segid " " and resid 23 and name HA )) ASSI { 24} (( segid " " and resid 23 and name HN )) (( segid " " and resid 22 and name HA )) 1.900 1.900 4.100 peak 24 spectrum 1 weight 0.10000E+01 volume 0.13491E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 22} (( segid " " and resid 23 and name HN )) (( segid " " and resid 22 and name HB2 )) 4.200 2.200 1.800 peak 22 spectrum 1 weight 0.10000E+01 volume 0.66824E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 22} (( segid " " and resid 23 and name HN )) (( segid " " and resid 22 and name HB1 )) ASSI { 249} (( segid " " and resid 22 and name HN )) (( segid " " and resid 23 and name HN )) 3.400 1.500 1.500 peak 249 spectrum 1 weight 0.10000E+01 volume 0.66974E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 441} (( segid " " and resid 23 and name HB1 )) (( segid " " and resid 23 and name HA )) 2.400 0.700 0.700 peak 441 spectrum 1 weight 0.10000E+01 volume 0.48444E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 441} (( segid " " and resid 23 and name HB2 )) (( segid " " and resid 23 and name HA )) ASSI { 25} (( segid " " and resid 23 and name HN )) (( segid " " and resid 23 and name HA )) 2.500 0.800 0.800 peak 25 spectrum 1 weight 0.10000E+01 volume 0.32728E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 21} (( segid " " and resid 23 and name HN )) (( segid " " and resid 23 and name HB2 )) 2.400 0.700 0.700 peak 21 spectrum 1 weight 0.10000E+01 volume 0.46015E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 21} (( segid " " and resid 23 and name HN )) (( segid " " and resid 23 and name HB1 )) ASSI { 201} (( segid " " and resid 2 and name HN )) (( segid " " and resid 24 and name HA )) 2.200 2.200 3.800 peak 201 spectrum 1 weight 0.10000E+01 volume 0.15856E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 205} (( segid " " and resid 2 and name HN )) (( segid " " and resid 24 and name HB1 )) 2.900 1.100 1.100 peak 205 spectrum 1 weight 0.10000E+01 volume 0.17594E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 205} (( segid " " and resid 2 and name HN )) (( segid " " and resid 24 and name HB2 )) ASSI { 207} (( segid " " and resid 2 and name HN )) (( segid " " and resid 24 and name HG2 )) 3.800 1.900 1.900 peak 207 spectrum 1 weight 0.10000E+01 volume 0.74853E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 207} (( segid " " and resid 2 and name HN )) (( segid " " and resid 24 and name HG1 )) ASSI { 133} (( segid " " and resid 24 and name HN )) (( segid " " and resid 23 and name HB1 )) 2.900 1.100 1.100 peak 133 spectrum 1 weight 0.10000E+01 volume 0.14720E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 133} (( segid " " and resid 24 and name HN )) (( segid " " and resid 23 and name HB2 )) ASSI { 27} (( segid " " and resid 23 and name HN )) (( segid " " and resid 24 and name HN )) 2.800 1.000 1.000 peak 27 spectrum 1 weight 0.10000E+01 volume 0.16108E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 476} (( segid " " and resid 24 and name HB1 )) (( segid " " and resid 24 and name HA )) 2.100 0.600 0.600 peak 476 spectrum 1 weight 0.10000E+01 volume 0.63998E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 476} (( segid " " and resid 24 and name HB2 )) (( segid " " and resid 24 and name HA )) ASSI { 544} (( segid " " and resid 24 and name HG2 )) (( segid " " and resid 24 and name HA )) 3.300 1.400 1.400 peak 544 spectrum 1 weight 0.10000E+01 volume 0.14847E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 544} (( segid " " and resid 24 and name HG1 )) (( segid " " and resid 24 and name HA )) ASSI { 119} (( segid " " and resid 24 and name HN )) (( segid " " and resid 24 and name HA )) 2.300 0.700 0.700 peak 119 spectrum 1 weight 0.10000E+01 volume 0.47432E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 139} (( segid " " and resid 24 and name HN )) (( segid " " and resid 24 and name HB1 )) 2.800 1.000 1.000 peak 139 spectrum 1 weight 0.10000E+01 volume 0.21800E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 139} (( segid " " and resid 24 and name HN )) (( segid " " and resid 24 and name HB2 )) ASSI { 146} (( segid " " and resid 24 and name HN )) (( segid " " and resid 24 and name HG1 )) 2.500 0.800 0.800 peak 146 spectrum 1 weight 0.10000E+01 volume 0.23009E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 146} (( segid " " and resid 24 and name HN )) (( segid " " and resid 24 and name HG2 )) ASSI { 317} (( segid " " and resid 25 and name HA )) (( segid " " and resid 25 and name HB )) 2.700 0.900 0.900 peak 317 spectrum 1 weight 0.10000E+01 volume 0.24224E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 572} ( segid " " and resid 25 and name HG2%) (( segid " " and resid 25 and name HA )) 2.900 1.000 1.000 peak 572 spectrum 1 weight 0.10000E+01 volume 0.30263E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 