NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
8372 | 1m4e | 5501 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 24} (( segid " " and resid 6 and name HN )) (( segid " " and resid 6 and name HB2 )) 2.500 0.800 0.800 peak 24 spectrum 1 weight 0.10000E+01 volume 0.56378E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 24} (( segid " " and resid 6 and name HN )) (( segid " " and resid 6 and name HB1 )) OR { 24} (( segid " " and resid 6 and name HN )) (( segid " " and resid 5 and name HB1 )) ASSI { 33} (( segid " " and resid 16 and name HN )) (( segid " " and resid 15 and name HN )) 3.500 1.500 1.500 peak 33 spectrum 1 weight 0.10000E+01 volume 0.19168E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 33} (( segid " " and resid 14 and name HN )) (( segid " " and resid 15 and name HN )) ASSI { 129} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HB2 )) 2.600 0.800 0.800 peak 129 spectrum 1 weight 0.10000E+01 volume 0.33656E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 129} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HB1 )) OR { 129} (( segid " " and resid 13 and name HN )) (( segid " " and resid 11 and name HB1 )) ASSI { 80} (( segid " " and resid 3 and name HN )) (( segid " " and resid 2 and name HA )) 1.600 0.300 0.600 peak 80 spectrum 1 weight 0.10000E+01 volume 0.14997E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 80} (( segid " " and resid 3 and name HN )) (( segid " " and resid 18 and name HA )) ASSI { 109} (( segid " " and resid 20 and name HN )) (( segid " " and resid 19 and name HA )) 1.900 0.400 0.400 peak 109 spectrum 1 weight 0.10000E+01 volume 0.15738E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 109} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HA )) ASSI { 24} (( segid " " and resid 6 and name HN )) (( segid " " and resid 6 and name HB2 )) 2.600 0.800 0.800 peak 24 spectrum 1 weight 0.10000E+01 volume 0.42997E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 24} (( segid " " and resid 6 and name HN )) (( segid " " and resid 6 and name HB1 )) OR { 24} (( segid " " and resid 6 and name HN )) (( segid " " and resid 5 and name HB1 )) OR { 24} (( segid " " and resid 6 and name HN )) (( segid " " and resid 5 and name HB2 )) ASSI { 157} (( segid " " and resid 11 and name HN )) (( segid " " and resid 10 and name HN )) 4.600 2.600 1.400 peak 157 spectrum 1 weight 0.10000E+01 volume 0.51649E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 157} (( segid " " and resid 8 and name HN )) (( segid " " and resid 10 and name HN )) ASSI { 133} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HB2 )) 3.600 1.600 1.600 peak 133 spectrum 1 weight 0.10000E+01 volume 0.93472E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 133} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HB2 )) OR { 133} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HB1 )) OR { 133} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HB1 )) OR { 133} (( segid " " and resid 20 and name HN )) (( segid " " and resid 19 and name HB2 )) OR { 133} (( segid " " and resid 20 and name HN )) (( segid " " and resid 19 and name HB1 )) OR { 133} (( segid " " and resid 20 and name HN )) (( segid " " and resid 19 and name HB1 )) ASSI { 119} (( segid " " and resid 11 and name HB2 )) (( segid " " and resid 11 and name HG1 )) 2.200 0.600 0.600 peak 119 spectrum 1 weight 0.10000E+01 volume 0.77607E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 119} (( segid " " and resid 19 and name HB2 )) (( segid " " and resid 19 and name HG2 )) OR { 119} (( segid " " and resid 19 and name HB2 )) (( segid " " and resid 19 and name HG2 )) OR { 119} (( segid " " and resid 19 and name HB1 )) (( segid " " and resid 19 and name HG1 )) OR { 119} (( segid " " and resid 19 and name HB1 )) (( segid " " and resid 19 and name HG1 )) OR { 119} (( segid " " and resid 19 and name HB1 )) (( segid " " and resid 19 and name HG2 )) OR { 119} (( segid " " and resid 19 and name HB1 )) (( segid " " and resid 19 and name HG2 )) OR { 119} (( segid " " and resid 19 and name HB2 )) (( segid " " and resid 19 and name HG1 )) OR { 119} (( segid " " and resid 19 and name HB2 )) (( segid " " and resid 19 and name HG1 )) OR { 119} (( segid " " and resid 11 and name HB2 )) (( segid " " and resid 11 and name HG2 )) ASSI { 198} (( segid " " and resid 1 and name HA )) (( segid " " and resid 1 and name HB )) 2.000 0.500 0.500 peak 198 spectrum 1 weight 0.10000E+01 volume 0.11123E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 194} (( segid " " and resid 1 and name HA )) ( segid " " and resid 1 and name HD1%) 3.800 1.800 1.800 peak 194 spectrum 1 weight 0.10000E+01 volume 0.19170E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 342} ( segid " " and resid 1 and name HD1%) (( segid " " and resid 1 and name HB )) 2.800 1.000 1.000 peak 342 spectrum 1 weight 0.10000E+01 volume 0.29187E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 196} (( segid " " and resid 1 and name HA )) (( segid " " and resid 1 and name HG11)) 3.900 1.900 1.900 peak 196 spectrum 1 weight 0.10000E+01 volume 0.76087E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 197} (( segid " " and resid 1 and name HA )) (( segid " " and resid 1 and name HG12)) 3.400 1.400 1.400 peak 197 spectrum 1 weight 0.10000E+01 volume 0.20548E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 274} (( segid " " and resid 1 and name HB )) (( segid " " and resid 1 and name HG12)) 2.900 1.100 1.100 peak 274 spectrum 1 weight 0.10000E+01 volume 0.21926E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 323} (( segid " " and resid 1 and name HG12)) (( segid " " and resid 1 and name HG11)) 1.600 0.300 0.600 peak 323 spectrum 1 weight 0.10000E+01 volume 0.10331E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 195} (( segid " " and resid 1 and name HA )) ( segid " " and resid 1 and name HG2%) 2.400 0.700 0.700 peak 195 spectrum 1 weight 0.10000E+01 volume 0.59850E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 331} ( segid " " and resid 1 and name HG2%) (( segid " " and resid 1 and name HB )) 2.000 0.500 0.500 peak 331 spectrum 1 weight 0.10000E+01 volume 0.12808E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 327} (( segid " " and resid 1 and name HG11)) ( segid " " and resid 1 and name HG2%) 3.500 1.500 1.500 peak 327 spectrum 1 weight 0.10000E+01 volume 0.18198E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 206} (( segid " " and resid 1 and name HA )) (( segid " " and resid 2 and name HA )) 3.600 1.600 1.600 peak 206 spectrum 1 weight 0.10000E+01 volume 0.15445E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 199} (( segid " " and resid 1 and name HA )) (( segid " " and resid 2 and name HB2 )) 4.100 2.100 1.900 peak 199 spectrum 1 weight 0.10000E+01 volume 0.15809E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 199} (( segid " " and resid 1 and name HA )) (( segid " " and resid 2 and name HB1 )) ASSI { 27} (( segid " " and resid 2 and name HN )) (( segid " " and resid 1 and name HA )) 1.800 0.400 0.400 peak 27 spectrum 1 weight 0.10000E+01 volume 0.17329E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 20} (( segid " " and resid 2 and name HN )) (( segid " " and resid 1 and name HB )) 2.600 0.900 0.900 peak 20 spectrum 1 weight 0.10000E+01 volume 0.42006E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 18} (( segid " " and resid 2 and name HN )) (( segid " " and resid 1 and name HG11)) 3.500 1.500 1.500 peak 18 spectrum 1 weight 0.10000E+01 volume 0.13456E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 19} (( segid " " and resid 2 and name HN )) (( segid " " and resid 1 and name HG12)) 3.900 1.900 1.900 peak 19 spectrum 1 weight 0.10000E+01 volume 0.13076E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 17} (( segid " " and resid 2 and name HN )) ( segid " " and resid 1 and name HG2%) 4.400 2.400 1.600 peak 17 spectrum 1 weight 0.10000E+01 volume 0.10753E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 67} (( segid " " and resid 3 and name HN )) (( segid " " and resid 2 and name HB1 )) 2.800 1.000 1.000 peak 67 spectrum 1 weight 0.10000E+01 volume 0.31389E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 67} (( segid " " and resid 3 and name HN )) (( segid " " and resid 2 and name HB2 )) ASSI { 315} (( segid " " and resid 3 and name HG12)) (( segid " " and resid 3 and name HA )) 3.700 1.700 1.700 peak 315 spectrum 1 weight 0.10000E+01 volume 0.99481E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 277} (( segid " " and resid 3 and name HB )) (( segid " " and resid 3 and name HG12)) 2.800 1.000 1.000 peak 277 spectrum 1 weight 0.10000E+01 volume 0.28422E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 324} (( segid " " and resid 3 and name HG12)) (( segid " " and resid 3 and name HG11)) 1.400 0.200 0.800 peak 324 spectrum 1 weight 0.10000E+01 volume 0.15131E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 78} (( segid " " and resid 3 and name HN )) (( segid " " and resid 3 and name HA )) 2.400 0.700 0.700 peak 78 spectrum 1 weight 0.10000E+01 volume 0.33170E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 65} (( segid " " and resid 3 and name HN )) (( segid " " and resid 3 and name HB )) 3.600 1.600 1.600 peak 65 spectrum 1 weight 0.10000E+01 volume 0.14180E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 68} (( segid " " and resid 3 and name HN )) (( segid " " and resid 4 and name HB2 )) 4.200 2.200 1.800 peak 68 spectrum 1 weight 0.10000E+01 volume 0.12663E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 68} (( segid " " and resid 3 and name HN )) (( segid " " and resid 4 and name HB1 )) ASSI { 41} (( segid " " and resid 4 and name HN )) (( segid " " and resid 3 and name HA )) 1.700 0.400 0.500 peak 41 spectrum 1 weight 0.10000E+01 volume 0.20636E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 57} (( segid " " and resid 4 and name HN )) (( segid " " and resid 3 and name HG11)) 3.800 1.800 1.800 peak 57 spectrum 1 weight 0.10000E+01 volume 0.10494E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 56} (( segid " " and resid 4 and name HN )) (( segid " " and resid 3 and name HG12)) 4.100 2.100 1.900 peak 56 spectrum 1 weight 0.10000E+01 volume 0.13643E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 145} (( segid " " and resid 4 and name HZ )) (( segid " " and resid 4 and name HB2 )) 4.100 2.100 1.900 peak 145 spectrum 1 weight 0.10000E+01 volume 0.11424E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 145} (( segid " " and resid 4 and name HZ )) (( segid " " and resid 4 and name HB1 )) ASSI { 92} (( segid " " and resid 5 and name HN )) (( segid " " and resid 4 and name HA )) 1.500 0.300 0.700 peak 92 spectrum 1 weight 0.10000E+01 volume 0.25536E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 86} (( segid " " and resid 5 and name HN )) (( segid " " and resid 4 and name HN )) 3.900 1.900 1.900 peak 86 spectrum 1 weight 0.10000E+01 volume 0.10081E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 250} (( segid " " and resid 5 and name HB1 )) (( segid " " and resid 5 and name HA )) 2.200 0.600 0.600 peak 250 spectrum 1 weight 0.10000E+01 volume 0.87930E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 250} (( segid " " and resid 5 and name HB2 )) (( segid " " and resid 5 and name HA )) ASSI { 91} (( segid " " and resid 5 and name HN )) (( segid " " and resid 5 and name HA )) 2.200 2.200 3.800 peak 91 spectrum 1 weight 0.10000E+01 volume 0.69193E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 94} (( segid " " and resid 5 and name HN )) (( segid " " and resid 5 and name HB2 )) 2.700 0.900 0.900 peak 94 spectrum 1 weight 0.10000E+01 volume 0.25259E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 94} (( segid " " and resid 5 and name HN )) (( segid " " and resid 5 and name HB1 )) ASSI { 26} (( segid " " and resid 6 and name HN )) (( segid " " and resid 5 and name HB1 )) 3.300 1.400 1.400 peak 26 spectrum 1 weight 0.10000E+01 volume 0.39041E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 26} (( segid " " and resid 6 and name HN )) (( segid " " and resid 5 and name HB2 )) ASSI { 252} (( segid " " and resid 6 and name HB1 )) (( segid " " and resid 6 and name HA )) 2.100 0.500 0.500 peak 252 spectrum 1 weight 0.10000E+01 volume 0.95881E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 252} (( segid " " and resid 6 and name HB2 )) (( segid " " and resid 6 and name HA )) ASSI { 23} (( segid " " and resid 6 and name HN )) (( segid " " and resid 6 and name HB2 )) 2.800 1.000 1.000 peak 23 spectrum 1 weight 0.10000E+01 volume 