*HEADER    FACTORH                                 18-AUG-05   2BZM
*TITLE     SOLUTION STRUCTURE OF THE PRIMARY HOST RECOGNITION REGION
*TITLE    2 OF COMPLEMENT FACTOR H
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: COMPLEMENT FACTORH;
*COMPND   3 CHAIN: CHAIN:, A, (1107, -, 1231);
*COMPND   4 FRAGMENT: CCPS 19-20;
*COMPND   5 ENGINEERED: YES
*SOURCE    MOL_ID: 1;
*SOURCE   2 EXPRESSION_SYSTEM: PICHIA PASTORIS;
*SOURCE   3 EXPRESSION_SYSTEM_STRAIN: KM71H;
*SOURCE   4 EXPRESSION_SYSTEM_VECTOR: PPICZALPHAA;
*SOURCE   5 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE   6 ORGANISM_COMMON: HUMAN
*KEYWDS    FACTORH,COMPLEMENT,NMR,HUS,HEPARIN,POLYANIONS
*EXPDTA    NMR, 26 STRUCTURES
*AUTHOR    A.P.HERBERT,D.UHRIN,M.LYON,M.K.PANGBURN,P.N.BARLOW




 ASSI (
   (( segid "    " and resid 1226 and name HD1 ))
  OR 
   (( segid "    " and resid 1112 and name HD2 ))
 )(
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
  OR 
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      6.000     6.000     0.000 peak  9697 weight  0.10000E+01 volume -0.16700E+00 ppm1      3.450 ppm2      0.103
 ASSI (
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      6.000     6.000     0.000 peak  9663 weight  0.10000E+01 volume -0.16900E+00 ppm1      6.826 ppm2      0.115
 ASSI (
   (( segid "    " and resid 1226 and name HD1 ))
  OR 
   (( segid "    " and resid 1112 and name HD2 ))
 )(
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
  OR 
   (( segid "    " and resid 1112 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7301 weight  0.10000E+01 volume -0.68800E+00 ppm1      3.463 ppm2      0.379
 ASSI (
   (( segid "    " and resid 1226 and name HG2 ))
  OR 
   (( segid "    " and resid 1160 and name HG2 ))
 )(
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
  OR 
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )
      5.000     5.000     0.000 peak  7926 weight  0.10000E+01 volume  0.43700E+00 ppm1      1.703 ppm2      0.392
 ASSI (
   (( segid "    " and resid 1170 and name HB2 ))
 )(
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )
      6.000     6.000     0.000 peak  7760 weight  0.10000E+01 volume -0.18800E+00 ppm1      3.710 ppm2     -0.397
 ASSI (
   (( segid "    " and resid 1169 and name HG12))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )
      6.000     6.000     0.000 peak  9518 weight  0.10000E+01 volume  0.38600E+00 ppm1      0.965 ppm2      0.420
 ASSI (
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )
      2.700     2.700     0.000 peak  9646 weight  0.10000E+01 volume  0.55690E+01 ppm1      0.626 ppm2      0.434
 ASSI (
   (( segid "    " and resid 1114 and name HG2 ))
  OR 
   (( segid "    " and resid 1114 and name HG1 ))
  OR 
   (( segid "    " and resid 1113 and name HG1 ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
  OR 
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )
      5.000     5.000     0.000 peak  9221 weight  0.10000E+01 volume  0.49300E+00 ppm1      1.978 ppm2      0.439
 ASSI (
   (( segid "    " and resid 1160 and name HG1 ))
 )(
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )
      5.000     5.000     0.000 peak  9491 weight  0.10000E+01 volume  0.11520E+01 ppm1      1.859 ppm2      0.445
 ASSI (
   (( segid "    " and resid 1226 and name HD1 ))
  OR 
   (( segid "    " and resid 1112 and name HD2 ))
 )(
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )
      6.000     6.000     0.000 peak  7307 weight  0.10000E+01 volume -0.37800E+00 ppm1      3.472 ppm2      0.515
 ASSI (
   (( segid "    " and resid 1112 and name HD1 ))
 )(
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )
      6.000     6.000     0.000 peak  7308 weight  0.10000E+01 volume -0.34000E+00 ppm1      3.551 ppm2      0.515
 ASSI (
   (( segid "    " and resid 1161 and name HB1 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      5.000     5.000     0.000 peak  8304 weight  0.10000E+01 volume  0.14760E+01 ppm1      1.821 ppm2      0.585
 ASSI (
   (( segid "    " and resid 1203 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
 )(
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      6.000     6.000     0.000 peak  8127 weight  0.10000E+01 volume  0.33500E+00 ppm1      1.772 ppm2      0.590
 ASSI (
   (( segid "    " and resid 1220 and name HA  ))
  OR 
   (( segid "    " and resid 1162 and name HA  ))
  OR 
   (( segid "    " and resid 1137 and name HA  ))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
  OR 
   (( segid "    " and resid 1115 and name HG12))
 )
      6.000     6.000     0.000 peak  7596 weight  0.10000E+01 volume -0.31100E+00 ppm1      4.487 ppm2      0.658
 ASSI (
   (( segid "    " and resid 1208 and name HB2 ))
  OR 
   (( segid "    " and resid 1170 and name HB2 ))
 )(
   (( segid "    " and resid 1227 and name HG23))
  OR 
   (( segid "    " and resid 1227 and name HG22))
  OR 
   (( segid "    " and resid 1227 and name HG21))
  OR 
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
  OR 
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      5.000     5.000     0.000 peak  8012 weight  0.10000E+01 volume -0.61000E+00 ppm1      3.676 ppm2      0.663
 ASSI (
   (( segid "    " and resid 1225 and name HE2 ))
  OR 
   (( segid "    " and resid 1225 and name HE1 ))
 )(
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
  OR 
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      5.000     5.000     0.000 peak  8113 weight  0.10000E+01 volume -0.55700E+00 ppm1      6.717 ppm2      0.665
 ASSI (
   (( segid "    " and resid 1211 and name HB1 ))
  OR 
   (( segid "    " and resid 1208 and name HB1 ))
  OR 
   (( segid "    " and resid 1170 and name HB1 ))
  OR 
   (( segid "    " and resid 1126 and name HB2 ))
  OR 
   (( segid "    " and resid 1126 and name HB1 ))
 )(
   (( segid "    " and resid 1227 and name HG23))
  OR 
   (( segid "    " and resid 1227 and name HG22))
  OR 
   (( segid "    " and resid 1227 and name HG21))
  OR 
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
  OR 
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