73} (( segid " " and resid 25 and name HN )) (( segid " " and resid 25 and name HB )) 2.900 1.100 1.100 peak 73 spectrum 1 weight 0.10000E+01 volume 0.22183E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 49} (( segid " " and resid 25 and name HN )) ( segid " " and resid 25 and name HG2%) 3.300 1.400 1.400 peak 49 spectrum 1 weight 0.10000E+01 volume 0.13199E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 571} ( segid " " and resid 2 and name HG2%) (( segid " " and resid 2 and name HB )) 2.400 0.700 0.700 peak 571 spectrum 1 weight 0.10000E+01 volume 0.52857E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 571} ( segid " " and resid 2 and name HG2%) (( segid " " and resid 2 and name HA )) ASSI { 123} (( segid " " and resid 3 and name HN )) (( segid " " and resid 2 and name HA )) 1.900 0.500 0.500 peak 123 spectrum 1 weight 0.10000E+01 volume 0.13620E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 123} (( segid " " and resid 3 and name HN )) (( segid " " and resid 2 and name HB )) ASSI { 245} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HA )) 2.700 0.900 0.900 peak 245 spectrum 1 weight 0.10000E+01 volume 0.32115E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 245} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HA )) ASSI { 256} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HB1 )) 2.400 0.700 0.700 peak 256 spectrum 1 weight 0.10000E+01 volume 0.44970E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 256} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HB1 )) OR { 256} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HB2 )) OR { 256} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HB2 )) ASSI { 234} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 4 and name HB1 )) 3.900 1.900 1.900 peak 234 spectrum 1 weight 0.10000E+01 volume 0.96566E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 234} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 4 and name HB1 )) ASSI { 183} (( segid " " and resid 4 and name HN )) ( segid " " and resid 4 and name HD% ) 3.100 1.200 1.200 peak 183 spectrum 1 weight 0.10000E+01 volume 0.15459E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 183} (( segid " " and resid 4 and name HN )) ( segid " " and resid 4 and name HD% ) ASSI { 253} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 5 and name HD1 )) 3.500 1.600 1.600 peak 253 spectrum 1 weight 0.10000E+01 volume 0.17811E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 253} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 5 and name HD1 )) OR { 253} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 5 and name HD2 )) OR { 253} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 5 and name HD2 )) ASSI { 462} (( segid " " and resid 5 and name HB1 )) (( segid " " and resid 5 and name HG1 )) 1.600 0.300 0.600 peak 462 spectrum 1 weight 0.10000E+01 volume 0.22948E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 462} (( segid " " and resid 5 and name HB2 )) (( segid " " and resid 5 and name HG2 )) OR { 462} (( segid " " and resid 5 and name HB1 )) (( segid " " and resid 5 and name HG2 )) OR { 462} (( segid " " and resid 5 and name HB2 )) (( segid " " and resid 5 and name HG1 )) ASSI { 564} (( segid " " and resid 6 and name HG11)) (( segid " " and resid 5 and name HG2 )) 4.200 2.300 1.800 peak 564 spectrum 1 weight 0.10000E+01 volume 0.25984E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 564} (( segid " " and resid 6 and name HG11)) (( segid " " and resid 5 and name HG1 )) ASSI { 518} (( segid " " and resid 6 and name HB )) (( segid " " and resid 6 and name HG11)) 2.300 0.700 0.700 peak 518 spectrum 1 weight 0.10000E+01 volume 0.29595E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 47} (( segid " " and resid 7 and name HN )) ( segid " " and resid 6 and name HD1%) 4.000 2.000 2.000 peak 47 spectrum 1 weight 0.10000E+01 volume 0.12217E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 596} ( segid " " and resid 8 and name HG2%) (( segid " " and resid 8 and name HG12)) 2.500 0.800 0.800 peak 596 spectrum 1 weight 0.10000E+01 volume 0.34965E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 144} (( segid " " and resid 8 and name HN )) (( segid " " and resid 6 and name HB )) 2.900 1.100 1.100 peak 144 spectrum 1 weight 0.10000E+01 volume 0.14446E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 453} (( segid " " and resid 7 and name HB2 )) (( segid " " and resid 23 and name HB1 )) 3.900 2.000 2.000 peak 453 spectrum 1 weight 0.10000E+01 volume 0.63945E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 453} (( segid " " and resid 7 and name HB2 )) (( segid " " and resid 23 and name HB2 )) OR { 453} (( segid " " and resid 7 and name HB1 )) (( segid " " and resid 23 and name HB2 )) OR { 453} (( segid " " and resid 7 and name HB1 )) (( segid " " and resid 23 