0.20701E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 23} (( segid " " and resid 6 and name HN )) (( segid " " and resid 6 and name HB1 )) ASSI { 110} (( segid " " and resid 7 and name HN )) (( segid " " and resid 6 and name HA )) 1.900 0.500 0.500 peak 110 spectrum 1 weight 0.10000E+01 volume 0.99159E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 122} (( segid " " and resid 8 and name HN )) (( segid " " and resid 8 and name HA )) 3.400 1.400 1.400 peak 122 spectrum 1 weight 0.10000E+01 volume 0.89717E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 150} (( segid " " and resid 10 and name HD2 )) (( segid " " and resid 10 and name HB2 )) 2.700 0.900 0.900 peak 150 spectrum 1 weight 0.10000E+01 volume 0.34891E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 150} (( segid " " and resid 10 and name HD1 )) (( segid " " and resid 10 and name HB1 )) OR { 150} (( segid " " and resid 10 and name HD2 )) (( segid " " and resid 10 and name HB1 )) OR { 150} (( segid " " and resid 10 and name HD1 )) (( segid " " and resid 10 and name HB2 )) ASSI { 74} (( segid " " and resid 10 and name HN )) (( segid " " and resid 10 and name HA )) 2.400 0.700 0.700 peak 74 spectrum 1 weight 0.10000E+01 volume 0.60380E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 70} (( segid " " and resid 10 and name HN )) (( segid " " and resid 10 and name HB2 )) 3.000 1.100 1.100 peak 70 spectrum 1 weight 0.10000E+01 volume 0.12500E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 70} (( segid " " and resid 10 and name HN )) (( segid " " and resid 10 and name HB1 )) ASSI { 136} (( segid " " and resid 11 and name HE )) (( segid " " and resid 11 and name HB1 )) 3.500 1.500 1.500 peak 136 spectrum 1 weight 0.10000E+01 volume 0.12851E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 136} (( segid " " and resid 11 and name HE )) (( segid " " and resid 11 and name HB2 )) ASSI { 135} (( segid " " and resid 11 and name HE )) (( segid " " and resid 11 and name HG2 )) 3.000 1.100 1.100 peak 135 spectrum 1 weight 0.10000E+01 volume 0.19101E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 135} (( segid " " and resid 11 and name HE )) (( segid " " and resid 11 and name HG1 )) ASSI { 314} (( segid " " and resid 11 and name HG2 )) (( segid " " and resid 11 and name HA )) 3.200 1.300 1.300 peak 314 spectrum 1 weight 0.10000E+01 volume 0.14595E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 314} (( segid " " and resid 11 and name HG1 )) (( segid " " and resid 11 and name HA )) ASSI { 64} (( segid " " and resid 12 and name HN )) (( segid " " and resid 11 and name HB1 )) 3.300 1.300 1.300 peak 64 spectrum 1 weight 0.10000E+01 volume 0.20156E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 64} (( segid " " and resid 12 and name HN )) (( segid " " and resid 11 and name HB2 )) ASSI { 62} (( segid " " and resid 12 and name HN )) (( segid " " and resid 11 and name HG2 )) 3.900 1.900 1.900 peak 62 spectrum 1 weight 0.10000E+01 volume 0.10320E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 62} (( segid " " and resid 12 and name HN )) (( segid " " and resid 11 and name HG1 )) ASSI { 131} (( segid " " and resid 13 and name HN )) (( segid " " and resid 11 and name HG1 )) 3.300 1.400 1.400 peak 131 spectrum 1 weight 0.10000E+01 volume 0.13823E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 131} (( segid " " and resid 13 and name HN )) (( segid " " and resid 11 and name HG2 )) ASSI { 124} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HA )) 2.300 0.600 0.600 peak 124 spectrum 1 weight 0.10000E+01 volume 0.65316E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 141} (( segid " " and resid 4 and name HZ )) (( segid " " and resid 14 and name HB1 )) 2.500 0.800 0.800 peak 141 spectrum 1 weight 0.10000E+01 volume 0.47308E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 141} (( segid " " and resid 4 and name HZ )) (( segid " " and resid 14 and name HB2 )) ASSI { 89} (( segid " " and resid 5 and name HN )) (( segid " " and resid 14 and name HA )) 3.600 1.700 1.700 peak 89 spectrum 1 weight 0.10000E+01 volume 0.14494E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 96} (( segid " " and resid 5 and name HN )) (( segid " " and resid 14 and name HB1 )) 4.100 2.100 1.900 peak 96 spectrum 1 weight 0.10000E+01 volume 0.85241E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 96} (( segid " " and resid 5 and name HN )) (( segid " " and resid 14 and name HB2 )) ASSI { 179} (( segid " " and resid 14 and name HA )) (( segid " " and resid 6 and name HA )) 1.700 0.400 0.500 peak 179 spectrum 1 weight 0.10000E+01 volume 0.58386E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 258} (( segid " " and resid 6 and name HB1 )) (( segid " " and resid 14 and name HA )) 3.900 1.900 1.900 peak 258 spectrum 1 weight 0.10000E+01 volume 0.19877E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 258} (( segid " " and resid 6 and name HB2 )) (( segid " " and resid 14 and name HA )) ASSI { 267} (( segid " " and resid 14 and name HB1 )) (( segid " " and resid 6 and name HA )) 3.200 1.300 1.300 peak 267 spectrum 1 weight 0.10000E+01 volume 0.13660E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 267} (( segid " " and resid 14 and name HB2 )) (( segid " " and resid 6 and name HA )) ASSI { 22} (( segid " " and resid 6 and name HN )) (( segid " " and resid 14 and name HB1 )) 4.100 2.100 1.900 peak 22 spectrum 1 weight 0.10000E+01 volume 0.85676E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 22} (( segid " " and resid 6 and name HN )) (( segid " " and resid 14 and name HB2 )) ASSI { 39} (( segid " " and resid 14 and name HN )) (( segid " " and resid 6 and name HA )) 3.700 1.700 1.700 peak 39 spectrum 1 weight 0.10000E+01 volume 0.10026E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 53} (( segid " " and resid 14 and name HN )) (( segid " " and resid 13 and name HB1 )) 2.800 1.000 1.000 peak 53 spectrum 1 weight 0.10000E+01 volume 0.44223E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 53} (( segid " " and resid 14 and name HN )) (( segid " " and resid 13 and name HB2 )) ASSI { 34} (( segid " " and resid 14 and name HN )) (( segid " " and resid 13 and name HN )) 3.800 1.800 1.800 peak 34 spectrum 1 weight 0.10000E+01 volume 0.19168E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 269} (( segid " " and resid 14 and name HB1 )) (( segid " " and resid 14 and name HA )) 2.400 0.700 0.700 peak 269 spectrum 1 weight 0.10000E+01 volume 0.49437E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 269} (( segid " " and resid 14 and name HB2 )) (( segid " " and resid 14 and name HA )) ASSI { 153} (( segid " " and resid 4 and name HZ )) (( segid " " and resid 15 and name HA2 )) 4.300 2.300 1.700 peak 153 spectrum 1 weight 0.10000E+01 volume 0.13772E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 153} (( segid " " and resid 4 and name HZ )) (( segid " " and resid 15 and name HA1 )) ASSI { 117} (( segid " " and resid 15 and name HN )) (( segid " " and resid 5 and name HN )) 2.300 0.700 0.700 peak 117 spectrum 1 weight 0.10000E+01 volume 0.45707E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 100} (( segid " " and resid 15 and name HN )) (( segid " " and resid 14 and name HB1 )) 2.900 1.100 1.100 peak 100 spectrum 1 weight 0.10000E+01 volume 0.33287E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 100} (( segid " " and resid 15 and name HN )) (( segid " " and resid 14 and name HB2 )) ASSI { 178} (( segid " " and resid 2 and name HA )) (( segid " " and resid 16 and name HB1 )) 4.400 2.400 1.600 peak 178 spectrum 1 weight 0.10000E+01 volume 0.10114E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 178} (( segid " " and resid 2 and name HA )) (( segid " " and resid 16 and name HB2 )) ASSI { 79} (( segid " " and resid 3 and name HN )) (( segid " " and resid 16 and name HA )) 3.500 1.500 1.500 peak 79 spectrum 1 weight 0.10000E+01 volume 0.13329E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 253} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 16 and name HA )) 3.300 1.300 1.300 peak 253 spectrum 1 weight 0.10000E+01 volume 0.32785E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 253} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 16 and name HA )) ASSI { 40} (( segid " " and resid 4 and name HN )) (( segid " " and resid 16 and name HA )) 3.400 1.400 1.400 peak 40 spectrum 1 weight 0.10000E+01 volume 0.90826E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 45} (( segid " " and resid 16 and name HN )) (( segid " " and resid 15 and name HA2 )) 1.900 0.400 0.400 peak 45 spectrum 1 weight 0.10000E+01 volume 0.11540E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 45} (( segid " " and resid 16 and name HN )) (( segid " " and resid 15 and name HA1 )) ASSI { 38} (( segid " " and resid 16 and name HN )) (( segid " " and resid 16 and name HA )) 2.200 0.600 0.600 peak 38 spectrum 1 weight 0.10000E+01 volume 0.48589E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 84} (( segid " " and resid 3 and name HN )) (( segid " " and resid 17 and name HN )) 2.400 0.700 0.700 peak 84 spectrum 1 weight 0.10000E+01 volume 0.39121E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 5} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HA )) 1.600 0.300 0.600 peak 5 spectrum 1 weight 0.10000E+01 volume 0.15614E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 32} (( segid " " and resid 16 and name HN )) (( segid " " and resid 17 and name HN )) 3.800 1.800 1.800 peak 32 spectrum 1 weight 0.10000E+01 volume 0.14435E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 4} (( segid " " and resid 17 and name HN )) (( segid " " and resid 17 and name HA )) 2.400 0.700 0.700 peak 4 spectrum 1 weight 0.10000E+01 volume 0.39650E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 3} (( segid " " and resid 17 and name HN )) (( segid " " and resid 18 and name HA )) 3.700 1.700 1.700 peak 3 spectrum 1 weight 0.10000E+01 volume 0.10189E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 13} (( segid " " and resid 18 and name HN )) (( segid " " and resid 17 and name HB1 )) 3.900 1.900 1.900 peak 13 spectrum 1 weight 0.10000E+01 volume 0.11434E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 13} (( segid " " and resid 18 and name HN )) (( segid " " and resid 17 and name HB2 )) ASSI { 193} (( segid " " and resid 17 and name HN )) (( segid " " and resid 18 and name HN )) 3.600 1.600 1.600 peak 193 spectrum 1 weight 0.10000E+01 volume 0.11984E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 174} (( segid " " and resid 18 and name HA )) (( segid " " and resid 19 and name HA )) 3.900 1.900 1.900 peak 174 spectrum 1 weight 0.10000E+01 volume 0.89444E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 114} (( segid " " and resid 19 and name HN )) (( segid " " and resid 18 and name HA )) 2.000 0.500 0.500 peak 114 spectrum 1 weight 0.10000E+01 volume 0.12045E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 119} (( segid " " and resid 19 and name HN )) (( segid " " and resid 18 and name HN )) 3.200 1.300 1.300 peak 119 spectrum 1 weight 0.10000E+01 volume 0.22821E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 97} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HG1 )) 3.100 1.200 1.200 peak 97 spectrum 1 weight 0.10000E+01 volume 0.16685E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 97} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HG2 )) ASSI { 350} ( segid " " and resid 3 and name HG2%) (( segid " " and resid 3 and name HA )) 3.300 1.300 1.300 peak 350 spectrum 1 weight 0.10000E+01 volume 0.88843E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 350} ( segid " " and resid 3 and name HD1%) (( segid " " and resid 3 and name HA )) ASSI { 334} ( segid " " and resid 3 and name HD1%) (( segid " " and resid 3 and name HG11)) 2.100 0.500 0.500 peak 334 spectrum 1 weight 0.10000E+01 volume 0.12618E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 334} ( segid " " and resid 3 and name HG2%) (( segid " " and resid 3 and name HG11)) ASSI { 337} ( segid " " and resid 3 and name HD1%) (( segid " " and resid 3 and name HG12)) 1.900 0.500 0.500 peak 337 spectrum 1 weight 0.10000E+01 volume 0.13387E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 337} ( segid " " and resid 3 and name HG2%) (( segid " " and resid 3 and name HG12)) ASSI { 59} (( segid " " and resid 3 and name HN )) ( segid " " and resid 3 and name HG2%) 3.100 1.200 1.200 peak 59 spectrum 1 weight 0.10000E+01 volume 0.26159E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 59} (( segid " " and resid 3 and name HN )) ( segid " " and resid 