  OR 
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
  OR 
   (( segid "    " and resid 1125 and name HD13))
  OR 
   (( segid "    " and resid 1125 and name HD12))
  OR 
   (( segid "    " and resid 1125 and name HD11))
 )
      6.000     6.000     0.000 peak  8013 weight  0.10000E+01 volume -0.38700E+00 ppm1      3.924 ppm2      0.667
 ASSI (
   (( segid "    " and resid 1226 and name HG1 ))
 )(
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
  OR 
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )
      5.000     5.000     0.000 peak  9287 weight  0.10000E+01 volume  0.86400E+00 ppm1      2.079 ppm2      0.694
 ASSI (
   (( segid "    " and resid 1161 and name HB1 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
  OR 
   (( segid "    " and resid 1108 and name HB1 ))
 )(
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
  OR 
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
 )
      3.300     3.300     0.000 peak  8323 weight  0.10000E+01 volume  0.17540E+01 ppm1      1.823 ppm2      0.779
 ASSI (
   (( segid "    " and resid 1187 and name HB2 ))
  OR 
   (( segid "    " and resid 1187 and name HB1 ))
  OR 
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      5.000     5.000     0.000 peak  8284 weight  0.10000E+01 volume  0.53500E+00 ppm1      2.016 ppm2      0.799
 ASSI (
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
 )(
   (( segid "    " and resid 1207 and name HD13))
  OR 
   (( segid "    " and resid 1207 and name HD12))
  OR 
   (( segid "    " and resid 1207 and name HD11))
 )
      3.300     3.300     0.000 peak  7949 weight  0.10000E+01 volume  0.17090E+01 ppm1      1.076 ppm2      0.822
 ASSI (
   (( segid "    " and resid 1167 and name HA  ))
 )(
   (( segid "    " and resid 1168 and name HG23))
  OR 
   (( segid "    " and resid 1168 and name HG22))
  OR 
   (( segid "    " and resid 1168 and name HG21))
  OR 
   (( segid "    " and resid 1168 and name HG13))
  OR 
   (( segid "    " and resid 1168 and name HG12))
  OR 
   (( segid "    " and resid 1168 and name HG11))
 )
      6.000     6.000     0.000 peak  6541 weight  0.10000E+01 volume -0.32100E+00 ppm1      4.795 ppm2      0.828
 ASSI (
   (( segid "    " and resid 1149 and name HB1 ))
  OR 
   (( segid "    " and resid 1108 and name HB2 ))
 )(
   (( segid "    " and resid 1150 and name HG11))
  OR 
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
  OR 
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )
      5.000     5.000     0.000 peak  7130 weight  0.10000E+01 volume  0.71600E+00 ppm1      1.670 ppm2      0.831
 ASSI (
   (( segid "    " and resid 1108 and name HB1 ))
 )(
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
 )
      5.000     5.000     0.000 peak  8324 weight  0.10000E+01 volume  0.12130E+01 ppm1      1.799 ppm2      0.839
 ASSI (
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )(
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
  OR 
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
  OR 
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
  OR 
   (( segid "    " and resid 1125 and name HB2 ))
 )
      6.000     6.000     0.000 peak  9661 weight  0.10000E+01 volume -0.15300E+00 ppm1      7.119 ppm2      0.843
 ASSI (
   (( segid "    " and resid 1134 and name HA  ))
  OR 
   (( segid "    " and resid 1126 and name HA  ))
 )(
   (( segid "    " and resid 1150 and name HG11))
  OR 
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
  OR 
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
  OR 
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
  OR 
   (( segid "    " and resid 1125 and name HB2 ))
 )
      6.000     6.000     0.000 peak  9130 weight  0.10000E+01 volume -0.30400E+00 ppm1      4.379 ppm2      0.855
 ASSI (
   (( segid "    " and resid 1214 and name HG  ))
 )(
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )
      5.000     5.000     0.000 peak  9333 weight  0.10000E+01 volume  0.80900E+00 ppm1      1.696 ppm2      0.934
 ASSI (
   (( segid "    " and resid 1225 and name HA  ))
  OR 
   (( segid "    " and resid 1214 and name HA  ))
 )(
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
  OR 
   (( segid "    " and resid 1169 and name HG12))
 )
      6.000     6.000     0.000 peak  7503 weight  0.10000E+01 volume -0.18100E+00 ppm1      4.158 ppm2      0.939
 ASSI (
   (( segid "    " and resid 1226 and name HA  ))
 )(
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )
      6.000     6.000     0.000 peak  7410 weight  0.10000E+01 volume -0.25900E+00 ppm1      4.498 ppm2      0.966
 ASSI (
   (( segid "    " and resid 1206 and name HB1 ))
  OR 
   (( segid "    " and resid 1135 and name HB1 ))
 )(
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      5.000     5.000     0.000 peak  8321 weight  0.10000E+01 volume  0.59700E+00 ppm1      1.841 ppm2      0.977
 ASSI (
   (( segid "    " and resid 1135 and name HB2 ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      5.000     5.000     0.000 peak  8322 weight  0.10000E+01 volume  0.75700E+00 ppm1      1.739 ppm2      0.986
 ASSI (
   (( segid "    " and resid 1214 and name HG  ))
 )(
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
 )
      5.000     5.000     0.000 peak  7924 weight  0.10000E+01 volume  0.12080E+01 ppm1      1.702 ppm2      1.089
 ASSI (
   (( segid "    " and resid 1230 and name HE2 ))
  OR 
   (( segid "    " and resid 1230 and name HE1 ))
  OR 
   (( segid "    " and resid 1202 and name HE2 ))
  OR 
   (( segid "    " and resid 1202 and name HE1 ))
 )(
   (( segid "    " and resid 1230 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9275 weight  0.10000E+01 volume  0.15410E+01 ppm1      2.808 ppm2      1.100
 ASSI (
   (( segid "    " and resid 1207 and name HG  ))
  OR 
   (( segid "    " and resid 1203 and name HG1 ))
 )(
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
  OR 
   (( segid "    " and resid 1184 and name HG23))
  OR 
   (( segid "    " and resid 1184 and name HG22))
  OR 
   (( segid "    " and resid 1184 and name HG21))
 )