and name HB1 )) ASSI { 418} (( segid " " and resid 9 and name HB2 )) (( segid " " and resid 8 and name HA )) 3.700 1.700 1.700 peak 418 spectrum 1 weight 0.10000E+01 volume 0.30838E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 418} (( segid " " and resid 9 and name HB2 )) (( segid " " and resid 8 and name HA )) OR { 418} (( segid " " and resid 9 and name HB1 )) (( segid " " and resid 8 and name HA )) OR { 418} (( segid " " and resid 9 and name HB1 )) (( segid " " and resid 8 and name HA )) ASSI { 280} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 9 and name HB1 )) 1.900 0.400 0.400 peak 280 spectrum 1 weight 0.10000E+01 volume 0.16826E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 280} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 9 and name HB1 )) OR { 280} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 9 and name HB1 )) OR { 280} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 9 and name HB1 )) OR { 280} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 9 and name HB2 )) OR { 280} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 9 and name HB2 )) OR { 280} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 9 and name HB2 )) ASSI { 287} ( segid " " and resid 9 and name HD% ) ( segid " " and resid 9 and name HE% ) 1.700 0.300 0.500 peak 287 spectrum 1 weight 0.10000E+01 volume 0.27528E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 287} ( segid " " and resid 9 and name HD% ) ( segid " " and resid 9 and name HE% ) OR { 287} ( segid " " and resid 9 and name HD% ) ( segid " " and resid 9 and name HE% ) OR { 287} ( segid " " and resid 9 and name HD% ) ( segid " " and resid 9 and name HE% ) ASSI { 40} (( segid " " and resid 9 and name HN )) (( segid " " and resid 9 and name HB2 )) 1.800 0.400 0.400 peak 40 spectrum 1 weight 0.10000E+01 volume 0.15739E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 40} (( segid " " and resid 9 and name HN )) (( segid " " and resid 9 and name HB2 )) OR { 40} (( segid " " and resid 9 and name HN )) (( segid " " and resid 9 and name HB1 )) OR { 40} (( segid " " and resid 9 and name HN )) (( segid " " and resid 9 and name HB1 )) ASSI { 87} (( segid " " and resid 9 and name HN )) ( segid " " and resid 9 and name HD% ) 4.600 2.600 1.400 peak 87 spectrum 1 weight 0.10000E+01 volume 0.78753E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 87} (( segid " " and resid 9 and name HN )) ( segid " " and resid 9 and name HD% ) ASSI { 243} ( segid " " and resid 9 and name HE% ) (( segid " " and resid 9 and name HZ )) 2.000 0.500 0.500 peak 243 spectrum 1 weight 0.10000E+01 volume 0.11294E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 243} ( segid " " and resid 9 and name HE% ) (( segid " " and resid 9 and name HZ )) ASSI { 425} (( segid " " and resid 9 and name HB1 )) (( segid " " and resid 10 and name HA )) 3.500 1.500 1.500 peak 425 spectrum 1 weight 0.10000E+01 volume 0.11691E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 425} (( segid " " and resid 9 and name HB1 )) (( segid " " and resid 10 and name HA )) OR { 425} (( segid " " and resid 9 and name HB2 )) (( segid " " and resid 10 and name HA )) OR { 425} (( segid " " and resid 9 and name HB2 )) (( segid " " and resid 10 and name HA )) ASSI { 132} (( segid " " and resid 10 and name HN )) (( segid " " and resid 9 and name HB1 )) 3.400 1.400 1.400 peak 132 spectrum 1 weight 0.10000E+01 volume 0.28279E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 132} (( segid " " and resid 10 and name HN )) (( segid " " and resid 9 and name HB1 )) OR { 132} (( segid " " and resid 10 and name HN )) (( segid " " and resid 9 and name HB2 )) OR { 132} (( segid " " and resid 10 and name HN )) (( segid " " and resid 9 and name HB2 )) ASSI { 288} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 10 and name HN )) 3.200 1.300 1.300 peak 288 spectrum 1 weight 0.10000E+01 volume 0.12235E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 288} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 10 and name HN )) ASSI { 173} (( segid " " and resid 12 and name HN )) (( segid " " and resid 12 and name HA1 )) 2.100 0.600 0.600 peak 173 spectrum 1 weight 0.10000E+01 volume 0.57105E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 173} (( segid " " and resid 12 and name HN )) (( segid " " and resid 12 and name HA1 )) OR { 173} (( segid " " and resid 12 and name HN )) (( segid " " and resid 12 and name HA2 )) OR { 173} (( segid " " and resid 12 and name HN )) (( segid " " and resid 12 and name HA2 )) ASSI { 90} (( segid " " and resid 15 and name HN )) (( segid " " and resid 16 and name HN )) 3.400 1.500 1.500 peak 90 spectrum 1 weight 0.10000E+01 volume 0.61506E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 498} (( segid " " and resid 16 and name HB1 )) (( segid " " and resid 16 and name HD2 )) 2.800 