3 and name HD1%) ASSI { 248} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 3 and name HA )) 3.800 1.800 1.800 peak 248 spectrum 1 weight 0.10000E+01 volume 0.32832E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 248} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 3 and name HA )) OR { 248} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 3 and name HA )) OR { 248} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 3 and name HA )) ASSI { 239} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 3 and name HB )) 3.900 1.900 1.900 peak 239 spectrum 1 weight 0.10000E+01 volume 0.16875E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 239} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 3 and name HB )) OR { 239} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 3 and name HB )) OR { 239} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 3 and name HB )) ASSI { 237} (( segid " " and resid 4 and name HB2 )) ( segid " " and resid 3 and name HG2%) 2.200 2.200 3.800 peak 237 spectrum 1 weight 0.10000E+01 volume 0.14025E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 237} (( segid " " and resid 4 and name HB2 )) ( segid " " and resid 3 and name HG2%) OR { 237} (( segid " " and resid 4 and name HB1 )) ( segid " " and resid 3 and name HG2%) OR { 237} (( segid " " and resid 4 and name HB1 )) ( segid " " and resid 3 and name HG2%) ASSI { 238} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 3 and name HG11)) 4.000 2.000 2.000 peak 238 spectrum 1 weight 0.10000E+01 volume 0.11983E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 238} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 3 and name HG11)) OR { 238} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 3 and name HG11)) OR { 238} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 3 and name HG11)) ASSI { 58} (( segid " " and resid 4 and name HN )) ( segid " " and resid 3 and name HG2%) 4.000 2.000 2.000 peak 58 spectrum 1 weight 0.10000E+01 volume 0.26159E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 249} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 4 and name HA )) 1.900 0.400 0.400 peak 249 spectrum 1 weight 0.10000E+01 volume 0.14092E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 249} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 4 and name HA )) OR { 249} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 4 and name HA )) OR { 249} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 4 and name HA )) ASSI { 146} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HB1 )) 1.700 0.300 0.500 peak 146 spectrum 1 weight 0.10000E+01 volume 0.38430E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 146} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HB1 )) OR { 146} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HB1 )) OR { 146} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HB1 )) OR { 146} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HB2 )) OR { 146} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HB2 )) OR { 146} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HB2 )) ASSI { 144} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 4 and name HB1 )) 3.100 1.200 1.200 peak 144 spectrum 1 weight 0.10000E+01 volume 0.63406E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 144} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 4 and name HB1 )) OR { 144} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 4 and name HB1 )) OR { 144} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 4 and name HB1 )) OR { 144} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 4 and name HB2 )) OR { 144} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 4 and name HB2 )) OR { 144} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 4 and name HB2 )) ASSI { 160} ( segid " " and resid 4 and name HE% ) ( segid " " and resid 4 and name HD% ) 1.500 0.300 0.700 peak 160 spectrum 1 weight 0.10000E+01 volume 0.55496E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 160} ( segid " " and resid 4 and name HE% ) ( segid " " and resid 4 and name HD% ) OR { 160} ( segid " " and resid 4 and name HE% ) ( segid " " and resid 4 and name HD% ) OR { 160} ( segid " " and resid 4 and name HE% ) ( segid " " and resid 4 and name HD% ) ASSI { 47} (( segid " " and resid 4 and name HN )) (( segid " " and resid 4 and name HB2 )) 1.800 0.400 0.400 peak 47 spectrum 1 weight 0.10000E+01 volume 0.22014E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 47} (( segid " " and resid 4 and name HN )) (( segid " " and resid 4 and name HB2 )) OR { 47} (( segid " " and resid 4 and name HN )) (( segid " " and resid 4 and name HB1 )) OR { 47} (( segid " " and resid 4 and name HN )) (( segid " " and resid 4 and name HB1 )) ASSI { 172} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HN )) 3.800 1.800 1.800 peak 172 spectrum 1 weight 0.10000E+01 volume 0.21058E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 172} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HN )) ASSI { 162} (( segid " " and resid 4 and name HZ )) ( segid " " and resid 4 and name HE% ) 1.600 0.300 0.600 peak 162 spectrum 1 weight 0.10000E+01 volume 0.46776E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 162} (( segid " " and resid 4 and name HZ )) ( segid " " and resid 4 and name HE% ) ASSI { 95} (( segid " " and resid 5 and name HN )) (( segid " " and resid 4 and name HB1 )) 3.200 1.300 1.300 peak 95 spectrum 1 weight 0.10000E+01 volume 0.46890E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 95} (( segid " " and resid 5 and name HN )) (( segid " " and resid 4 and name HB1 )) OR { 95} (( segid " " and resid 5 and name HN )) (( segid " " and resid 4 and name HB2 )) OR { 95} (( segid " " and resid 5 and name HN )) (( segid " " and resid 4 and name HB2 )) ASSI { 167} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 5 and name HN )) 4.400 2.400 1.600 peak 167 spectrum 1 weight 0.10000E+01 volume 0.10912E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 167} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 5 and name HN )) ASSI { 204} (( segid " " and resid 7 and name HA1 )) (( segid " " and resid 6 and name HA )) 3.700 1.700 1.700 peak 204 spectrum 1 weight 0.10000E+01 volume 0.18266E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 204} (( segid " " and resid 7 and name HA1 )) (( segid " " and resid 6 and name HA )) OR { 204} (( segid " " and resid 7 and name HA2 )) (( segid " " and resid 6 and name HA )) OR { 204} (( segid " " and resid 7 and name HA2 )) (( segid " " and resid 6 and name HA )) ASSI { 205} (( segid " " and resid 7 and name HA1 )) (( segid " " and resid 8 and name HA )) 3.500 1.500 1.500 peak 205 spectrum 1 weight 0.10000E+01 volume 0.14327E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 205} (( segid " " and resid 7 and name HA1 )) (( segid " " and resid 8 and name HA )) OR { 205} (( segid " " and resid 7 and name HA2 )) (( segid " " and resid 8 and name HA )) OR { 205} (( segid " " and resid 7 and name HA2 )) (( segid " " and resid 8 and name HA )) ASSI { 295} (( segid " " and resid 11 and name HB1 )) (( segid " " and resid 11 and name HD1 )) 2.800 1.000 1.000 peak 295 spectrum 1 weight 0.10000E+01 volume 0.30652E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 295} (( segid " " and resid 11 and name HB1 )) (( segid " " and resid 11 and name HD1 )) OR { 295} (( segid " " and resid 11 and name HB1 )) (( segid " " and resid 11 and name HD2 )) OR { 295} (( segid " " and resid 11 and name HB1 )) (( segid " " and resid 11 and name HD2 )) OR { 295} (( segid " " and resid 11 and name HB2 )) (( segid " " and resid 11 and name HD1 )) OR { 295} (( segid " " and resid 11 and name HB2 )) (( segid " " and resid 11 and name HD1 )) OR { 295} (( segid " " and resid 11 and name HB2 )) (( segid " " and resid 11 and name HD2 )) ASSI { 147} (( segid " " and resid 11 and name HE )) (( segid " " and resid 11 and name HD1 )) 2.300 0.600 0.600 peak 147 spectrum 1 weight 0.10000E+01 volume 0.62560E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 147} (( segid " " and resid 11 and name HE )) (( segid " " and resid 11 and name HD1 )) OR { 147} (( segid " " and resid 11 and name HE )) (( segid " " and resid 11 and name HD2 )) OR { 147} (( segid " " and resid 11 and name HE )) (( segid " " and resid 11 and name HD2 )) ASSI { 234} (( segid " " and resid 11 and name HD2 )) (( segid " " and resid 11 and name HG1 )) 2.500 0.800 0.800 peak 234 spectrum 1 weight 0.10000E+01 volume 0.35097E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 234} (( segid " " and resid 11 and name HD2 )) (( segid " " and resid 11 and name HG1 )) OR { 234} (( segid " " and resid 11 and name HD1 )) (( segid " " and resid 11 and name HG2 )) OR { 234} (( segid " " and resid 11 and name HD1 )) (( segid " " and resid 11 and name HG2 )) OR { 234} (( segid " " and resid 11 and name HD2 )) (( segid " " and resid 11 and name HG2 )) OR { 234} (( segid " " and resid 11 and name HD1 )) (( segid " " and resid 11 and name HG1 )) OR { 234} (( segid " " and resid 11 and name HD1 )) (( segid " " and resid 11 and name HG1 )) ASSI { 73} (( segid " " and resid 12 and name HN )) (( segid " " and resid 12 and name HB2 )) 2.500 0.800 0.800 peak 73 spectrum 1 weight 0.10000E+01 volume 0.47289E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 73} (( segid " " and resid 12 and name HN )) (( segid " " and resid 12 and name HB2 )) OR { 73} (( segid " " and resid 12 and name HN )) (( segid " " and resid 12 and name HB1 )) OR { 73} (( segid " " and resid 12 and name HN )) (( segid " " and resid 12 and name HB1 )) ASSI { 126} (( segid " " and resid 13 and name HN )) (( segid " " and resid 7 and name HA2 )) 3.600 1.700 1.700 peak 126 spectrum 1 weight 0.10000E+01 volume 0.11632E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 126} (( segid " " and resid 13 and name HN )) (( segid " " and resid 7 and name HA2 )) OR { 126} (( segid " " and resid 13 and name HN )) (( segid " " and resid 7 and name HA1 )) OR { 126} (( segid " " and resid 13 and name HN )) (( segid " " and resid 7 and name HA1 )) ASSI { 128} (( segid " " and resid 13 and name HN )) (( segid " " and resid 12 and name HB2 )) 2.600 0.900 0.900 peak 128 spectrum 1 weight 0.10000E+01 volume 0.38166E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 128} (( segid " " and resid 13 and name HN )) (( segid " " and resid 12 and name HB2 )) OR { 128} (( segid " " and resid 13 and name HN )) (( segid " " and resid 12 and name HB1 )) OR { 128} (( segid " " and resid 13 and name HN )) (( segid " " and resid 12 and name HB1 )) ASSI { 294} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HA )) 2.600 0.800 0.800 peak 294 spectrum 1 weight 0.10000E+01 volume 0.34874E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 294} (( segid " " and resid 13 and name HG2 )) (( segid " " and resid 13 and name HA )) OR { 294} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HA )) ASSI { 281} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HG1 )) 1.800 0.400 0.400 peak 281 spectrum 1 weight 0.10000E+01 volume 0.29962E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 281} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HG2 )) OR { 281} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HG1 )) OR { 281} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HG2 )) ASSI { 185} (( segid " " and resid 13 and name HA )) (( segid " " and resid 13 and name HG2 )) 3.100 1.200 1.200 peak 185 spectrum 1 weight 0.10000E+01 volume 0.14854E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 185} (( segid " " and resid 13 and name HA )) (( segid " " and resid 13 and name HG1 )) OR { 185} (( segid " " and resid 13 and name HA )) (( segid " " and resid 13 and name HD2 )) ASSI { 304} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HG1 )) 2.400 0.700 0.700 peak 304 spectrum 1 weight 0.10000E+01 volume 0.49582E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 304} (( segid " " and resid 13 and name HG2 )) (( segid " " and resid 13 and name HD1 )) OR { 304} (( segid " " and resid 13 and name HG1 )) (( segid " " and resid 13 and name HD2 )) OR { 304} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HG2 )) OR { 304} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HG1 )) OR { 304} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HG2 )) OR { 304} (( segid " " and resid 13 and name HG2 )) (( segid " " and resid 13 and name HD2 )) OR { 304} (( segid " " and resid 13 and name HG1 )) (( segid " " and resid 13 and name HD1 )) OR { 304} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HD2 )) ASSI { 319} (( segid " " and resid 13 and name HG1 )) (( segid " " and resid 13 and name HB2 )) 2.300 0.600 0.600 peak 319 spectrum 1 weight 0.10000E+01 volume 0.75078E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 319} (( segid " " and resid 13 and name HG2 )) (( segid " " and resid 13 and name HB1 )) OR { 319} (( segid " " and resid 13 and name HG1 )) (( segid " " and resid 13 and name HB1 )) OR { 319} (( segid " " and resid 13 and name HG2 )) (( segid " " and resid 13 and name HB2 )) OR { 319} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HB1 )) OR { 319} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HB2 )) ASSI { 305} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HG2 )) 1.900 0.400 0.400 peak 305 spectrum 1 weight 0.10000E+01 volume 0.22957E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 305} (( segid " " and resid 13 and name HE1 )) (( segid " " and resid 13 and name HD2 )) OR { 305} (( segid " " and resid 13 and name HE1 )) (( segid " " and resid 13 and name HD2 )) OR { 305} (( segid " " and resid 13 and name HE2 )) (( segid " " and resid 13 and name HD2 )) OR { 305} (( segid " " and resid 13 and name HE2 )) (( segid " " and resid 13 and name HD2 )) OR { 305} (( segid " " and resid 13 and name HE1 )) (( segid " " and resid 13 and name HD1 )) OR { 305} (( segid " " and resid 13 and name HE1 )) (( segid " " and resid 13 and name HD1 )) OR { 305} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HG1 )) OR { 305} (( segid " " and resid 13 and name HE2 )) (( segid " " and resid 13 and name HD1 )) OR { 305} (( segid " " and resid 13 and name HE2 )) (( segid " " and resid 13 and name HD1 )) OR { 305} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HG2 )) OR { 305} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HG1 )) OR { 305} (( segid " " and resid 13 and name HE2 )) (( segid " " and resid 13 and name HG1 )) OR { 305} (( segid " " and resid 13 and name HE2 )) (( segid " " and resid 13 and name HG1 )) ASSI { 130} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HB2 )) 2.300 0.700 0.700 peak 130 spectrum 1 weight 0.10000E+01 volume 0.63346E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 130} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HG1 )) OR { 130} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HG2 )) OR { 130} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HB1 )) ASSI { 129} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HB2 )) 2.600 0.800 0.800 peak 129 spectrum 1 weight 0.10000E+01 volume 0.36116E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 129} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HB1 )) ASSI { 133} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HG1 )) 2.600 0.900 0.900 peak 133 spectrum 1 weight 0.10000E+01 volume 0.34965E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 133} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HG2 )) OR { 133} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HD1 )) ASSI { 142} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 14 and name HB1 )) 3.200 1.300 1.300 peak 142 spectrum 1 weight 0.10000E+01 volume 0.18303E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 142} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 14 and name HB1 )) OR { 142} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 14 and name HB2 )) OR { 142} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 14 and name HB2 )) ASSI { 140} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 14 and name HB1 )) 2.600 0.800 0.800 peak 140 spectrum 1 weight 0.10000E+01 volume 0.50860E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 140} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 14 and name HB1 )) OR { 140} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 14 and name HB2 )) OR { 140} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 14 and name HB2 )) ASSI { 55} (( segid " " and resid 14 and name HN )) (( segid " " and resid 13 and name HG2 )) 3.900 1.900 1.900 peak 55 spectrum 1 weight 0.10000E+01 volume 0.11413E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 55} (( segid " " and resid 14 and name HN )) (( segid " " and resid 13 and name HG1 )) ASSI { 154} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 15 and name HA2 )) 3.000 1.100 1.100 peak 154 spectrum 1 weight 0.10000E+01 volume 0.35214E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 154} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 15 and name HA2 )) OR { 154} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 15 and name HA1 )) OR { 154} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 15 and name HA1 )) ASSI { 166} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 15 and name HN )) 3.300 1.400 1.400 peak 166 spectrum 1 weight 0.10000E+01 volume 0.12139E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 166} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 15 and name HN )) ASSI { 165} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 15 and name HN )) 3.600 1.600 1.600 peak 165 spectrum 1 weight 0.10000E+01 volume 0.12057E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 165} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 15 and name HN )) ASSI { 283} ( segid " " and resid 16 and name HE% ) (( segid " " and resid 4 and name HB2 )) 1.700 1.700 4.300 peak 283 spectrum 1 weight 0.10000E+01 volume 0.78189E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 283} ( segid " " and resid 16 and name HE% ) (( segid " " and resid 4 and name HB2 )) OR { 283} ( segid " " and resid 16 and name HE% ) (( segid " " and resid 4 and name HB1 )) ASSI { 138} ( segid " " and resid 4 and name HD% ) ( segid " " and resid 16 and name HE% ) 4.000 2.000 2.000 peak 138 spectrum 1 weight 0.10000E+01 volume 0.11563E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 138} ( segid " " and resid 4 and name HD% ) ( segid " " and resid 16 and name HE% ) ASSI { 143} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 16 and name HG2 )) 3.100 1.200 1.200 peak 143 spectrum 1 weight 0.10000E+01 volume 0.25512E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 143} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 16 and name HG2 )) OR { 143} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 16 and name HG2 )) OR { 143} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 16 and name HG2 )) OR { 143} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 16 and name HG1 )) OR { 143} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 16 and name HG1 )) OR { 143} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 16 and name HG1 )) ASSI { 139} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 16 and name HG2 )) 4.100 2.100 1.900 peak 139 spectrum 1 weight 0.10000E+01 volume 0.98672E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 139} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 16 and name HG2 )) OR { 139} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 16 and name HG2 )) OR { 139} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 16 and name HG2 )) OR { 139} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 16 and name HG1 )) OR { 139} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 16 and name HG1 )) OR { 139} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 16 and name HG1 )) ASSI { 170} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 16 and name HN )) 3.100 1.200 1.200 peak 170 spectrum 1 weight 0.10000E+01 volume 0.17391E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 170} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 16 and name HN )) ASSI { 298} (( segid " " and resid 16 and name HB1 )) ( segid " " and resid 16 and name HE% ) 2.000 0.500 0.500 peak 298 spectrum 1 weight 0.10000E+01 volume 0.16281E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 298} (( segid " " and resid 16 and name HB2 )) ( segid " " and resid 16 and name HE% ) ASSI { 268} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 16 and name HA )) 2.600 0.900 0.900 peak 268 spectrum 1 weight 0.10000E+01 volume 0.31355E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 268} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 16 and name HA )) OR { 268} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 16 and name HA )) OR { 268} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 16 and name HA )) ASSI { 263} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 16 and name HB2 )) 2.100 0.600 0.600 peak 263 spectrum 1 weight 0.10000E+01 volume 0.10508E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 263} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 16 and name HB2 )) OR { 263} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 16 and name HB1 )) OR { 263} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 16 and name HB1 )) OR { 263} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 16 and name HB1 )) OR { 263} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 16 and name HB1 )) OR { 263} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 16 and name HB2 )) OR { 263} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 16 and name HB2 )) OR { 263} (( segid " " and resid 16 and name HG1 )) ( segid " " and resid 16 and name HE% ) OR { 263} (( segid " " and resid 16 and name HG1 )) ( segid " " and resid 16 and name HE% ) ASSI { 282} ( segid " " and resid 16 and name HE% ) (( segid " " and resid 16 and name HG1 )) 2.200 0.600 0.600 peak 282 spectrum 1 weight 0.10000E+01 volume 0.18114E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 282} ( segid " " and resid 16 and name HE% ) (( segid " " and resid 16 and name HG1 )) OR { 282} ( segid " " and resid 16 and name HE% ) (( segid " " and resid 16 and name HG2 )) OR { 282} ( segid " " and resid 16 and name HE% ) (( segid " " and resid 16 and name HG2 )) ASSI { 50} (( segid " " and resid 16 and name HN )) (( segid " " and resid 16 and name HB2 )) 2.100 0.600 0.600 peak 50 spectrum 1 weight 0.10000E+01 volume 0.11942E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 50} (( segid " " and resid 16 and name HN )) (( segid " " and resid 16 and name HB1 )) OR { 50} (( segid " " and resid 16 and name HN )) ( segid " " and resid 16 and name HE% ) ASSI { 49} (( segid " " and resid 16 and name HN )) (( segid " " and resid 16 and name HG2 )) 2.000 0.500 0.500 peak 49 spectrum 1 weight 0.10000E+01 volume 0.99293E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 49} (( segid " " and resid 16 and name HN )) (( segid " " and resid 16 and name HG2 )) OR { 49} (( segid " " and resid 16 and name HN )) (( segid " " and resid 16 and name HG1 )) OR { 49} (( segid " " and resid 16 and name HN )) (( segid " " and resid 16 and name HG1 )) ASSI { 8} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HG2 )) 3.700 1.700 1.700 peak 8 spectrum 1 weight 0.10000E+01 volume 0.17658E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 8} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HG2 )) OR { 8} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HG1 )) OR { 8} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HG1 )) ASSI { 80} (( segid " " and resid 3 and name HN )) (( segid " " and resid 2 and name HA )) 1.700 0.400 0.500 peak 80 spectrum 1 weight 0.10000E+01 volume 0.16093E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 256} (( segid " " and resid 18 and name HB2 )) (( segid " " and resid 17 and name HA )) 4.000 2.000 2.000 peak 256 spectrum 1 weight 0.10000E+01 volume 0.24379E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 256} (( segid " " and resid 18 and name HB2 )) (( segid " " and resid 17 and name HA )) OR { 256} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 17 and name HA )) OR { 256} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 17 and name HA )) ASSI { 259} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 18 and name HA )) 2.000 0.500 0.500 peak 259 spectrum 1 weight 0.10000E+01 volume 0.17156E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 259} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 18 and name HA )) OR { 259} (( segid " " and resid 18 and name HB2 )) (( segid " " and resid 18 and name HA )) OR { 259} (( segid " " and resid 18 and name HB2 )) (( segid " " and resid 18 and name HA )) ASSI { 12} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HB2 )) 2.200 0.600 0.600 peak 12 spectrum 1 weight 0.10000E+01 volume 0.96571E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 12} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HB2 )) OR { 12} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HB1 )) OR { 12} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HB1 )) ASSI { 102} (( segid " " and resid 19 and name HN )) (( segid " " and resid 18 and name HB1 )) 2.900 1.000 1.000 peak 102 spectrum 1 weight 0.10000E+01 volume 0.41275E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 102} (( segid " " and resid 19 and name HN )) (( segid " " and resid 18 and name HB1 )) OR { 102} (( segid " " and resid 19 and name HN )) (( segid " " and resid 18 and name HB2 )) OR { 102} (( segid " " and resid 19 and name HN )) (( segid " " and resid 18 and name HB2 )) ASSI { 289} (( segid " " and resid 19 and name HB1 )) (( segid " " and resid 19 and name HA )) 2.500 0.800 0.800 peak 289 spectrum 1 weight 0.10000E+01 volume 0.34638E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 289} (( segid " " and resid 19 and name HB1 )) (( segid " " and resid 19 and name HA )) OR { 289} (( segid " " and resid 19 and name HB2 )) (( segid " " and resid 19 and name HA )) OR { 289} (( segid " " and resid 19 and name HB2 )) (( segid " " and resid 19 and name HA )) ASSI { 99} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HB2 )) 2.900 1.100 1.100 peak 99 spectrum 1 weight 0.10000E+01 volume 0.18863E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 99} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HB2 )) OR { 99} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HB1 )) OR { 99} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HB1 )) ASSI { 98} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HD2 )) 2.800 1.000 1.000 peak 98 spectrum 1 weight 0.10000E+01 volume 0.26003E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 98} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HD2 )) OR { 98} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HD1 )) OR { 98} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HD1 )) ASSI { 101} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HE2 )) 3.100 1.200 1.200 peak 101 spectrum 1 weight 0.10000E+01 volume 0.15860E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 101} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HE2 )) OR { 101} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HE1 )) OR { 101} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HE1 )) ASSI { 329} ( segid " " and resid 20 and name HG2%) (( segid " " and resid 20 and name HB )) 2.500 0.800 0.800 peak 329 spectrum 1 weight 0.10000E+01 volume 0.49017E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 329} ( segid " " and resid 20 and name HG2%) (( segid " " and resid 20 and name HA )) ASSI { 107} (( segid " " and resid 20 and name HN )) (( segid " " and resid 20 and name HA )) 2.600 0.800 0.800 peak 107 spectrum 1 weight 0.10000E+01 volume 0.42346E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 107} (( segid " " and resid 20 and name HN )) (( segid " " and resid 20 and name HB )) ASSI { 308} (( segid " " and resid 1 and name HG12)) ( segid " " and resid 1 and name HD1%) 2.300 0.600 0.600 peak 308 spectrum 1 weight 0.10000E+01 volume 0.63650E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 291} (( segid " " and resid 3 and name HB )) (( segid " " and resid 3 and name HA )) 2.000 0.500 0.500 peak 291 spectrum 1 weight 0.10000E+01 volume 0.72946E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 60} (( segid " " and resid 3 and name HN )) (( segid " " and resid 3 and name HG11)) 2.600 0.900 0.900 peak 60 spectrum 1 weight 0.10000E+01 volume 0.26922E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 61} (( segid " " and resid 3 and name HN )) (( segid " " and resid 3 and name HG12)) 1.900 0.400 0.400 peak 61 spectrum 1 weight 0.10000E+01 volume 0.19527E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 52} (( segid " " and resid 4 and name HN )) (( segid " " and resid 3 and name HB )) 2.800 1.000 1.000 peak 52 spectrum 1 weight 0.10000E+01 volume 0.72930E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 108} (( segid " " and resid 7 and name HN )) (( segid " " and resid 12 and name HA )) 4.300 2.300 1.700 peak 108 spectrum 1 weight 0.10000E+01 volume 0.12239E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 189} (( segid " " and resid 12 and name HA )) (( segid " " and resid 11 and name HA )) 4.300 2.300 1.700 peak 189 spectrum 1 weight 0.10000E+01 volume 0.88347E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 77} (( segid " " and resid 12 and name HN )) (( segid " " and resid 11 and name HA )) 1.900 0.400 0.400 peak 77 spectrum 1 weight 0.10000E+01 volume 0.63597E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 125} (( segid " " and resid 13 and name HN )) (( segid " " and resid 12 and name HA )) 2.600 0.900 0.900 peak 125 spectrum 1 weight 0.10000E+01 volume 0.43546E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 121} (( segid " " and resid 13 and name HN )) (( segid " " and resid 12 and name HN )) 2.100 0.500 0.500 peak 121 spectrum 1 weight 0.10000E+01 volume 0.52192E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 43} (( segid " " and resid 14 and name HN )) (( segid " " and resid 13 and name HA )) 1.700 0.300 0.500 peak 43 spectrum 1 weight 0.10000E+01 volume 0.14307E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 113} (( segid " " and resid 15 and name HN )) (( segid " " and resid 14 and name HA )) 1.700 0.300 0.500 peak 113 spectrum 1 weight 0.10000E+01 volume 0.97629E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 104} (( segid " " and resid 15 and name HN )) (( segid " " and resid 15 and name HA1 )) 2.400 0.700 0.700 peak 104 spectrum 1 weight 0.10000E+01 volume 0.31288E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 104} (( segid " " and resid 15 and name HN )) (( segid " " and resid 15 and name HA2 )) ASSI { 352} (( segid " " and resid 17 and name HN )) (( segid " " and resid 4 and name HA )) 2.400 0.700 0.700 peak 352 spectrum 1 weight 0.10000E+01 volume 0.24969E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 14} (( segid " " and resid 18 and name HN )) (( segid " " and resid 17 and name HA )) 1.700 0.300 0.500 peak 14 spectrum 1 weight 0.10000E+01 volume 0.18478E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 340} ( segid " " and resid 3 and name HG2%) (( segid " " and resid 3 and name HB )) 2.100 0.500 0.500 peak 340 spectrum 1 weight 0.10000E+01 volume 0.10610E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 340} ( segid " " and resid 3 and name HD1%) (( segid " " and resid 3 and name HB )) ASSI { 58} (( segid " " and resid 4 and name HN )) ( segid " " and resid 3 and name HG2%) 4.500 2.500 1.500 peak 58 spectrum 1 weight 0.10000E+01 volume 0.24377E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 58} (( segid " " and resid 4 and name HN )) ( segid " " and resid 3 and name HD1%) ASSI { 212} (( segid " " and resid 5 and name HB1 )) ( segid " " and resid 3 and name HD1%) 4.100 2.100 1.900 peak 212 spectrum 1 weight 0.10000E+01 volume 0.13248E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 212} (( segid " " and resid 5 and name HB2 )) ( segid " " and resid 3 and name HD1%) ASSI { 105} (( segid " " and resid 7 and name HN )) (( segid " " and resid 7 and name HA2 )) 1.900 0.400 0.400 peak 105 spectrum 1 weight 0.10000E+01 volume 0.13431E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 105} (( segid " " and resid 7 and name HN )) (( segid " " and resid 7 and name HA2 )) OR { 105} (( segid " " and resid 7 and name HN )) (( segid " " and resid 7 and name HA1 )) OR { 105} (( segid " " and resid 7 and name HN )) (( segid " " and resid 7 and name HA1 )) ASSI { 190} (( segid " " and resid 12 and name HA )) (( segid " " and resid 7 and name HA2 )) 2.000 0.500 0.500 peak 190 spectrum 1 weight 0.10000E+01 volume 0.87447E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 190} (( segid " " and resid 12 and name HA )) (( segid " " and resid 7 and name HA2 )) OR { 190} (( segid " " and resid 12 and name HA )) (( segid " " and resid 7 and name HA1 )) OR { 190} (( segid " " and resid 12 and name HA )) (( segid " " and resid 7 and name HA1 )) ASSI { 294} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HA )) 2.500 0.800 0.800 peak 294 spectrum 1 weight 0.10000E+01 volume 0.32499E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 294} (( segid " " and resid 13 and name HG2 )) (( segid " " and resid 13 and name HA )) OR { 294} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HA )) OR { 294} (( segid " " and resid 13 and name HG1 )) (( segid " " and resid 13 and name HA )) ASSI { 185} (( segid " " and resid 13 and name HA )) (( segid " " and resid 13 and name HG2 )) 3.300 1.400 1.400 peak 185 spectrum 1 weight 0.10000E+01 volume 0.13843E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 185} (( segid " " and resid 13 and name HA )) (( segid " " and resid 13 and name HG1 )) OR { 185} (( segid " " and resid 13 and name HA )) (( segid " " and resid 13 and name HD1 )) OR { 185} (( segid " " and resid 13 and name HA )) (( segid " " and resid 13 and name HD2 )) ASSI { 304} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HG1 )) 2.400 0.700 0.700 peak 304 spectrum 1 weight 0.10000E+01 volume 0.46205E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 304} (( segid " " and resid 13 and name HG2 )) (( segid " " and resid 13 and name HD1 )) OR { 304} (( segid " " and resid 13 and name HG1 )) (( segid " " and resid 13 and name HD2 )) OR { 304} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HG2 )) OR { 304} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HG1 )) OR { 304} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HG2 )) OR { 304} (( segid " " and resid 13 and name HG2 )) (( segid " " and resid 13 and name HD2 )) OR { 304} (( segid " " and resid 13 and name HG1 )) (( segid " " and resid 13 and name HD1 )) OR { 304} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HD2 )) OR { 304} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HD2 )) ASSI { 278} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HG1 )) 2.400 0.700 0.700 peak 278 spectrum 1 weight 0.10000E+01 volume 0.56742E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 278} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HG2 )) OR { 278} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HG1 )) OR { 278} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HG2 )) OR { 278} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HD2 )) OR { 278} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HD1 )) OR { 278} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HD2 )) ASSI { 305} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HG2 )) 1.900 0.500 0.500 peak 305 spectrum 1 weight 0.10000E+01 volume 0.21393E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 305} (( segid " " and resid 13 and name HE1 )) (( segid " " and resid 13 and name HD2 )) OR { 305} (( segid " " and resid 13 and name HE1 )) (( segid " " and resid 13 and name HD2 )) OR { 305} (( segid " " and resid 13 and name HE2 )) (( segid " " and resid 13 and name HD2 )) OR { 305} (( segid " " and resid 13 and name HE2 )) (( segid " " and resid 13 and name HD2 )) OR { 305} (( segid " " and resid 13 and name HE1 )) (( segid " " and resid 13 and name HD1 )) OR { 305} (( segid " " and resid 13 and name HE1 )) (( segid " " and resid 13 and name HD1 )) OR { 305} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HG1 )) OR { 305} (( segid " " and resid 13 and name HE2 )) (( segid " " and resid 13 and name HD1 )) OR { 305} (( segid " " and resid 13 and name HE2 )) (( segid " " and resid 13 and name HD1 )) OR { 305} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HG2 )) OR { 305} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HG1 )) OR { 305} (( segid " " and resid 13 and name HE2 )) (( segid " " and resid 13 and name HG1 )) OR { 305} (( segid " " and resid 13 and name HE2 )) (( segid " " and resid 13 and name HG1 )) OR { 305} (( segid " " and resid 13 and name HE1 )) (( segid " " and resid 13 and name HG1 )) OR { 305} (( segid " " and resid 13 and name HE1 )) (( segid " " and resid 13 and name HG1 )) ASSI { 133} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HG1 )) 2.700 0.900 0.900 peak 133 spectrum 1 weight 0.10000E+01 volume 0.32583E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 133} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HG2 )) OR { 133} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HD1 )) OR { 133} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HD2 )) ASSI { 152} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 15 and name HA2 )) 2.300 0.600 0.600 peak 152 spectrum 1 weight 0.10000E+01 volume 0.50168E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 152} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 15 and name HA2 )) OR { 152} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 15 and name HA1 )) OR { 152} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 15 and name HA1 )) ASSI { 240} (( segid " " and resid 4 and name HB2 )) ( segid " " and resid 16 and name HE% ) 4.600 2.600 1.400 peak 240 spectrum 1 weight 0.10000E+01 volume 0.22454E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 240} (( segid " " and resid 4 and name HB2 )) ( segid " " and resid 16 and name HE% ) OR { 240} (( segid " " and resid 4 and name HB1 )) ( segid " " and resid 16 and name HE% ) OR { 240} (( segid " " and resid 4 and name HB1 )) ( segid " " and resid 16 and name HE% ) ASSI { 169} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 16 and name HN )) 2.300 0.700 0.700 peak 169 spectrum 1 weight 0.10000E+01 volume 0.17675E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 169} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 16 and name HN )) ASSI { 261} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 16 and name HB2 )) 2.000 0.500 0.500 peak 261 spectrum 1 weight 0.10000E+01 volume 0.90084E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 261} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 16 and name HB2 )) OR { 261} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 16 and name HB1 )) OR { 261} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 16 and name HB1 )) OR { 261} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 16 and name HB1 )) OR { 261} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 16 and name HB2 )) OR { 261} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 16 and name HB2 )) ASSI { 263} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 16 and name HB2 )) 2.200 0.600 0.600 peak 263 spectrum 1 weight 0.10000E+01 volume 0.97921E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 263} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 16 and name HB2 )) OR { 263} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 16 and name HB1 )) OR { 263} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 16 and name HB2 )) OR { 263} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 16 and name HB2 )) OR { 263} (( segid " " and resid 16 and name HG1 )) ( segid " " and resid 16 and name HE% ) OR { 263} (( segid " " and resid 16 and name HG1 )) ( segid " " and resid 16 and name HE% ) OR { 263} (( segid " " and resid 16 and name HG2 )) ( segid " " and resid 16 and name HE% ) OR { 263} (( segid " " and resid 16 and name HG2 )) ( segid " " and resid 16 and name HE% ) ASSI { 242} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 19 and name HE2 )) 2.200 0.600 0.600 peak 242 spectrum 1 weight 0.10000E+01 volume 0.31688E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 242} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 19 and name HE2 )) OR { 242} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 19 and name HE2 )) OR { 242} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 19 and name HE2 )) OR { 242} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 19 and name HE1 )) OR { 242} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 19 and name HE1 )) OR { 242} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 19 and name HE1 )) OR { 242} (( segid " " and resid 18 and name HB1 )) (( segid " " and resid 19 and name HE1 )) OR { 242} (( segid " " and resid 18 and name HB2 )) (( segid " " and resid 19 and name HE2 )) OR { 242} (( segid " " and resid 18 and name HB2 )) (( segid " " and resid 19 and name HE2 )) OR { 242} (( segid " " and resid 18 and name HB2 )) (( segid " " and resid 19 and name HE2 )) OR { 242} (( segid " " and resid 18 and name HB2 )) (( segid " " and resid 19 and name HE2 )) OR { 242} (( segid " " and resid 18 and name HB2 )) (( segid " " and resid 19 and name HE1 )) ASSI { 177} (( segid " " and resid 2 and name HA )) (( segid " " and resid 2 and name HB1 )) 1.900 0.400 0.400 peak 177 spectrum 1 weight 0.10000E+01 volume 0.48243E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 177} (( segid " " and resid 2 and name HA )) (( segid " " and resid 2 and name HB2 )) ASSI { 25} (( segid " " and resid 2 and name HN )) (( segid " " and resid 2 and name HB2 )) 2.300 0.600 0.600 peak 25 spectrum 1 weight 0.10000E+01 volume 0.24718E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 25} (( segid " " and resid 2 and name HN )) (( segid " " and resid 2 and name HB1 )) ASSI { 30} (( segid " " and resid 6 and name HN )) (( segid " " and resid 5 and name HA )) 1.900 0.400 0.400 peak 30 spectrum 1 weight 0.10000E+01 volume 0.65745E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 288} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HA )) 2.400 0.700 0.700 peak 288 spectrum 1 weight 0.10000E+01 volume 0.26838E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 288} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HA )) ASSI { 112} (( segid " " and resid 7 and name HN )) (( segid " " and resid 14 and name HA )) 2.500 0.800 0.800 peak 112 spectrum 1 weight 0.10000E+01 volume 0.15352E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 46} (( segid " " and resid 14 and name HN )) (( segid " " and resid 14 and name HB2 )) 2.200 0.600 0.600 peak 46 spectrum 1 weight 0.10000E+01 volume 0.50518E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 46} (( segid " " and resid 14 and name HN )) (( segid " " and resid 14 and name HB1 )) ASSI { 111} (( segid " " and resid 15 and name HN )) (( segid " " and resid 6 and name HA )) 2.700 0.900 0.900 peak 111 spectrum 1 weight 0.10000E+01 volume 0.22181E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 90} (( segid " " and resid 5 and name HN )) (( segid " " and resid 16 and name HA )) 2.200 0.600 0.600 peak 90 spectrum 1 weight 0.10000E+01 volume 0.27593E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 293} (( segid " " and resid 16 and name HB1 )) (( segid " " and resid 16 and name HA )) 2.100 0.500 0.500 peak 293 spectrum 1 weight 0.10000E+01 volume 0.23098E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 293} (( segid " " and resid 16 and name HB2 )) (( segid " " and resid 16 and name HA )) ASSI { 292} ( segid " " and resid 16 and name HE% ) (( segid " " and resid 16 and name HA )) 3.600 1.600 1.600 peak 292 spectrum 1 weight 0.10000E+01 volume 0.31634E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 85} (( segid " " and resid 5 and name HN )) (( segid " " and resid 17 and name HN )) 3.000 1.100 1.100 peak 85 spectrum 1 weight 0.10000E+01 volume 0.77079E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 11} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HB1 )) 3.000 1.100 1.100 peak 11 spectrum 1 weight 0.10000E+01 volume 0.14694E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 11} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HB2 )) ASSI { 255} (( segid " " and resid 17 and name HB1 )) (( segid " " and resid 17 and name HA )) 2.200 0.600 0.600 peak 255 spectrum 1 weight 0.10000E+01 volume 0.44701E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 255} (( segid " " and resid 17 and name HB2 )) (( segid " " and resid 17 and name HA )) ASSI { 7} (( segid " " and resid 17 and name HN )) (( segid " " and resid 17 and name HB2 )) 2.200 0.600 0.600 peak 7 spectrum 1 weight 0.10000E+01 volume 0.37762E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 7} (( segid " " and resid 17 and name HN )) (( segid " " and resid 17 and name HB1 )) ASSI { 88} (( segid " " and resid 5 and name HN )) ( segid " " and resid 4 and name HD% ) 3.100 1.200 1.200 peak 88 spectrum 1 weight 0.10000E+01 volume 0.20572E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 88} (( segid " " and resid 5 and name HN )) ( segid " " and resid 4 and name HD% ) ASSI { 302} (( segid " " and resid 11 and name HB2 )) (( segid " " and resid 11 and name HG1 )) 2.100 0.500 0.500 peak 302 spectrum 1 weight 0.10000E+01 volume 0.66768E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 302} (( segid " " and resid 11 and name HB1 )) (( segid " " and resid 11 and name HG2 )) OR { 302} (( segid " " and resid 11 and name HB1 )) (( segid " " and resid 11 and name HG1 )) OR { 302} (( segid " " and resid 11 and name HB2 )) (( segid " " and resid 11 and name HG2 )) ASSI { 321} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HG2 )) 2.400 0.700 0.700 peak 321 spectrum 1 weight 0.10000E+01 volume 0.43533E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 321} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HG1 )) OR { 321} (( segid " " and resid 13 and name HG2 )) (( segid " " and resid 13 and name HB1 )) OR { 321} (( segid " " and resid 13 and name HG1 )) (( segid " " and resid 13 and name HB1 )) OR { 321} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HG2 )) OR { 321} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HG1 )) OR { 321} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HB1 )) OR { 321} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HB1 )) OR { 321} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HB2 )) OR { 321} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HB2 )) ASSI { 278} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HG2 )) 2.400 0.700 0.700 peak 278 spectrum 1 weight 0.10000E+01 volume 0.46436E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 278} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HG1 )) OR { 278} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HG2 )) OR { 278} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HD2 )) OR { 278} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HD1 )) OR { 278} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HD2 )) OR { 278} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HD1 )) ASSI { 319} (( segid " " and resid 13 and name HG1 )) (( segid " " and resid 13 and name HB2 )) 2.300 0.700 0.700 peak 319 spectrum 1 weight 0.10000E+01 volume 0.57258E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 319} (( segid " " and resid 13 and name HG2 )) (( segid " " and resid 13 and name HB1 )) OR { 319} (( segid " " and resid 13 and name HG1 )) (( segid " " and resid 13 and name HB1 )) OR { 319} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HB1 )) OR { 319} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HB1 )) OR { 319} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HB2 )) OR { 319} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HB2 )) ASSI { 307} (( segid " " and resid 1 and name HG11)) ( segid " " and resid 1 and name HD1%) 2.000 0.500 0.500 peak 307 spectrum 1 weight 0.10000E+01 volume 0.14381E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 54} (( segid " " and resid 2 and name HN )) ( segid " " and resid 1 and name HD1%) 2.700 2.700 3.300 peak 54 spectrum 1 weight 0.10000E+01 volume 0.45802E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 27} (( segid " " and resid 2 and name HN )) (( segid " " and resid 2 and name HA )) 2.200 0.600 0.600 peak 27 spectrum 1 weight 0.10000E+01 volume 0.39071E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 182} (( segid " " and resid 2 and name HA )) (( segid " " and resid 3 and name HA )) 4.400 2.400 1.600 peak 182 spectrum 1 weight 0.10000E+01 volume 0.67077E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 186} (( segid " " and resid 2 and name HA )) ( segid " " and resid 3 and name HG2%) 5.200 3.400 0.800 peak 186 spectrum 1 weight 0.10000E+01 volume 0.44024E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 25} (( segid " " and resid 2 and name HN )) (( segid " " and resid 3 and name HN )) 4.300 2.300 1.700 peak 25 spectrum 1 weight 0.10000E+01 volume 0.76604E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 268} (( segid " " and resid 3 and name HB )) ( segid " " and resid 3 and name HD1%) 2.900 1.000 1.000 peak 268 spectrum 1 weight 0.10000E+01 volume 0.20941E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 270} (( segid " " and resid 3 and name HB )) (( segid " " and resid 3 and name HG11)) 2.400 0.700 0.700 peak 270 spectrum 1 weight 0.10000E+01 volume 0.20721E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 309} ( segid " " and resid 3 and name HD1%) (( segid " " and resid 3 and name HG11)) 1.700 1.700 4.300 peak 309 spectrum 1 weight 0.10000E+01 volume 0.18674E-01 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 306} (( segid " " and resid 3 and name HG12)) ( segid " " and resid 3 and name HD1%) 2.200 0.600 0.600 peak 306 spectrum 1 weight 0.10000E+01 volume 0.38376E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 58} (( segid " " and resid 3 