      6.000     6.000     0.000 peak  8023 weight  0.10000E+01 volume  0.29400E+00 ppm1      1.795 ppm2      1.101
 ASSI (
   (( segid "    " and resid 1206 and name HB2 ))
  OR 
   (( segid "    " and resid 1206 and name HB1 ))
  OR 
   (( segid "    " and resid 1186 and name HB1 ))
 )(
   (( segid "    " and resid 1230 and name HG2 ))
  OR 
   (( segid "    " and resid 1184 and name HG23))
  OR 
   (( segid "    " and resid 1184 and name HG22))
  OR 
   (( segid "    " and resid 1184 and name HG21))
 )
      5.000     5.000     0.000 peak  8325 weight  0.10000E+01 volume  0.56800E+00 ppm1      1.820 ppm2      1.105
 ASSI (
   (( segid "    " and resid 1225 and name HA  ))
 )(
   (( segid "    " and resid 1223 and name HB2 ))
  OR 
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
  OR 
   (( segid "    " and resid 1179 and name HG11))
  OR 
   (( segid "    " and resid 1173 and name HB  ))
 )
      5.000     5.000     0.000 peak  6641 weight  0.10000E+01 volume -0.95500E+00 ppm1      4.163 ppm2      1.108
 ASSI (
   (( segid "    " and resid 1230 and name HE2 ))
  OR 
   (( segid "    " and resid 1230 and name HE1 ))
  OR 
   (( segid "    " and resid 1202 and name HE2 ))
  OR 
   (( segid "    " and resid 1202 and name HE1 ))
 )(
   (( segid "    " and resid 1230 and name HG1 ))
  OR 
   (( segid "    " and resid 1202 and name HG1 ))
 )
      5.000     5.000     0.000 peak  9284 weight  0.10000E+01 volume  0.15180E+01 ppm1      2.808 ppm2      1.213
 ASSI (
   (( segid "    " and resid 1203 and name HG1 ))
  OR 
   (( segid "    " and resid 1160 and name HG2 ))
 )(
   (( segid "    " and resid 1202 and name HD2 ))
  OR 
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
  OR 
   (( segid "    " and resid 1112 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9346 weight  0.10000E+01 volume  0.57500E+00 ppm1      1.754 ppm2      1.251
 ASSI (
   (( segid "    " and resid 1112 and name HD1 ))
 )(
   (( segid "    " and resid 1125 and name HB1 ))
  OR 
   (( segid "    " and resid 1112 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7305 weight  0.10000E+01 volume -0.30700E+00 ppm1      3.531 ppm2      1.299
 ASSI (
   (( segid "    " and resid 1108 and name HA  ))
 )(
   (( segid "    " and resid 1108 and name HG2 ))
 )
      5.000     5.000     0.000 peak  7974 weight  0.10000E+01 volume -0.11050E+01 ppm1      4.276 ppm2      1.304
 ASSI (
   (( segid "    " and resid 1188 and name HA  ))
 )(
   (( segid "    " and resid 1188 and name HG2 ))
 )
      5.000     5.000     0.000 peak  8280 weight  0.10000E+01 volume -0.12960E+01 ppm1      4.396 ppm2      1.324
 ASSI (
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1166 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
  OR 
   (( segid "    " and resid 1144 and name HG  ))
 )
      5.000     5.000     0.000 peak  9403 weight  0.10000E+01 volume  0.12210E+01 ppm1      0.661 ppm2      1.370
 ASSI (
   (( segid "    " and resid 1203 and name HG1 ))
  OR 
   (( segid "    " and resid 1160 and name HG2 ))
 )(
   (( segid "    " and resid 1202 and name HD1 ))
  OR 
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
  OR 
   (( segid "    " and resid 1149 and name HG2 ))
  OR 
   (( segid "    " and resid 1144 and name HG  ))
  OR 
   (( segid "    " and resid 1120 and name HG11))
 )
      5.000     5.000     0.000 peak  9345 weight  0.10000E+01 volume  0.75700E+00 ppm1      1.754 ppm2      1.382
 ASSI (
   (( segid "    " and resid 1186 and name HA  ))
  OR 
   (( segid "    " and resid 1108 and name HA  ))
 )(
   (( segid "    " and resid 1186 and name HG2 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1108 and name HG1 ))
 )
      3.300     3.300     0.000 peak  7973 weight  0.10000E+01 volume -0.28610E+01 ppm1      4.274 ppm2      1.399
 ASSI (
   (( segid "    " and resid 1166 and name HB1 ))
 )(
   (( segid "    " and resid 1166 and name HG2 ))
 )
      6.000     6.000     0.000 peak  9562 weight  0.10000E+01 volume  0.26400E+00 ppm1      2.222 ppm2      1.402
 ASSI (
   (( segid "    " and resid 1166 and name HG1 ))
 )(
   (( segid "    " and resid 1166 and name HG2 ))
 )
      5.000     5.000     0.000 peak  9566 weight  0.10000E+01 volume  0.14890E+01 ppm1      1.520 ppm2      1.405
 ASSI (
   (( segid "    " and resid 1188 and name HA  ))
 )(
   (( segid "    " and resid 1188 and name HG1 ))
  OR 
   (( segid "    " and resid 1185 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8281 weight  0.10000E+01 volume -0.10790E+01 ppm1      4.394 ppm2      1.408
 ASSI (
   (( segid "    " and resid 1215 and name HD2 ))
  OR 
   (( segid "    " and resid 1215 and name HD1 ))
  OR 
   (( segid "    " and resid 1153 and name HD2 ))
  OR 
   (( segid "    " and resid 1153 and name HD1 ))
 )(
   (( segid "    " and resid 1215 and name HG2 ))
  OR 
   (( segid "    " and resid 1215 and name HG1 ))
  OR 
   (( segid "    " and resid 1153 and name HG2 ))
 )
      3.300     3.300     0.000 peak  7049 weight  0.10000E+01 volume  0.28510E+01 ppm1      3.187 ppm2      1.455
 ASSI (
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
 )(
   (( segid "    " and resid 1192 and name HB2 ))
 )
      6.000     6.000     0.000 peak  9711 weight  0.10000E+01 volume  0.36000E+00 ppm1      2.134 ppm2      1.460
 ASSI (
   (( segid "    " and resid 1207 and name HG  ))
 )(
   (( segid "    " and resid 1207 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8025 weight  0.10000E+01 volume  0.70600E+00 ppm1      1.794 ppm2      1.463
 ASSI (
   (( segid "    " and resid 1222 and name HE2 ))
  OR 
   (( segid "    " and resid 1222 and name HE1 ))
  OR 
   (( segid "    " and resid 1148 and name HE2 ))
  OR 
   (( segid "    " and resid 1148 and name HE1 ))
 )(
   (( segid "    " and resid 1222 and name HG1 ))
  OR 
   (( segid "    " and resid 1148 and name HG2 ))
 )
      5.000     5.000     0.000 peak  9580 weight  0.10000E+01 volume  0.55100E+00 ppm1      3.072 ppm2      1.474
 ASSI (
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
 )(
   (( segid "    " and resid 1148 and name HG2 ))
 )