0.900 0.900 peak 498 spectrum 1 weight 0.10000E+01 volume 0.32578E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 498} (( segid " " and resid 16 and name HB1 )) (( segid " " and resid 16 and name HD2 )) OR { 498} (( segid " " and resid 16 and name HB2 )) (( segid " " and resid 16 and name HD1 )) OR { 498} (( segid " " and resid 16 and name HB1 )) (( segid " " and resid 16 and name HD1 )) OR { 498} (( segid " " and resid 16 and name HB1 )) (( segid " " and resid 16 and name HD1 )) OR { 498} (( segid " " and resid 16 and name HB2 )) (( segid " " and resid 16 and name HD2 )) OR { 498} (( segid " " and resid 16 and name HB2 )) (( segid " " and resid 16 and name HD2 )) ASSI { 281} (( segid " " and resid 16 and name HE )) (( segid " " and resid 16 and name HD1 )) 2.100 0.600 0.600 peak 281 spectrum 1 weight 0.10000E+01 volume 0.69830E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 281} (( segid " " and resid 16 and name HE )) (( segid " " and resid 16 and name HD1 )) OR { 281} (( segid " " and resid 16 and name HE )) (( segid " " and resid 16 and name HD2 )) OR { 281} (( segid " " and resid 16 and name HE )) (( segid " " and resid 16 and name HD2 )) ASSI { 366} (( segid " " and resid 16 and name HD1 )) (( segid " " and resid 16 and name HG2 )) 2.400 0.700 0.700 peak 366 spectrum 1 weight 0.10000E+01 volume 0.28914E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 366} (( segid " " and resid 16 and name HD1 )) (( segid " " and resid 16 and name HG2 )) OR { 366} (( segid " " and resid 16 and name HD2 )) (( segid " " and resid 16 and name HG1 )) OR { 366} (( segid " " and resid 16 and name HD2 )) (( segid " " and resid 16 and name HG1 )) OR { 366} (( segid " " and resid 16 and name HD2 )) (( segid " " and resid 16 and name HG2 )) OR { 366} (( segid " " and resid 16 and name HD1 )) (( segid " " and resid 16 and name HG1 )) OR { 366} (( segid " " and resid 16 and name HD1 )) (( segid " " and resid 16 and name HG1 )) ASSI { 318} (( segid " " and resid 12 and name HA1 )) (( segid " " and resid 17 and name HA )) 3.000 1.100 1.100 peak 318 spectrum 1 weight 0.10000E+01 volume 0.23245E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 318} (( segid " " and resid 12 and name HA1 )) (( segid " " and resid 17 and name HA )) OR { 318} (( segid " " and resid 12 and name HA2 )) (( segid " " and resid 17 and name HA )) OR { 318} (( segid " " and resid 12 and name HA2 )) (( segid " " and resid 17 and name HA )) ASSI { 71} (( segid " " and resid 17 and name HN )) (( segid " " and resid 17 and name HB2 )) 2.500 0.800 0.800 peak 71 spectrum 1 weight 0.10000E+01 volume 0.40301E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 71} (( segid " " and resid 17 and name HN )) (( segid " " and resid 17 and name HB2 )) OR { 71} (( segid " " and resid 17 and name HN )) (( segid " " and resid 17 and name HB1 )) OR { 71} (( segid " " and resid 17 and name HN )) (( segid " " and resid 17 and name HB1 )) ASSI { 223} (( segid " " and resid 18 and name HN )) (( segid " " and resid 12 and name HA1 )) 2.800 1.000 1.000 peak 223 spectrum 1 weight 0.10000E+01 volume 0.14831E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 223} (( segid " " and resid 18 and name HN )) (( segid " " and resid 12 and name HA1 )) OR { 223} (( segid " " and resid 18 and name HN )) (( segid " " and resid 12 and name HA2 )) OR { 223} (( segid " " and resid 18 and name HN )) (( segid " " and resid 12 and name HA2 )) ASSI { 271} (( segid " " and resid 16 and name HE )) (( segid " " and resid 18 and name HD1 )) 2.400 2.400 3.600 peak 271 spectrum 1 weight 0.10000E+01 volume 0.12011E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 271} (( segid " " and resid 16 and name HE )) (( segid " " and resid 18 and name HD1 )) OR { 271} (( segid " " and resid 16 and name HE )) (( segid " " and resid 18 and name HD2 )) ASSI { 530} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 18 and name HD1 )) 2.500 0.800 0.800 peak 530 spectrum 1 weight 0.10000E+01 volume 0.56878E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 530} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 18 and name HD1 )) OR { 530} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 18 and name HD1 )) OR { 530} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 18 and name HD1 )) OR { 530} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 18 and name HD2 )) OR { 530} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 18 and name HD2 )) OR { 530} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 18 and name HD2 )) ASSI { 516} (( segid " " and resid 18 and name HD1 )) (( segid " " and resid 18 and name HG2 )) 2.300 0.600 0.600 peak 516 spectrum 1 weight 0.10000E+01 volume 0.45400E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 516} (( segid " " and resid 18 and name HD1 )) (( segid " " and resid 