and name HN )) ( segid " " and resid 3 and name HG2%) 2.900 1.100 1.100 peak 58 spectrum 1 weight 0.10000E+01 volume 0.19299E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 245} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 3 and name HB )) 4.700 2.800 1.300 peak 245 spectrum 1 weight 0.10000E+01 volume 0.15784E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 245} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 3 and name HB )) ASSI { 224} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 4 and name HA )) 1.900 1.900 4.100 peak 224 spectrum 1 weight 0.10000E+01 volume 0.10869E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 224} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 4 and name HA )) ASSI { 292} (( segid " " and resid 3 and name HG12)) (( segid " " and resid 5 and name HB1 )) 5.900 4.300 0.100 peak 292 spectrum 1 weight 0.10000E+01 volume 0.37185E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 292} (( segid " " and resid 3 and name HG12)) (( segid " " and resid 5 and name HB2 )) ASSI { 223} (( segid " " and resid 5 and name HB2 )) (( segid " " and resid 6 and name HA )) 3.700 1.800 1.800 peak 223 spectrum 1 weight 0.10000E+01 volume 0.37546E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 223} (( segid " " and resid 5 and name HB1 )) (( segid " " and resid 6 and name HA )) ASSI { 28} (( segid " " and resid 6 and name HN )) (( segid " " and resid 6 and name HA )) 3.000 1.100 1.100 peak 28 spectrum 1 weight 0.10000E+01 volume 0.11856E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 229} (( segid " " and resid 6 and name HB1 )) (( segid " " and resid 7 and name HA1 )) 5.200 3.300 0.800 peak 229 spectrum 1 weight 0.10000E+01 volume 0.70462E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 229} (( segid " " and resid 6 and name HB2 )) (( segid " " and resid 7 and name HA1 )) OR { 229} (( segid " " and resid 6 and name HB1 )) (( segid " " and resid 7 and name HA2 )) OR { 229} (( segid " " and resid 6 and name HB2 )) (( segid " " and resid 7 and name HA2 )) ASSI { 130} (( segid " " and resid 7 and name HN )) (( segid " " and resid 6 and name HB1 )) 4.100 2.100 1.900 peak 130 spectrum 1 weight 0.10000E+01 volume 0.14348E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 130} (( segid " " and resid 7 and name HN )) (( segid " " and resid 6 and name HB2 )) ASSI { 26} (( segid " " and resid 6 and name HN )) (( segid " " and resid 7 and name HN )) 4.200 2.200 1.800 peak 26 spectrum 1 weight 0.10000E+01 volume 0.52937E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 117} (( segid " " and resid 7 and name HN )) (( segid " " and resid 8 and name HN )) 2.600 0.800 0.800 peak 117 spectrum 1 weight 0.10000E+01 volume 0.18107E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 213} (( segid " " and resid 8 and name HB2 )) (( segid " " and resid 8 and name HA )) 2.100 0.500 0.500 peak 213 spectrum 1 weight 0.10000E+01 volume 0.14972E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 213} (( segid " " and resid 8 and name HB1 )) (( segid " " and resid 8 and name HA )) ASSI { 142} (( segid " " and resid 8 and name HN )) (( segid " " and resid 8 and name HB1 )) 3.400 1.500 1.500 peak 142 spectrum 1 weight 0.10000E+01 volume 0.58085E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 142} (( segid " " and resid 8 and name HN )) (( segid " " and resid 8 and name HB2 )) ASSI { 19} (( segid " " and resid 9 and name HN )) (( segid " " and resid 8 and name HA )) 4.100 2.100 1.900 peak 19 spectrum 1 weight 0.10000E+01 volume 0.70289E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 18} (( segid " " and resid 9 and name HN )) (( segid " " and resid 8 and name HB1 )) 3.600 1.600 1.600 peak 18 spectrum 1 weight 0.10000E+01 volume 0.53317E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 18} (( segid " " and resid 9 and name HN )) (( segid " " and resid 8 and name HB2 )) ASSI { 89} (( segid " " and resid 10 and name HN )) (( segid " " and resid 8 and name HA )) 2.400 2.400 3.600 peak 89 spectrum 1 weight 0.10000E+01 volume 0.89275E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 80} (( segid " " and resid 10 and name HN )) (( segid " " and resid 9 and name HA )) 4.100 2.100 1.900 peak 80 spectrum 1 weight 0.10000E+01 volume 0.12852E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 37} (( segid " " and resid 10 and name HN )) (( segid " " and resid 9 and name HB2 )) 3.600 1.600 1.600 peak 37 spectrum 1 weight 0.10000E+01 volume 0.56000E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 37} (( segid " " and resid 10 and name HN )) (( segid " " and resid 9 and name HB1 )) ASSI { 107} (( segid " " and resid 10 and name HN )) (( segid " " and resid 9 and name HN )) 2.500 0.800 0.800 peak 107 spectrum 1 weight 0.10000E+01 volume 0.10676E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 103} (( segid " " and resid 10 and name HN )) (( segid " " and resid 11 and name HN )) 3.800 1.800 1.800 peak 103 spectrum 1 weight 0.10000E+01 volume 0.12569E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 150} (( segid " " and resid 11 and name HN )) (( segid " " and resid 11 and name HA )) 3.500 1.500 1.500 peak 150 spectrum 1 weight 0.10000E+01 volume 0.34948E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 79} (( segid " " and resid 12 and name HN )) (( segid " " and resid 12 and name HA )) 2.400 0.700 0.700 peak 79 spectrum 1 weight 0.10000E+01 volume 0.42207E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 116} (( segid " " and resid 7 and name HN )) (( segid " " and resid 13 and name HN )) 4.500 2.500 1.500 peak 116 spectrum 1 weight 0.10000E+01 volume 0.72171E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 149} (( segid " " and resid 13 and name HN )) (( segid " " and resid 11 and name HA )) 4.200 2.200 1.800 peak 149 spectrum 1 weight 0.10000E+01 volume 0.69893E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 138} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HG1 )) 2.500 0.800 0.800 peak 138 spectrum 1 weight 0.10000E+01 volume 0.37708E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 138} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HG2 )) ASSI { 90} (( segid " " and resid 14 and name HN )) (( segid " " and resid 14 and name HA )) 2.400 0.700 0.700 peak 90 spectrum 1 weight 0.10000E+01 volume 0.29693E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 114} (( segid " " and resid 15 and name HN )) (( segid " " and resid 14 and name HN )) 4.300 2.300 1.700 peak 114 spectrum 1 weight 0.10000E+01 volume 0.11264E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 241} (( segid " " and resid 2 and name HB2 )) ( segid " " and resid 16 and name HE% ) 3.800 1.800 1.800 peak 241 spectrum 1 weight 0.10000E+01 volume 0.20316E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 241} (( segid " " and resid 2 and name HB1 )) ( segid " " and resid 16 and name HE% ) ASSI { 83} (( segid " " and resid 16 and name HN )) (( segid " " and resid 4 and name HA )) 3.500 1.500 1.500 peak 83 spectrum 1 weight 0.10000E+01 volume 0.76930E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 38} (( segid " " and resid 16 and name HN )) (( segid " " and resid 4 and name HB2 )) 5.600 3.900 0.400 peak 38 spectrum 1 weight 0.10000E+01 volume 0.52939E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 38} (( segid " " and resid 16 and name HN )) (( segid " " and resid 4 and name HB1 )) ASSI { 100} (( segid " " and resid 16 and name HN )) ( segid " " and resid 4 and name HE% ) 3.300 1.300 1.300 peak 100 spectrum 1 weight 0.10000E+01 volume 0.70417E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 255} (( segid " " and resid 16 and name HG2 )) (( segid " " and resid 15 and name HA2 )) 4.300 2.300 1.700 peak 255 spectrum 1 weight 0.10000E+01 volume 0.52255E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 255} (( segid " " and resid 16 and name HG1 )) (( segid " " and resid 15 and name HA2 )) ASSI { 105} (( segid " " and resid 16 and name HN )) (( segid " " and resid 15 and name HN )) 3.600 1.700 1.700 peak 105 spectrum 1 weight 0.10000E+01 volume 0.11439E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 48} (( segid " " and resid 16 and name HN )) (( segid " " and resid 16 and name HB2 )) 2.200 0.600 0.600 peak 48 spectrum 1 weight 0.10000E+01 volume 0.76433E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 48} (( segid " " and resid 16 and name HN )) (( segid " " and resid 16 and name HB1 )) ASSI { 47} (( segid " " and resid 16 and name HN )) ( segid " " and resid 16 and name HE% ) 4.800 2.800 1.200 peak 47 spectrum 1 weight 0.10000E+01 volume 0.45664E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 3} (( segid " " and resid 17 and name HN )) (( segid " " and resid 2 and name HA )) 3.800 1.800 1.800 peak 3 spectrum 1 weight 0.10000E+01 volume 0.99169E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 9} (( segid " " and resid 17 and name HN )) (( segid " " and resid 2 and name HB1 )) 2.700 0.900 0.900 peak 9 spectrum 1 weight 0.10000E+01 volume 0.12887E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 9} (( segid " " and resid 17 and name HN )) (( segid " " and resid 2 and name HB2 )) ASSI { 67} (( segid " " and resid 3 and name HN )) (( segid " " and resid 17 and name HB2 )) 4.400 2.500 1.600 peak 67 spectrum 1 weight 0.10000E+01 volume 0.75135E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 67} (( segid " " and resid 3 and name HN )) (( segid " " and resid 17 and name HB1 )) ASSI { 14} (( segid " " and resid 17 and name HN )) (( segid " " and resid 3 and name HG11)) 3.400 1.500 1.500 peak 14 spectrum 1 weight 0.10000E+01 volume 0.41221E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 13} (( segid " " and resid 17 and name HN )) (( segid " " and resid 3 and name HG12)) 4.000 2.000 2.000 peak 13 spectrum 1 weight 0.10000E+01 volume 0.47012E-03 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 236} (( segid " " and resid 17 and name HB2 )) (( segid " " and resid 5 and name HB1 )) 3.300 1.400 1.400 peak 236 spectrum 1 weight 0.10000E+01 volume 0.16957E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 236} (( segid " " and resid 17 and name HB2 )) (( segid " " and resid 5 and name HB2 )) OR { 236} (( segid " " and resid 17 and name HB1 )) (( segid " " and resid 5 and name HB2 )) OR { 236} (( segid " " and resid 17 and name HB1 )) (( segid " " and resid 5 and name HB1 )) ASSI { 71} (( segid " " and resid 5 and name HN )) (( segid " " and resid 17 and name HB2 )) 4.200 2.200 1.800 peak 71 spectrum 1 weight 0.10000E+01 volume 0.55175E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 71} (( segid " " and resid 5 and name HN )) (( segid " " and resid 17 and name HB1 )) ASSI { 21} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HA )) 2.400 0.700 0.700 peak 21 spectrum 1 weight 0.10000E+01 volume 0.49038E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 168} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HA )) 1.800 0.400 0.400 peak 168 spectrum 1 weight 0.10000E+01 volume 0.34785E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 168} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HA )) ASSI { 169} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 4 and name HA )) 4.800 2.800 1.200 peak 169 spectrum 1 weight 0.10000E+01 volume 0.71905E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 169} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 4 and name HA )) ASSI { 166} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HZ )) 2.600 0.800 0.800 peak 166 spectrum 1 weight 0.10000E+01 volume 0.15783E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 166} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 4 and name HZ )) ASSI { 231} (( segid " " and resid 6 and name HB1 )) (( segid " " and resid 7 and name HA1 )) 5.100 3.200 0.900 peak 231 spectrum 1 weight 0.10000E+01 volume 0.79104E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 231} (( segid " " and resid 6 and name HB1 )) (( segid " " and resid 7 and name HA1 )) OR { 231} (( segid " " and resid 6 and name HB2 )) (( segid " " and resid 7 and name HA1 )) OR { 231} (( segid " " and resid 6 and name HB1 )) (( segid " " and resid 7 and name HA2 )) OR { 231} (( segid " " and resid 6 and name HB1 )) (( segid " " and resid 7 and name HA2 )) OR { 231} (( segid " " and resid 6 and name HB2 )) (( segid " " and resid 7 and name HA2 )) OR { 231} (( segid " " and resid 6 and name HB2 )) (( segid " " and resid 7 and name HA2 )) ASSI { 145} (( segid " " and resid 8 and name HN )) (( segid " " and resid 7 and name HA2 )) 3.100 1.200 1.200 peak 