      2.700     2.700     0.000 peak  8130 weight  0.10000E+01 volume  0.31390E+01 ppm1      1.766 ppm2      1.495
 ASSI (
   (( segid "    " and resid 1166 and name HB1 ))
 )(
   (( segid "    " and resid 1166 and name HG1 ))
 )
      6.000     6.000     0.000 peak  9560 weight  0.10000E+01 volume  0.35000E+00 ppm1      2.221 ppm2      1.529
 ASSI (
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )(
   (( segid "    " and resid 1134 and name HB  ))
  OR 
   (( segid "    " and resid 1125 and name HG  ))
  OR 
   (( segid "    " and resid 1120 and name HB  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )
      6.000     6.000     0.000 peak  9121 weight  0.10000E+01 volume -0.15300E+00 ppm1      6.829 ppm2      1.545
 ASSI (
   (( segid "    " and resid 1144 and name HG  ))
 )(
   (( segid "    " and resid 1161 and name HB2 ))
  OR 
   (( segid "    " and resid 1144 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9238 weight  0.10000E+01 volume  0.58900E+00 ppm1      1.303 ppm2      1.551
 ASSI (
   (( segid "    " and resid 1210 and name HA  ))
  OR 
   (( segid "    " and resid 1186 and name HA  ))
  OR 
   (( segid "    " and resid 1108 and name HA  ))
 )(
   (( segid "    " and resid 1210 and name HG2 ))
  OR 
   (( segid "    " and resid 1210 and name HG1 ))
  OR 
   (( segid "    " and resid 1186 and name HG1 ))
  OR 
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )
      2.700     2.700     0.000 peak  7972 weight  0.10000E+01 volume -0.31940E+01 ppm1      4.282 ppm2      1.583
 ASSI (
   (( segid "    " and resid 1162 and name HE2 ))
  OR 
   (( segid "    " and resid 1162 and name HE1 ))
  OR 
   (( segid "    " and resid 1148 and name HE2 ))
  OR 
   (( segid "    " and resid 1148 and name HE1 ))
 )(
   (( segid "    " and resid 1162 and name HD2 ))
  OR 
   (( segid "    " and resid 1162 and name HD1 ))
  OR 
   (( segid "    " and resid 1162 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
 )
      5.000     5.000     0.000 peak  9577 weight  0.10000E+01 volume  0.11840E+01 ppm1      3.010 ppm2      1.587
 ASSI (
   (( segid "    " and resid 1148 and name HE2 ))
  OR 
   (( segid "    " and resid 1148 and name HE1 ))
 )(
   (( segid "    " and resid 1149 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
 )
      5.000     5.000     0.000 peak  9578 weight  0.10000E+01 volume  0.53100E+00 ppm1      3.072 ppm2      1.587
 ASSI (
   (( segid "    " and resid 1205 and name HA  ))
 )(
   (( segid "    " and resid 1230 and name HB1 ))
  OR 
   (( segid "    " and resid 1206 and name HG2 ))
  OR 
   (( segid "    " and resid 1206 and name HG1 ))
 )
      6.000     6.000     0.000 peak  6539 weight  0.10000E+01 volume -0.39700E+00 ppm1      4.796 ppm2      1.595
 ASSI (
   (( segid "    " and resid 1188 and name HA  ))
 )(
   (( segid "    " and resid 1188 and name HD2 ))
  OR 
   (( segid "    " and resid 1188 and name HD1 ))
  OR 
   (( segid "    " and resid 1188 and name HB2 ))
 )
      3.300     3.300     0.000 peak  8279 weight  0.10000E+01 volume -0.24860E+01 ppm1      4.393 ppm2      1.604
 ASSI (
   (( segid "    " and resid 1148 and name HA  ))
 )(
   (( segid "    " and resid 1161 and name HB2 ))
  OR 
   (( segid "    " and resid 1149 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
  OR 
   (( segid "    " and resid 1144 and name HB2 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6885 weight  0.10000E+01 volume -0.12130E+01 ppm1      3.971 ppm2      1.604
 ASSI (
   (( segid "    " and resid 1203 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
 )(
   (( segid "    " and resid 1203 and name HG2 ))
  OR 
   (( segid "    " and resid 1149 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
 )
      2.700     2.700     0.000 peak  8131 weight  0.10000E+01 volume  0.71120E+01 ppm1      1.767 ppm2      1.605
 ASSI (
   (( segid "    " and resid 1139 and name HB1 ))
 )(
   (( segid "    " and resid 1139 and name HB2 ))
 )
      2.700     2.700     0.000 peak  9439 weight  0.10000E+01 volume  0.42190E+01 ppm1      1.923 ppm2      1.606
 ASSI (
   (( segid "    " and resid 1211 and name HB1 ))
  OR 
   (( segid "    " and resid 1208 and name HB1 ))
  OR 
   (( segid "    " and resid 1130 and name HA  ))
 )(
   (( segid "    " and resid 1226 and name HB2 ))
  OR 
   (( segid "    " and resid 1210 and name HG2 ))
  OR 
   (( segid "    " and resid 1210 and name HG1 ))
  OR 
   (( segid "    " and resid 1206 and name HG2 ))
  OR 
   (( segid "    " and resid 1206 and name HG1 ))
  OR 
   (( segid "    " and resid 1131 and name HB3 ))
  OR 
   (( segid "    " and resid 1131 and name HB2 ))
  OR 
   (( segid "    " and resid 1131 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7959 weight  0.10000E+01 volume -0.33900E+00 ppm1      3.943 ppm2      1.615
 ASSI (
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )(
   (( segid "    " and resid 1226 and name HG2 ))
  OR 
   (( segid "    " and resid 1224 and name HB2 ))
  OR 
   (( segid "    " and resid 1224 and name HB1 ))
  OR 
   (( segid "    " and resid 1215 and name HB2 ))
  OR 
   (( segid "    " and resid 1214 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9326 weight  0.10000E+01 volume  0.12410E+01 ppm1      1.137 ppm2      1.664
 ASSI (
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
 )(
   (( segid "    " and resid 1164 and name HB1 ))
  OR 
   (( segid "    " and resid 1162 and name HB1 ))
 )
      2.700     2.700     0.000 peak  9551 weight  0.10000E+01 volume  0.44450E+01 ppm1      0.659 ppm2      1.664
 ASSI (
   (( segid "    " and resid 1226 and name HD1 ))
 )(
   (( segid "    " and resid 1226 and name HG2 ))
  OR 
   (( segid "    " and resid 1226 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7282 weight  0.10000E+01 volume -0.60700E+00 ppm1      3.462 ppm2      1.668
 ASSI (
   (( segid "    " and resid 1210 and name HA  ))
  OR 
   (( segid "    " and resid 1186 and name HA  ))
  OR 
   (( segid "    " and resid 1108 and name HA  ))
 )(
   (( segid "    " and resid 1210 and name HB2 ))
  OR 
   (( segid "    " and resid 1186 and name HB2 ))
  OR 