18 and name HG2 )) OR { 516} (( segid " " and resid 18 and name HD2 )) (( segid " " and resid 18 and name HG2 )) OR { 516} (( segid " " and resid 18 and name HD2 )) (( segid " " and resid 18 and name HG2 )) OR { 516} (( segid " " and resid 18 and name HD1 )) (( segid " " and resid 18 and name HG1 )) OR { 516} (( segid " " and resid 18 and name HD1 )) (( segid " " and resid 18 and name HG1 )) OR { 516} (( segid " " and resid 18 and name HD2 )) (( segid " " and resid 18 and name HG1 )) ASSI { 367} (( segid " " and resid 16 and name HD1 )) (( segid " " and resid 18 and name HG2 )) 2.500 2.500 3.500 peak 367 spectrum 1 weight 0.10000E+01 volume 0.85418E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 367} (( segid " " and resid 16 and name HD1 )) (( segid " " and resid 18 and name HG2 )) OR { 367} (( segid " " and resid 16 and name HD2 )) (( segid " " and resid 18 and name HG2 )) OR { 367} (( segid " " and resid 16 and name HD2 )) (( segid " " and resid 18 and name HG2 )) OR { 367} (( segid " " and resid 16 and name HD1 )) (( segid " " and resid 18 and name HG1 )) OR { 367} (( segid " " and resid 16 and name HD1 )) (( segid " " and resid 18 and name HG1 )) ASSI { 226} (( segid " " and resid 18 and name HN )) (( segid " " and resid 16 and name HD1 )) 2.500 2.500 3.500 peak 226 spectrum 1 weight 0.10000E+01 volume 0.98773E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 226} (( segid " " and resid 18 and name HN )) (( segid " " and resid 16 and name HD1 )) OR { 226} (( segid " " and resid 18 and name HN )) (( segid " " and resid 16 and name HD2 )) OR { 226} (( segid " " and resid 18 and name HN )) (( segid " " and resid 16 and name HD2 )) ASSI { 57} (( segid " " and resid 17 and name HN )) (( segid " " and resid 18 and name HD1 )) 3.300 1.400 1.400 peak 57 spectrum 1 weight 0.10000E+01 volume 0.19274E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 57} (( segid " " and resid 17 and name HN )) (( segid " " and resid 18 and name HD1 )) OR { 57} (( segid " " and resid 17 and name HN )) (( segid " " and resid 18 and name HD2 )) OR { 57} (( segid " " and resid 17 and name HN )) (( segid " " and resid 18 and name HD2 )) ASSI { 224} (( segid " " and resid 18 and name HN )) (( segid " " and resid 17 and name HB1 )) 3.300 1.400 1.400 peak 224 spectrum 1 weight 0.10000E+01 volume 0.31096E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 224} (( segid " " and resid 18 and name HN )) (( segid " " and resid 17 and name HB1 )) OR { 224} (( segid " " and resid 18 and name HN )) (( segid " " and resid 17 and name HB2 )) OR { 224} (( segid " " and resid 18 and name HN )) (( segid " " and resid 17 and name HB2 )) ASSI { 481} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 18 and name HA )) 2.300 0.600 0.600 peak 481 spectrum 1 weight 0.10000E+01 volume 0.40233E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 481} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 18 and name HA )) OR { 481} (( segid " " and resid 18 and name HB2 )) (( segid " " and resid 18 and name HA )) OR { 481} (( segid " " and resid 18 and name HB2 )) (( segid " " and resid 18 and name HA )) ASSI { 482} (( segid " " and resid 18 and name HD2 )) (( segid " " and resid 18 and name HA )) 3.400 1.400 1.400 peak 482 spectrum 1 weight 0.10000E+01 volume 0.26792E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 482} (( segid " " and resid 18 and name HD2 )) (( segid " " and resid 18 and name HA )) OR { 482} (( segid " " and resid 18 and name HD1 )) (( segid " " and resid 18 and name HA )) OR { 482} (( segid " " and resid 18 and name HD1 )) (( segid " " and resid 18 and name HA )) ASSI { 515} (( segid " " and resid 18 and name HB2 )) (( segid " " and resid 18 and name HG1 )) 2.200 0.600 0.600 peak 515 spectrum 1 weight 0.10000E+01 volume 0.51113E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 515} (( segid " " and resid 18 and name HB2 )) (( segid " " and resid 18 and name HG1 )) OR { 515} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 18 and name HG2 )) OR { 515} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 18 and name HG1 )) OR { 515} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 18 and name HG1 )) OR { 515} (( segid " " and resid 18 and name HB2 )) (( segid " " and resid 18 and name HG2 )) OR { 515} (( segid " " and resid 18 and name HB2 )) (( segid " " and resid 18 and name HG2 )) ASSI { 534} (( segid " " and resid 18 and name HG1 )) (( segid " " and resid 18 and name HE2 )) 2.800 1.000 1.000 peak 534 spectrum 1 weight 0.10000E+01 volume 0.29734E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 534} (( segid " " and resid 18 and name HG1 )) (( segid " " and resid 18 and name HE2 )) OR { 534} (( segid " " and resid 18 and name HG1 )) (( segid " " and resid 18 and name HE1 )) OR { 534} (( segid " " and resid 18 and name HG1 )) (( segid " " and resid 18 and name HE1 )) OR { 534} (( segid " " and resid 18 and name HG2 )) (( segid " " and resid 18 and name HE2 )) OR { 534} (( segid " " and resid 18 and name HG2 )) (( segid " " and resid 18 and name HE2 )) OR { 534} (( segid " " and resid 18 and name HG2 )) (( segid " " and resid 18 and name HE1 )) ASSI { 227} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HB1 )) 3.100 1.200 1.200 peak 227 spectrum 1 weight 0.10000E+01 volume 0.19173E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 227} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HB1 )) OR { 227} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HB2 )) OR { 227} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HB2 )) ASSI { 228} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HD1 )) 2.900 1.100 1.100 peak 228 spectrum 1 weight 0.10000E+01 volume 0.62457E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 228} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HD1 )) OR { 228} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HD2 )) OR { 228} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HD2 )) ASSI { 358} (( segid " " and resid 16 and name HD2 )) (( segid " " and resid 14 and name HB2 )) 1.600 1.600 4.400 peak 358 spectrum 1 weight 0.10000E+01 volume 0.15946E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 358} (( segid " " and resid 16 and name HD2 )) (( segid " " and resid 14 and name HB2 )) OR { 358} (( segid " " and resid 16 and name HD1 )) (( segid " " and resid 14 and name HB2 )) OR { 358} (( segid " " and resid 16 and name HD1 )) (( segid " " and resid 14 and name HB2 )) OR { 358} (( segid " " and resid 16 and name HD2 )) (( segid " " and resid 14 and name HB1 )) OR { 358} (( segid " " and resid 16 and name HD2 )) (( segid " " and resid 14 and name HB1 )) ASSI { 277} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 19 and name HB1 )) 4.700 2.700 1.300 peak 277 spectrum 1 weight 0.10000E+01 volume 0.52804E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 277} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 19 and name HB1 )) OR { 277} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 19 and name HB2 )) OR { 277} ( segid " " and resid 9 and name HD% ) (( segid " " and resid 19 and name HB2 )) ASSI { 265} ( segid " " and resid 9 and name HE% ) (( segid " " and resid 19 and name HB1 )) 3.000 1.200 1.200 peak 265 spectrum 1 weight 0.10000E+01 volume 0.22963E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 265} ( segid " " and resid 9 and name HE% ) (( segid " " and resid 19 and name HB1 )) OR { 265} ( segid " " and resid 9 and name HE% ) (( segid " " and resid 19 and name HB2 )) OR { 265} ( segid " " and resid 9 and name HE% ) (( segid " " and resid 19 and name HB2 )) ASSI { 56} (( segid " " and resid 19 and name HN )) (( segid " " and resid 18 and name HB2 )) 2.700 0.900 0.900 peak 56 spectrum 1 weight 0.10000E+01 volume 0.52955E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 56} (( segid " " and resid 19 and name HN )) (( segid " " and resid 18 and name HB2 )) OR { 56} (( segid " " and resid 19 and name HN )) (( segid " " and resid 18 and name HB1 )) OR { 56} (( segid " " and resid 19 and name HN )) (( segid " " and resid 18 and name HB1 )) ASSI { 66} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HB2 )) 2.300 0.700 0.700 peak 66 spectrum 1 weight 0.10000E+01 volume 0.51549E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 66} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HB1 )) ASSI { 452} (( segid " " and resid 21 and name HG2 )) (( segid " " and resid 9 and name HB2 )) 3.300 1.300 1.300 peak 452 spectrum 1 weight 0.10000E+01 volume 0.98765E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 452} (( segid " " and resid 21 and name HG2 )) (( segid " " and resid 9 and name HB2 )) OR { 452} (( segid " " and resid 21 and name HG2 )) (( segid " " and resid 9 and name HB2 )) OR { 452} (( segid " " and resid 21 and name HG2 )) (( segid " " and resid 9 and name HB2 )) OR { 452} (( segid " " and resid 21 and name HG1 )) (( segid " " and resid 9 and name HB2 )) OR { 452} (( segid " " and resid 21 and name HG1 )) (( segid " " and resid 9 and name HB2 )) OR { 452} (( segid " " and resid 21 and name HG1 )) (( segid " " and resid 9 and name HB2 )) ASSI { 88} (( segid " " and resid 21 and name HN )) ( segid " " and resid 9 and name HD% ) 3.600 1.600 1.600 peak 88 spectrum 1 weight 0.10000E+01 volume 0.68631E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 88} (( segid " " and resid 21 and name HN )) ( segid " " and resid 9 and name HD% ) ASSI { 472} (( segid " " and resid 21 and name HB1 )) (( segid " " and resid 21 and name HA )) 2.500 0.800 0.800 peak 472 spectrum 1 weight 0.10000E+01 volume 0.20784E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 472} (( segid " " and resid 