145 spectrum 1 weight 0.10000E+01 volume 0.10443E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 145} (( segid " " and resid 8 and name HN )) (( segid " " and resid 7 and name HA2 )) OR { 145} (( segid " " and resid 8 and name HN )) (( segid " " and resid 7 and name HA1 )) OR { 145} (( segid " " and resid 8 and name HN )) (( segid " " and resid 7 and name HA1 )) ASSI { 195} (( segid " " and resid 7 and name HA2 )) (( segid " " and resid 11 and name HA )) 4.800 2.900 1.200 peak 195 spectrum 1 weight 0.10000E+01 volume 0.11305E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 195} (( segid " " and resid 7 and name HA2 )) (( segid " " and resid 11 and name HA )) OR { 195} (( segid " " and resid 7 and name HA1 )) (( segid " " and resid 11 and name HA )) OR { 195} (( segid " " and resid 7 and name HA1 )) (( segid " " and resid 11 and name HA )) ASSI { 192} (( segid " " and resid 7 and name HA1 )) (( segid " " and resid 12 and name HB1 )) 4.600 2.600 1.400 peak 192 spectrum 1 weight 0.10000E+01 volume 0.20370E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 192} (( segid " " and resid 7 and name HA1 )) (( segid " " and resid 12 and name HB1 )) OR { 192} (( segid " " and resid 7 and name HA1 )) (( segid " " and resid 12 and name HB1 )) OR { 192} (( segid " " and resid 7 and name HA1 )) (( segid " " and resid 12 and name HB1 )) OR { 192} (( segid " " and resid 7 and name HA2 )) (( segid " " and resid 12 and name HB1 )) OR { 192} (( segid " " and resid 7 and name HA2 )) (( segid " " and resid 12 and name HB1 )) OR { 192} (( segid " " and resid 7 and name HA2 )) (( segid " " and resid 12 and name HB1 )) OR { 192} (( segid " " and resid 7 and name HA2 )) (( segid " " and resid 12 and name HB1 )) OR { 192} (( segid " " and resid 7 and name HA1 )) (( segid " " and resid 12 and name HB2 )) OR { 192} (( segid " " and resid 7 and name HA1 )) (( segid " " and resid 12 and name HB2 )) OR { 192} (( segid " " and resid 7 and name HA1 )) (( segid " " and resid 12 and name HB2 )) OR { 192} (( segid " " and resid 7 and name HA1 )) (( segid " " and resid 12 and name HB2 )) OR { 192} (( segid " " and resid 7 and name HA2 )) (( segid " " and resid 12 and name HB2 )) ASSI { 77} (( segid " " and resid 12 and name HN )) (( segid " " and resid 7 and name HA2 )) 5.000 3.100 1.000 peak 77 spectrum 1 weight 0.10000E+01 volume 0.64857E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 77} (( segid " " and resid 12 and name HN )) (( segid " " and resid 7 and name HA2 )) OR { 77} (( segid " " and resid 12 and name HN )) (( segid " " and resid 7 and name HA1 )) OR { 77} (( segid " " and resid 12 and name HN )) (( segid " " and resid 7 and name HA1 )) ASSI { 140} (( segid " " and resid 13 and name HN )) (( segid " " and resid 11 and name HD1 )) 4.400 2.400 1.600 peak 140 spectrum 1 weight 0.10000E+01 volume 0.70880E-03 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 140} (( segid " " and resid 13 and name HN )) (( segid " " and resid 11 and name HD1 )) OR { 140} (( segid " " and resid 13 and name HN )) (( segid " " and resid 11 and name HD2 )) OR { 140} (( segid " " and resid 13 and name HN )) (( segid " " and resid 11 and name HD2 )) ASSI { 294} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HB1 )) 2.800 1.000 1.000 peak 294 spectrum 1 weight 0.10000E+01 volume 0.32118E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 294} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HB1 )) OR { 294} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HB1 )) OR { 294} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HB1 )) OR { 294} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HB1 )) OR { 294} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HB1 )) OR { 294} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HB1 )) OR { 294} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HB1 )) OR { 294} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HB2 )) OR { 294} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HB2 )) OR { 294} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HB2 )) OR { 294} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HB2 )) OR { 294} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HB2 )) ASSI { 276} (( segid " " and resid 19 and name HB2 )) (( segid " " and resid 19 and name HG2 )) 2.100 0.600 0.600 peak 276 spectrum 1 weight 0.10000E+01 volume 0.89094E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 276} (( segid " " and resid 19 and name HB2 )) (( segid " " and resid 19 and name HG2 )) OR { 276} (( segid " " and resid 19 and name HB1 )) (( segid " " and resid 19 and name HG1 )) OR { 276} (( segid " " and resid 19 and name HB1 )) (( segid " " and resid 19 and name HG2 )) OR { 276} (( segid " " and resid 19 and name HB1 )) (( segid " " and resid 19 and name HG2 )) OR { 276} (( segid " " and resid 19 and name HB2 )) (( segid " " and resid 19 and name HG1 )) OR { 276} (( segid " " and resid 19 and name HB2 )) (( segid " " and resid 19 and name HG1 )) ASSI { 275} (( segid " " and resid 19 and name HD2 )) (( segid " " and resid 19 and name HG1 )) 2.100 0.500 0.500 peak 275 spectrum 1 weight 0.10000E+01 volume 0.10671E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 275} (( segid " " and resid 19 and name HD2 )) (( segid " " and resid 19 and name HG1 )) OR { 275} (( segid " " and resid 19 and name HD1 )) (( segid " " and resid 19 and name HG2 )) OR { 275} (( segid " " and resid 19 and name HD1 )) (( segid " " and resid 19 and name HG2 )) OR { 275} (( segid " " and resid 19 and name HD2 )) (( segid " " and resid 19 and name HG2 )) OR { 275} (( segid " " and resid 19 and name HD2 )) (( segid " " and resid 19 and name HG2 )) OR { 275} (( segid " " and resid 19 and name HD1 )) (( segid " " and resid 19 and name HG1 )) ASSI { 114} (( segid " " and resid 1 and name HB )) (( segid " " and resid 1 and name HG11)) 2.500 0.800 0.800 peak 114 spectrum 1 weight 0.10000E+01 volume 0.32359E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 41} (( segid " " and resid 3 and name HA )) ( segid " " and resid 3 and name HG2%) 2.000 0.500 0.500 peak 41 spectrum 1 weight 0.10000E+01 volume 0.84235E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 112} (( segid " " and resid 3 and name HB )) ( segid " " and resid 3 and name HG2%) 2.200 0.600 0.600 peak 112 spectrum 1 weight 0.10000E+01 volume 0.49592E-02 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 79} (( segid " " and resid 9 and name HB1 )) (( segid " " and resid 9 and name HA )) 2.900 1.100 1.100 peak 79 spectrum 1 weight 0.10000E+01 volume 0.24015E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 79} (( segid " " and resid 9 and name HB2 )) (( segid " " and resid 9 and name HA )) ASSI { 60} (( segid " " and resid 10 and name HB1 )) (( segid " " and resid 10 and name HA )) 2.500 0.800 0.800 peak 60 spectrum 1 weight 0.10000E+01 volume 0.50059E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 60} (( segid " " and resid 10 and name HB2 )) (( segid " " and resid 10 and name HA )) ASSI { 44} (( segid " " and resid 13 and name HA )) (( segid " " and resid 13 and name HG2 )) 2.600 0.900 0.900 peak 44 spectrum 1 weight 0.10000E+01 volume 0.46529E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 44} (( segid " " and resid 13 and name HA )) (( segid " " and resid 13 and name HG1 )) ASSI { 72} (( segid " " and resid 6 and name HB2 )) (( segid " " and resid 14 and name HB1 )) 4.000 2.000 2.000 peak 72 spectrum 1 weight 0.10000E+01 volume 0.25263E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 72} (( segid " " and resid 6 and name HB1 )) (( segid " " and resid 14 and name HB1 )) OR { 72} (( segid " " and resid 6 and name HB1 )) (( segid " " and resid 14 and name HB2 )) OR { 72} (( segid " " and resid 6 and name HB2 )) (( segid " " and resid 14 and name HB2 )) ASSI { 8} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 15 and name HA2 )) 3.100 1.200 1.200 peak 8 spectrum 1 weight 0.10000E+01 volume 0.27630E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 8} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 15 and name HA1 )) ASSI { 5} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 15 and name HA2 )) 2.200 0.600 0.600 peak 5 spectrum 1 weight 0.10000E+01 volume 0.40974E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 5} ( segid " " and resid 4 and name HE% ) (( segid " " and resid 15 and name HA1 )) ASSI { 13} (( segid " " and resid 4 and name HZ )) (( segid " " and resid 4 and name HB2 )) 4.800 2.900 1.200 peak 13 spectrum 1 weight 0.10000E+01 volume 0.18077E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 13} (( segid " " and resid 4 and name HZ )) (( segid " " and resid 4 and name HB2 )) OR { 13} (( segid " " and resid 4 and name HZ )) (( segid " " and resid 4 and name HB1 )) OR { 13} (( segid " " and resid 4 and name HZ )) (( segid " " and resid 4 and name HB1 )) ASSI { 49} (( segid " " and resid 12 and name HA )) (( segid " " and resid 12 and name HB1 )) 1.900 0.400 0.400 peak 49 spectrum 1 weight 0.10000E+01 volume 0.24989E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 49} (( segid " " and resid 12 and name HA )) (( segid " " and resid 12 and name HB1 )) OR { 49} (( segid " " and resid 12 and name HA )) (( segid " " and resid 12 and name HB2 )) OR { 49} (( segid " " and resid 12 and name HA )) (( segid " " and resid 12 and name HB2 )) ASSI { 125} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HA )) 2.700 0.900 0.900 peak 125 spectrum 1 weight 0.10000E+01 volume 0.19868E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 125} (( segid " " and resid 13 and name HB1 )) (( segid " " and resid 13 and name HA )) OR { 125} (( segid " " and resid 13 and name HG2 )) (( segid " " and resid 13 and name HA )) OR { 125} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HA )) OR { 125} (( segid " " and resid 13 and name HB2 )) (( segid " " and resid 13 and name HA )) ASSI { 69} (( segid " " and resid 13 and name HE2 )) (( segid " " and resid 13 and name HG1 )) 2.900 1.100 1.100 peak 69 spectrum 1 weight 0.10000E+01 volume 0.48651E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 69} (( segid " " and resid 13 and name HE2 )) (( segid " " and resid 13 and name HG1 )) OR { 69} (( segid " " and resid 13 and name HE2 )) (( segid " " and resid 13 and name HG2 )) OR { 69} (( segid " " and resid 13 and name HE1 )) (( segid " " and resid 13 and name HG1 )) OR { 69} (( segid " " and resid 13 and name HE1 )) (( segid " " and resid 13 and name HG1 )) OR { 69} (( segid " " and resid 13 and name HE1 )) (( segid " " and resid 13 and name HG2 )) OR { 69} (( segid " " and resid 13 and name HE1 )) (( segid " " and resid 13 and name HG2 )) ASSI { 130} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HG2 )) 2.200 0.600 0.600 peak 130 spectrum 1 weight 0.10000E+01 volume 0.79184E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 130} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HG2 )) OR { 130} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HG1 )) OR { 130} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HG1 )) OR { 130} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HG2 )) OR { 130} (( segid " " and resid 13 and name HD2 )) (( segid " " and resid 13 and name HG2 )) OR { 130} (( segid " " and resid 13 and name HD1 )) (( segid " " and resid 13 and name HG1 )) ASSI { 85} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 16 and name HA )) 3.400 1.500 1.500 peak 85 spectrum 1 weight 0.10000E+01 volume 0.22388E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 85} (( segid " " and resid 4 and name HB2 )) (( segid " " and resid 16 and name HA )) OR { 85} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 16 and name HA )) OR { 85} (( segid " " and resid 4 and name HB1 )) (( segid " " and resid 16 and name HA )) ASSI { 3} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 16 and name HA )) 1.300 0.200 0.900 peak 3 spectrum 1 weight 0.10000E+01 volume 0.92568E-01 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 3} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 16 and name HA )) ASSI { 18} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 16 and name HG2 )) 3.300 1.300 1.300 peak 18 spectrum 1 weight 0.10000E+01 volume 0.27070E-02 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 18} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 16 and name HG2 )) OR { 18} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 16 and name HG1 )) OR { 18} ( segid " " and resid 4 and name HD% ) (( segid " " and resid 16 and name HG1 ))
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