   (( segid "    " and resid 1108 and name HB2 ))
 )
      2.700     2.700     0.000 peak  7971 weight  0.10000E+01 volume -0.36170E+01 ppm1      4.272 ppm2      1.699
 ASSI (
   (( segid "    " and resid 1114 and name HD2 ))
 )(
   (( segid "    " and resid 1160 and name HG2 ))
  OR 
   (( segid "    " and resid 1113 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9693 weight  0.10000E+01 volume -0.49300E+00 ppm1      3.629 ppm2      1.743
 ASSI (
   (( segid "    " and resid 1114 and name HD1 ))
 )(
   (( segid "    " and resid 1160 and name HG2 ))
  OR 
   (( segid "    " and resid 1113 and name HB2 ))
 )
      6.000     6.000     0.000 peak  9694 weight  0.10000E+01 volume -0.27300E+00 ppm1      3.805 ppm2      1.747
 ASSI (
   (( segid "    " and resid 1188 and name HA  ))
 )(
   (( segid "    " and resid 1188 and name HB1 ))
 )
      3.300     3.300     0.000 peak  8278 weight  0.10000E+01 volume -0.24460E+01 ppm1      4.395 ppm2      1.757
 ASSI (
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1220 and name HB2 ))
  OR 
   (( segid "    " and resid 1166 and name HB2 ))
  OR 
   (( segid "    " and resid 1145 and name HB2 ))
  OR 
   (( segid "    " and resid 1143 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7587 weight  0.10000E+01 volume  0.10270E+01 ppm1      0.658 ppm2      1.777
 ASSI (
   (( segid "    " and resid 1222 and name HE2 ))
  OR 
   (( segid "    " and resid 1222 and name HE1 ))
  OR 
   (( segid "    " and resid 1148 and name HE2 ))
  OR 
   (( segid "    " and resid 1148 and name HE1 ))
 )(
   (( segid "    " and resid 1222 and name HD2 ))
  OR 
   (( segid "    " and resid 1222 and name HD1 ))
  OR 
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
 )
      3.300     3.300     0.000 peak  9576 weight  0.10000E+01 volume  0.24140E+01 ppm1      3.006 ppm2      1.785
 ASSI (
   (( segid "    " and resid 1186 and name HA  ))
  OR 
   (( segid "    " and resid 1108 and name HA  ))
 )(
   (( segid "    " and resid 1186 and name HB1 ))
  OR 
   (( segid "    " and resid 1108 and name HB1 ))
 )
      2.700     2.700     0.000 peak  7970 weight  0.10000E+01 volume -0.43550E+01 ppm1      4.273 ppm2      1.806
 ASSI (
   (( segid "    " and resid 1148 and name HA  ))
 )(
   (( segid "    " and resid 1148 and name HB2 ))
 )
      3.300     3.300     0.000 peak  6886 weight  0.10000E+01 volume -0.17000E+01 ppm1      3.966 ppm2      1.818
 ASSI (
   (( segid "    " and resid 1143 and name HA  ))
 )(
   (( segid "    " and resid 1143 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7050 weight  0.10000E+01 volume -0.93000E+00 ppm1      4.679 ppm2      1.829
 ASSI (
   (( segid "    " and resid 1130 and name HD1 ))
  OR 
   (( segid "    " and resid 1114 and name HD2 ))
 )(
   (( segid "    " and resid 1130 and name HB2 ))
  OR 
   (( segid "    " and resid 1114 and name HB2 ))
  OR 
   (( segid "    " and resid 1113 and name HG2 ))
  OR 
   (( segid "    " and resid 1111 and name HB2 ))
  OR 
   (( segid "    " and resid 1108 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9692 weight  0.10000E+01 volume -0.11220E+01 ppm1      3.632 ppm2      1.844
 ASSI (
   (( segid "    " and resid 1114 and name HD1 ))
 )(
   (( segid "    " and resid 1160 and name HG1 ))
  OR 
   (( segid "    " and resid 1114 and name HB2 ))
  OR 
   (( segid "    " and resid 1113 and name HG2 ))
  OR 
   (( segid "    " and resid 1111 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9691 weight  0.10000E+01 volume -0.48000E+00 ppm1      3.805 ppm2      1.850
 ASSI (
   (( segid "    " and resid 1134 and name HA  ))
  OR 
   (( segid "    " and resid 1126 and name HA  ))
 )(
   (( segid "    " and resid 1135 and name HB1 ))
  OR 
   (( segid "    " and resid 1127 and name HB  ))
  OR 
   (( segid "    " and resid 1124 and name HB2 ))
  OR 
   (( segid "    " and resid 1111 and name HB2 ))
 )
      6.000     6.000     0.000 peak  3350 weight  0.10000E+01 volume -0.28400E+00 ppm1      4.390 ppm2      1.864
 ASSI (
   (( segid "    " and resid 1170 and name HA  ))
  OR 
   (( segid "    " and resid 1123 and name HA  ))
 )(
   (( segid "    " and resid 1172 and name HB1 ))
  OR 
   (( segid "    " and resid 1171 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HB1 ))
  OR 
   (( segid "    " and resid 1124 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG1 ))
  OR 
   (( segid "    " and resid 1124 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7092 weight  0.10000E+01 volume -0.11040E+01 ppm1      4.685 ppm2      1.879
 ASSI (
   (( segid "    " and resid 1168 and name HG23))
  OR 
   (( segid "    " and resid 1168 and name HG22))
  OR 
   (( segid "    " and resid 1168 and name HG21))
  OR 
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
 )(
   (( segid "    " and resid 1168 and name HB  ))
  OR 
   (( segid "    " and resid 1127 and name HB  ))
 )
      2.700     2.700     0.000 peak  9129 weight  0.10000E+01 volume  0.34000E+01 ppm1      0.807 ppm2      1.888
 ASSI (
   (( segid "    " and resid 1168 and name HG23))
  OR 
   (( segid "    " and resid 1168 and name HG22))
  OR 
   (( segid "    " and resid 1168 and name HG21))
  OR 
   (( segid "    " and resid 1168 and name HG13))
  OR 
   (( segid "    " and resid 1168 and name HG12))
  OR 
   (( segid "    " and resid 1168 and name HG11))
  OR 
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
  OR 
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )(
   (( segid "    " and resid 1168 and name HB  ))
  OR 
   (( segid "    " and resid 1127 and name HB  ))
 )
      3.300     3.300     0.000 peak  9128 weight  0.10000E+01 volume  0.28320E+01 ppm1      0.847 ppm2      1.888
 ASSI (
   (( segid "    " and resid 1210 and name HG2 ))
  OR 
   (( segid "    " and resid 1210 and name HG1 ))
 )(
   (( segid "    " and resid 1210 and name HB1 ))
 )
      2.700     2.700     0.000 peak  9391 weight  0.10000E+01 volume  0.35320E+01 ppm1      1.591 ppm2      1.930
 ASSI (
   (( segid "    " and resid 1222 and name HG1 ))
 )(
   (( segid "    " and resid 1222 and name HB2 ))