21 and name HB2 )) (( segid " " and resid 21 and name HA )) OR { 472} ( segid " " and resid 21 and name HE% ) (( segid " " and resid 21 and name HA )) ASSI { 461} ( segid " " and resid 21 and name HE% ) (( segid " " and resid 21 and name HB2 )) 1.800 0.400 0.400 peak 461 spectrum 1 weight 0.10000E+01 volume 0.28272E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 461} ( segid " " and resid 21 and name HE% ) (( segid " " and resid 21 and name HB1 )) ASSI { 456} (( segid " " and resid 21 and name HG2 )) (( segid " " and resid 21 and name HA )) 2.700 0.900 0.900 peak 456 spectrum 1 weight 0.10000E+01 volume 0.19662E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 456} (( segid " " and resid 21 and name HG2 )) (( segid " " and resid 21 and name HA )) OR { 456} (( segid " " and resid 21 and name HG1 )) (( segid " " and resid 21 and name HA )) OR { 456} (( segid " " and resid 21 and name HG1 )) (( segid " " and resid 21 and name HA )) ASSI { 450} (( segid " " and resid 21 and name HG2 )) (( segid " " and resid 21 and name HB1 )) 2.200 0.600 0.600 peak 450 spectrum 1 weight 0.10000E+01 volume 0.74327E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 450} (( segid " " and resid 21 and name HG2 )) (( segid " " and resid 21 and name HB1 )) OR { 450} (( segid " " and resid 21 and name HG1 )) (( segid " " and resid 21 and name HB2 )) OR { 450} (( segid " " and resid 21 and name HG1 )) (( segid " " and resid 21 and name HB2 )) OR { 450} (( segid " " and resid 21 and name HG2 )) (( segid " " and resid 21 and name HB2 )) OR { 450} (( segid " " and resid 21 and name HG2 )) (( segid " " and resid 21 and name HB2 )) OR { 450} (( segid " " and resid 21 and name HG1 )) (( segid " " and resid 21 and name HB1 )) OR { 450} (( segid " " and resid 21 and name HG1 )) (( segid " " and resid 21 and name HB1 )) OR { 450} (( segid " " and resid 21 and name HG2 )) ( segid " " and resid 21 and name HE% ) OR { 450} (( segid " " and resid 21 and name HG2 )) ( segid " " and resid 21 and name HE% ) ASSI { 448} (( segid " " and resid 21 and name HG2 )) (( segid " " and resid 21 and name HB1 )) 2.200 0.600 0.600 peak 448 spectrum 1 weight 0.10000E+01 volume 0.76215E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 448} (( segid " " and resid 21 and name HG2 )) (( segid " " and resid 21 and name HB1 )) OR { 448} (( segid " " and resid 21 and name HG1 )) (( segid " " and resid 21 and name HB2 )) OR { 448} (( segid " " and resid 21 and name HG1 )) (( segid " " and resid 21 and name HB2 )) OR { 448} (( segid " " and resid 21 and name HG2 )) (( segid " " and resid 21 and name HB2 )) OR { 448} (( segid " " and resid 21 and name HG2 )) (( segid " " and resid 21 and name HB2 )) OR { 448} (( segid " " and resid 21 and name HG1 )) (( segid " " and resid 21 and name HB1 )) ASSI { 61} (( segid " " and resid 21 and name HN )) (( segid " " and resid 21 and name HB2 )) 2.100 0.600 0.600 peak 61 spectrum 1 weight 0.10000E+01 volume 0.99185E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 61} (( segid " " and resid 21 and name HN )) (( segid " " and resid 21 and name HB1 )) OR { 61} (( segid " " and resid 21 and name HN )) ( segid " " and resid 21 and name HE% ) ASSI { 55} (( segid " " and resid 21 and name HN )) (( segid " " and resid 21 and name HB2 )) 2.200 0.600 0.600 peak 55 spectrum 1 weight 0.10000E+01 volume 0.63502E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 55} (( segid " " and resid 21 and name HN )) (( segid " " and resid 21 and name HB1 )) ASSI { 63} (( segid " " and resid 21 and name HN )) (( segid " " and resid 21 and name HG1 )) 2.200 0.600 0.600 peak 63 spectrum 1 weight 0.10000E+01 volume 0.82280E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 63} (( segid " " and resid 21 and name HN )) (( segid " " and resid 21 and name HG1 )) OR { 63} (( segid " " and resid 21 and name HN )) (( segid " " and resid 21 and name HG2 )) OR { 63} (( segid " " and resid 21 and name HN )) (( segid " " and resid 21 and name HG2 )) ASSI { 13} (( segid " " and resid 22 and name HN )) (( segid " " and resid 21 and name HG2 )) 4.300 2.300 1.700 peak 13 spectrum 1 weight 0.10000E+01 volume 0.10415E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 13} (( segid " " and resid 22 and name HN )) (( segid " " and resid 21 and name HG2 )) OR { 13} (( segid " " and resid 22 and name HN )) (( segid " " and resid 21 and name HG1 )) OR { 13} (( segid " " and resid 22 and name HN )) (( segid " " and resid 21 and name HG1 )) ASSI { 399} (( segid " " and resid 22 and name HB1 )) (( segid " " and resid 24 and name HE2 )) 2.200 2.200 3.800 peak 399 spectrum 1 weight 0.10000E+01 volume 0.22777E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 399} (( segid " " and resid 22 and name HB1 )) (( segid " " and resid 24 and name HE2 )) OR { 399} (( segid " " and resid 22 and name HB1 )) (( segid " " and resid 24 and name HE1 )) OR { 399} (( segid " " and resid 22 and name HB1 )) (( segid " " and resid 24 and name HE1 )) OR { 399} (( segid " " and resid 22 and name HB2 )) (( segid " " and resid 24 and name HE2 )) OR { 399} (( segid " " and resid 22 and name HB2 )) (( segid " " and resid 24 and name HE2 )) OR { 399} (( segid " " and resid 22 and name HB2 )) (( segid " " and resid 24 and name HE1 )) ASSI { 206} (( segid " " and resid 2 and name HN )) (( segid " " and resid 24 and name HB1 )) 3.000 1.100 1.100 peak 206 spectrum 1 weight 0.10000E+01 volume 0.18460E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 206} (( segid " " and resid 2 and name HN )) (( segid " " and resid 24 and name HB2 )) OR { 206} (( segid " " and resid 2 and name HN )) (( segid " " and resid 24 and name HD1 )) ASSI { 608} (( segid " " and resid 6 and name HN )) (( segid " " and resid 8 and name HN )) 3.200 1.300 1.300 peak 608 spectrum 1 weight 0.10000E+01 volume 0.21698E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 12} (( segid " " and resid 22 and name HN )) (( segid " " and resid 22 and name HB2 )) 2.600 0.900 0.900 peak 12 spectrum 1 weight 0.10000E+01 volume 0.30873E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 12} (( segid " " and resid 22 and name HN )) (( segid " " and resid 22 and name HB1 )) ASSI { 549} (( segid " " and resid 24 and name HG1 )) (( segid " " and resid 24 and name HE2 )) 3.000 1.100 1.100 peak 549 spectrum 1 weight 0.10000E+01 volume 0.16296E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 549} (( segid " " and resid 24 and name HG1 )) (( segid " " and resid 24 and name HE2 )) OR { 549} (( segid " " and resid 24 and name HG2 )) (( segid " " and resid 24 and name HE2 )) OR { 549} (( segid " " and resid 24 and name HG2 )) (( segid " " and resid 24 and name HE2 )) OR { 549} (( segid " " and resid 24 and name HG1 )) (( segid " " and resid 24 and name HE1 )) OR { 549} (( segid " " and resid 24 and name HG2 )) (( segid " " and resid 24 and name HE1 )) OR { 549} (( segid " " and resid 24 and name HG2 )) (( segid " " and resid 24 and name HE1 )) ASSI { 97} (( segid " " and resid 8 and name HN )) (( segid " " and resid 22 and name HN )) 2.500 2.500 3.500 peak 97 spectrum 1 weight 0.10000E+01 volume 0.29879E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 513} (( segid " " and resid 24 and name HB1 )) (( segid " " and resid 24 and name HG2 )) 2.200 0.600 0.600 peak 513 spectrum 1 weight 0.10000E+01 volume 0.52467E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 513} (( segid " " and resid 24 and name HB2 )) (( segid " " and resid 24 and name HG1 )) OR { 513} (( segid " " and resid 24 and name HD2 )) (( segid " " and resid 24 and name HG1 )) OR { 513} (( segid " " and resid 24 and name HD2 )) (( segid " " and resid 24 and name HG1 )) OR { 513} (( segid " " and resid 24 and name HD1 )) (( segid " " and resid 24 and name HG2 )) OR { 513} (( segid " " and resid 24 and name HD1 )) (( segid " " and resid 24 and name HG2 )) OR { 513} (( segid " " and resid 24 and name HD2 )) (( segid " " and resid 24 and name HG2 )) OR { 513} (( segid " " and resid 24 and name HD2 )) (( segid " " and resid 24 and name HG2 )) OR { 513} (( segid " " and resid 24 and name HB2 )) (( segid " " and resid 24 and name HG2 )) OR { 513} (( segid " " and resid 24 and name HB1 )) (( segid " " and resid 24 and name HG1 )) ASSI { 550} (( segid " " and resid 24 and name HG2 )) (( segid " " and resid 24 and name HB1 )) 2.200 0.600 0.600 peak 550 spectrum 1 weight 0.10000E+01 volume 0.54699E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 550} (( segid " " and resid 24 and name HG2 )) (( segid " " and resid 24 and name HB1 )) OR { 550} (( segid " " and resid 24 and name HG1 )) (( segid " " and resid 24 and name HB2 )) OR { 550} (( segid " " and resid 24 and name HG1 )) (( segid " " and resid 24 and name HB2 )) OR { 550} (( segid " " and resid 24 and name HG2 )) (( segid " " and resid 24 and name HB2 )) OR { 550} (( segid " " and resid 24 and name HG2 )) (( segid " " and resid 24 and name HB2 )) OR { 550} (( segid " " and resid 24 and name HG1 )) (( segid " " and resid 24 and name HB1 )) ASSI { 143} (( segid " " and resid 24 and name HN )) (( segid " " and resid 24 and name HB1 )) 2.800 1.000 1.000 peak 143 spectrum 1 weight 0.10000E+01 volume 0.37242E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 143} (( segid " " and resid 24 and name HN )) (( segid " " and resid 24 and name HB2 )) OR { 143} (( segid " " and resid 24 and name HN )) (( segid " " and resid 24 and name HD1 )) OR { 143} (( segid " " and resid 24 and name HN )) (( segid " " and resid 24 and name HD2 )) OR { 143} (( segid " " and resid 24 and name HN )) (( segid " " and resid 24 and name HD2 ))
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