  OR 
   (( segid "    " and resid 1222 and name HB1 ))
 )
      3.300     3.300     0.000 peak  9315 weight  0.10000E+01 volume  0.24690E+01 ppm1      1.428 ppm2      1.945
 ASSI (
   (( segid "    " and resid 1222 and name HG2 ))
 )(
   (( segid "    " and resid 1222 and name HB2 ))
  OR 
   (( segid "    " and resid 1222 and name HB1 ))
 )
      2.700     2.700     0.000 peak  9314 weight  0.10000E+01 volume  0.31700E+01 ppm1      1.357 ppm2      1.946
 ASSI (
   (( segid "    " and resid 1145 and name HB2 ))
 )(
   (( segid "    " and resid 1145 and name HB1 ))
 )
      3.300     3.300     0.000 peak  8211 weight  0.10000E+01 volume  0.29040E+01 ppm1      1.789 ppm2      1.956
 ASSI (
   (( segid "    " and resid 1138 and name HB2 ))
  OR 
   (( segid "    " and resid 1128 and name HB2 ))
 )(
   (( segid "    " and resid 1141 and name HB1 ))
  OR 
   (( segid "    " and resid 1109 and name HB2 ))
 )
      6.000     6.000     0.000 peak  3002 weight  0.10000E+01 volume  0.20900E+00 ppm1      2.512 ppm2      2.061
 ASSI (
   (( segid "    " and resid 1226 and name HD1 ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7299 weight  0.10000E+01 volume -0.84400E+00 ppm1      3.467 ppm2      2.079
 ASSI (
   (( segid "    " and resid 1225 and name HA  ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1224 and name HG2 ))
 )
      5.000     5.000     0.000 peak  6639 weight  0.10000E+01 volume -0.91200E+00 ppm1      4.164 ppm2      2.081
 ASSI (
   (( segid "    " and resid 1226 and name HG2 ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
 )
      5.000     5.000     0.000 peak  9285 weight  0.10000E+01 volume  0.10750E+01 ppm1      1.686 ppm2      2.084
 ASSI (
   (( segid "    " and resid 1148 and name HE2 ))
  OR 
   (( segid "    " and resid 1148 and name HE1 ))
 )(
   (( segid "    " and resid 1148 and name HB1 ))
  OR 
   (( segid "    " and resid 1135 and name HG2 ))
 )
      5.000     5.000     0.000 peak  9579 weight  0.10000E+01 volume  0.43700E+00 ppm1      3.008 ppm2      2.101
 ASSI (
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
 )(
   (( segid "    " and resid 1148 and name HB1 ))
 )
      3.300     3.300     0.000 peak  8129 weight  0.10000E+01 volume  0.25420E+01 ppm1      1.766 ppm2      2.114
 ASSI (
   (( segid "    " and resid 1186 and name HB1 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
 )(
   (( segid "    " and resid 1186 and name HD1 ))
  OR 
   (( segid "    " and resid 1148 and name HB1 ))
 )
      2.700     2.700     0.000 peak  8305 weight  0.10000E+01 volume  0.46720E+01 ppm1      1.825 ppm2      2.117
 ASSI (
   (( segid "    " and resid 1112 and name HD1 ))
 )(
   (( segid "    " and resid 1114 and name HB1 ))
  OR 
   (( segid "    " and resid 1113 and name HB1 ))
  OR 
   (( segid "    " and resid 1111 and name HG2 ))
  OR 
   (( segid "    " and resid 1111 and name HG1 ))
 )
      6.000     6.000     0.000 peak  7302 weight  0.10000E+01 volume -0.31800E+00 ppm1      3.540 ppm2      2.213
 ASSI (
   (( segid "    " and resid 1160 and name HG1 ))
  OR 
   (( segid "    " and resid 1113 and name HG2 ))
 )(
   (( segid "    " and resid 1114 and name HB1 ))
  OR 
   (( segid "    " and resid 1113 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9228 weight  0.10000E+01 volume  0.10100E+01 ppm1      1.863 ppm2      2.236
 ASSI (
   (( segid "    " and resid 1226 and name HD1 ))
  OR 
   (( segid "    " and resid 1112 and name HD2 ))
 )(
   (( segid "    " and resid 1226 and name HB1 ))
  OR 
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
  OR 
   (( segid "    " and resid 1111 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7298 weight  0.10000E+01 volume -0.42000E+00 ppm1      3.470 ppm2      2.246
 ASSI (
   (( segid "    " and resid 1222 and name HG2 ))
  OR 
   (( segid "    " and resid 1186 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
 )(
   (( segid "    " and resid 1224 and name HG1 ))
  OR 
   (( segid "    " and resid 1187 and name HG2 ))
  OR 
   (( segid "    " and resid 1175 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG1 ))
 )
      6.000     6.000     0.000 peak  9316 weight  0.10000E+01 volume  0.36800E+00 ppm1      1.359 ppm2      2.250
 ASSI (
   (( segid "    " and resid 1225 and name HA  ))
 )(
   (( segid "    " and resid 1226 and name HB1 ))
  OR 
   (( segid "    " and resid 1224 and name HG1 ))
  OR 
   (( segid "    " and resid 1214 and name HB1 ))
  OR 
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6638 weight  0.10000E+01 volume -0.10220E+01 ppm1      4.164 ppm2      2.250
 ASSI (
   (( segid "    " and resid 1226 and name HG2 ))
  OR 
   (( segid "    " and resid 1214 and name HG  ))
 )(
   (( segid "    " and resid 1226 and name HB1 ))
  OR 
   (( segid "    " and resid 1214 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9416 weight  0.10000E+01 volume  0.40100E+00 ppm1      1.665 ppm2      2.257
 ASSI (
   (( segid "    " and resid 1226 and name HB2 ))
 )(
   (( segid "    " and resid 1226 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7413 weight  0.10000E+01 volume  0.98000E+00 ppm1      1.626 ppm2      2.262
 ASSI (
   (( segid "    " and resid 1130 and name HD1 ))
  OR 
   (( segid "    " and resid 1114 and name HD2 ))
 )(
   (( segid "    " and resid 1130 and name HB1 ))
  OR 
   (( segid "    " and resid 1113 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9651 weight  0.10000E+01 volume -0.66300E+00 ppm1      3.649 ppm2      2.274
 ASSI (
   (( segid "    " and resid 1139 and name HB2 ))
 )(
   (( segid "    " and resid 1139 and name HG1 ))
 )
      5.000     5.000     0.000 peak  9438 weight  0.10000E+01 volume  0.69400E+00 ppm1      1.611 ppm2      2.288
 ASSI (
   (( segid "    " and resid 1177 and name HB2 ))
  OR 
   (( segid "    " and resid 1154 and name HB2 ))
 )(
   (( segid "    " and resid 1226 and name HB1 ))
  OR 
   (( segid "    " and resid 1175 and name HG2 ))
  OR 
   (( segid "    " and resid 1175 and name HG1 ))
  OR 
   (( segid "    " and resid 1156 and name HG2 ))
  OR 
   (( segid "    " and resid 1156 and name HG1 ))
  OR 
   (( segid "    " and resid 1152 and name HB1 ))
  OR 
   (( segid "    " and resid 1130 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8818 weight  0.10000E+01 volume  0.23000E+00 ppm1      2.698 ppm2      2.308
 ASSI (
   (( segid "    " and resid 1187 and name HB2 ))
  OR 
   (( segid "    " and resid 1187 and name HB1 ))
  OR 
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )(
   (( segid "    " and resid 1187 and name HG1 ))
  OR 
   (( segid "    " and resid 1175 and name HG2 ))
  OR 
   (( segid "    " and resid 1175 and name HG1 ))
 )
      2.700     2.700     0.000 peak   375 weight  0.10000E+01 volume  0.37930E+01 ppm1      2.017 ppm2      2.326
 ASSI (
   (( segid "    " and resid 1226 and name HD1 ))
  OR 
   (( segid "    " and resid 1112 and name HD2 ))
 )(
   (( segid "    " and resid 1225 and name HB2 ))
  OR 
   (( segid "    " and resid 1225 and name HB1 ))
  OR 
   (( segid "    " and resid 1128 and name HB2 ))
  OR 
   (( segid "    " and resid 1111 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7278 weight  0.10000E+01 volume -0.86800E+00 ppm1      3.467 ppm2      2.519
 ASSI (
   (( segid "    " and resid 1176 and name HB2 ))
 )(
   (( segid "    " and resid 1176 and name HB1 ))
 )
      2.700     2.700     0.000 peak  8497 weight  0.10000E+01 volume  0.10522E+02 ppm1      2.581 ppm2      2.643
 ASSI (
   (( segid "    " and resid 1205 and name HE2 ))
  OR 
   (( segid "    " and resid 1205 and name HE1 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )(
   (( segid "    " and resid 1228 and name HB2 ))
  OR 
   (( segid "    " and resid 1205 and name HB2 ))
  OR 
   (( segid "    " and resid 1201 and name HB2 ))
  OR 
   (( segid "    " and resid 1177 and name HB2 ))
  OR 
   (( segid "    " and resid 1167 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8112 weight  0.10000E+01 volume -0.25400E+00 ppm1      6.690 ppm2      2.675
 ASSI (
   (( segid "    " and resid 1201 and name HB1 ))
 )(
   (( segid "    " and resid 1228 and name HB2 ))
  OR 
   (( segid "    " and resid 1205 and name HB2 ))
  OR 
   (( segid "    " and resid 1201 and name HB2 ))
 )
      3.300     3.300     0.000 peak  8149 weight  0.10000E+01 volume  0.23620E+01 ppm1      3.020 ppm2      2.679
 ASSI (
   (( segid "    " and resid 1205 and name HA  ))
  OR 
   (( segid "    " and resid 1167 and name HA  ))
 )(
   (( segid "    " and resid 1205 and name HB2 ))
  OR 
   (( segid "    " and resid 1167 and name HB2 ))
 )
      3.300     3.300     0.000 peak  6485 weight  0.10000E+01 volume -0.18780E+01 ppm1      4.793 ppm2      2.686
 ASSI (
   (( segid "    " and resid 1140 and name HB2 ))
 )(
   (( segid "    " and resid 1140 and name HB1 ))
 )
      2.700     2.700     0.000 peak  9023 weight  0.10000E+01 volume  0.98790E+01 ppm1      2.674 ppm2      2.816
 ASSI (
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
 )(
   (( segid "    " and resid 1174 and name HG1 ))
 )
      6.000     6.000     0.000 peak  8640 weight  0.10000E+01 volume  0.39200E+00 ppm1      2.232 ppm2      2.862
 ASSI (
   (( segid "    " and resid 1188 and name HD2 ))
  OR 
   (( segid "    " and resid 1188 and name HD1 ))
 )(
   (( segid "    " and resid 1188 and name HE2 ))
  OR 
   (( segid "    " and resid 1188 and name HE1 ))
 )
      3.300     3.300     0.000 peak  9629 weight  0.10000E+01 volume  0.21760E+01 ppm1      1.587 ppm2      2.902
 ASSI (
   (( segid "    " and resid 1186 and name HA  ))
  OR 
   (( segid "    " and resid 1108 and name HA  ))
 )(
   (( segid "    " and resid 1186 and name HE2 ))
  OR 
   (( segid "    " and resid 1186 and name HE1 ))
  OR 
   (( segid "    " and resid 1128 and name HB1 ))
  OR 
   (( segid "    " and resid 1109 and name HB1 ))
  OR 
   (( segid "    " and resid 1108 and name HE2 ))
  OR 
   (( segid "    " and resid 1108 and name HE1 ))
 )
      6.000     6.000     0.000 peak  7976 weight  0.10000E+01 volume -0.38200E+00 ppm1      4.277 ppm2      2.908
 ASSI (
   (( segid "    " and resid 1186 and name HB1 ))
  OR 
   (( segid "    " and resid 1108 and name HB1 ))
 )(
   (( segid "    " and resid 1186 and name HE2 ))
  OR 
   (( segid "    " and resid 1186 and name HE1 ))
  OR 
   (( segid "    " and resid 1128 and name HB1 ))
  OR 
   (( segid "    " and resid 1109 and name HB1 ))
  OR 
   (( segid "    " and resid 1108 and name HE2 ))
  OR 
   (( segid "    " and resid 1108 and name HE1 ))
 )
      6.000     6.000     0.000 peak  8298 weight  0.10000E+01 volume  0.29600E+00 ppm1      1.801 ppm2      2.922
 ASSI (
   (( segid "    " and resid 1188 and name HG2 ))
 )(
   (( segid "    " and resid 1188 and name HE2 ))
  OR 
   (( segid "    " and resid 1188 and name HE1 ))
 )
      6.000     6.000     0.000 peak  9321 weight  0.10000E+01 volume  0.34500E+00 ppm1      1.294 ppm2      2.942
 ASSI (
   (( segid "    " and resid 1188 and name HG1 ))
  OR 
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
 )(
   (( segid "    " and resid 1188 and name HE2 ))
  OR 
   (( segid "    " and resid 1188 and name HE1 ))
  OR 
   (( segid "    " and resid 1162 and name HE2 ))
  OR 
   (( segid "    " and resid 1162 and name HE1 ))
 )
      3.300     3.300     0.000 peak  9320 weight  0.10000E+01 volume  0.18230E+01 ppm1      1.364 ppm2      2.950
 ASSI (
   (( segid "    " and resid 1138 and name HB2 ))
  OR 
   (( segid "    " and resid 1128 and name HB2 ))
 )(
   (( segid "    " and resid 1138 and name HB1 ))
  OR 
   (( segid "    " and resid 1128 and name HB1 ))
 )
      3.300     3.300     0.000 peak  8986 weight  0.10000E+01 volume  0.16500E+01 ppm1      2.539 ppm2      2.971
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1128 and name HB1 ))
  OR 
   (( segid "    " and resid 1124 and name HD2 ))
  OR 
   (( segid "    " and resid 1113 and name HD2 ))
  OR 
   (( segid "    " and resid 1113 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7077 weight  0.10000E+01 volume  0.42200E+00 ppm1      0.500 ppm2      2.975
 ASSI (
   (( segid "    " and resid 1124 and name HB1 ))
 )(
   (( segid "    " and resid 1124 and name HD2 ))
 )
      6.000     6.000     0.000 peak  9151 weight  0.10000E+01 volume  0.30100E+00 ppm1      2.125 ppm2      2.978
 ASSI (
   (( segid "    " and resid 1124 and name HB2 ))
 )(
   (( segid "    " and resid 1124 and name HD2 ))
 )
      6.000     6.000     0.000 peak  9150 weight  0.10000E+01 volume  0.37800E+00 ppm1      1.900 ppm2      2.979
 ASSI (
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
 )(
   (( segid "    " and resid 1148 and name HE2 ))
  OR 
   (( segid "    " and resid 1148 and name HE1 ))
 )
      5.000     5.000     0.000 peak  8128 weight  0.10000E+01 volume  0.14330E+01 ppm1      1.766 ppm2      3.036
 ASSI (
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1220 and name HB1 ))
  OR 
   (( segid "    " and resid 1219 and name HB2 ))
  OR 
   (( segid "    " and resid 1218 and name HB1 ))
  OR 
   (( segid "    " and resid 1192 and name HD2 ))
  OR 
   (( segid "    " and resid 1192 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9637 weight  0.10000E+01 volume  0.40800E+00 ppm1      0.659 ppm2      3.118
 ASSI (
   (( segid "    " and resid 1149 and name HB2 ))
 )(
   (( segid "    " and resid 1149 and name HD2 ))
  OR 
   (( segid "    " and resid 1149 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8904 weight  0.10000E+01 volume  0.60400E+00 ppm1      1.622 ppm2      3.137
 ASSI (
   (( segid "    " and resid 1220 and name HA  ))
 )(
   (( segid "    " and resid 1220 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7571 weight  0.10000E+01 volume -0.43700E+00 ppm1      4.483 ppm2      3.137
 ASSI (
   (( segid "    " and resid 1149 and name HB1 ))
  OR 
   (( segid "    " and resid 1135 and name HB2 ))
 )(
   (( segid "    " and resid 1149 and name HD2 ))
  OR 
   (( segid "    " and resid 1149 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8303 weight  0.10000E+01 volume  0.10910E+01 ppm1      1.714 ppm2      3.141
 ASSI (
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )(
   (( segid "    " and resid 1199 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9638 weight  0.10000E+01 volume  0.40000E+00 ppm1      0.681 ppm2      3.146
 ASSI (
   (( segid "    " and resid 1192 and name HB1 ))
  OR 
   (( segid "    " and resid 1153 and name HB2 ))
  OR 
   (( segid "    " and resid 1153 and name HB1 ))
 )(
   (( segid "    " and resid 1192 and name HD2 ))
  OR 
   (( segid "    " and resid 1192 and name HD1 ))
  OR 
   (( segid "    " and resid 1153 and name HD2 ))
  OR 
   (( segid "    " and resid 1153 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8840 weight  0.10000E+01 volume  0.14400E+01 ppm1      1.716 ppm2      3.158
 ASSI (
   (( segid "    " and resid 1181 and name HA  ))
 )(
   (( segid "    " and resid 1199 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6962 weight  0.10000E+01 volume -0.39400E+00 ppm1      4.359 ppm2      3.160
 ASSI (
   (( segid "    " and resid 1210 and name HG2 ))
  OR 
   (( segid "    " and resid 1210 and name HG1 ))
  OR 
   (( segid "    " and resid 1153 and name HG1 ))
 )(
   (( segid "    " and resid 1210 and name HD2 ))
  OR 
   (( segid "    " and resid 1210 and name HD1 ))
  OR 
   (( segid "    " and resid 1153 and name HD2 ))
  OR 
   (( segid "    " and resid 1153 and name HD1 ))
 )
      2.700     2.700     0.000 peak  9386 weight  0.10000E+01 volume  0.32210E+01 ppm1      1.585 ppm2      3.162
 ASSI (
   (( segid "    " and resid 1209 and name HB2 ))
  OR 
   (( segid "    " and resid 1209 and name HB1 ))
  OR 
   (( segid "    " and resid 1184 and name HA  ))
 )(
   (( segid "    " and resid 1210 and name HD2 ))
  OR 
   (( segid "    " and resid 1210 and name HD1 ))
  OR 
   (( segid "    " and resid 1206 and name HD1 ))
  OR 
   (( segid "    " and resid 1199 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8004 weight  0.10000E+01 volume -0.31100E+00 ppm1      3.980 ppm2      3.164
 ASSI (
   (( segid "    " and resid 1210 and name HA  ))
  OR 
   (( segid "    " and resid 1108 and name HA  ))
 )(
   (( segid "    " and resid 1210 and name HD2 ))
  OR 
   (( segid "    " and resid 1210 and name HD1 ))
  OR 
   (( segid "    " and resid 1106 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7975 weight  0.10000E+01 volume -0.68400E+00 ppm1      4.284 ppm2      3.165
 ASSI (
   (( segid "    " and resid 1203 and name HB1 ))
  OR 
   (( segid "    " and resid 1171 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HB1 ))
 )(
   (( segid "    " and resid 1203 and name HD2 ))
  OR 
   (( segid "    " and resid 1203 and name HD1 ))
  OR 
   (( segid "    " and resid 1171 and name HD2 ))
  OR 
   (( segid "    " and resid 1171 and name HD1 ))
 )
      3.300     3.300     0.000 peak  8125 weight  0.10000E+01 volume  0.22440E+01 ppm1      1.861 ppm2      3.231
 ASSI (
   (( segid "    " and resid 1203 and name HB2 ))
 )(
   (( segid "    " and resid 1203 and name HD2 ))
  OR 
   (( segid "    " and resid 1203 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8124 weight  0.10000E+01 volume  0.10490E+01 ppm1      1.766 ppm2      3.234
 ASSI (
   (( segid "    " and resid 1184 and name HA  ))
 )(
   (( segid "    " and resid 1183 and name HB2 ))
  OR 
   (( segid "    " and resid 1183 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8005 weight  0.10000E+01 volume -0.28100E+00 ppm1      3.981 ppm2      3.260
 ASSI (
   (( segid "    " and resid 1113 and name HG1 ))
 )(
   (( segid "    " and resid 1112 and name HA  ))
 )
      6.000     6.000     0.000 peak  9488 weight  0.10000E+01 volume  0.25000E+00 ppm1      1.977 ppm2      3.288
 ASSI (
   (( segid "    " and resid 1113 and name HG2 ))
 )(
   (( segid "    " and resid 1112 and name HA  ))
 )
      6.000     6.000     0.000 peak  9487 weight  0.10000E+01 volume  0.19200E+00 ppm1      1.869 ppm2      3.288
 ASSI (
   (( segid "    " and resid 1109 and name HA  ))
 )(
   (( segid "    " and resid 1155 and name HA2 ))
 )
      6.000     6.000     0.000 peak  7161 weight  0.10000E+01 volume -0.32200E+00 ppm1      4.537 ppm2      3.306
 ASSI (
   (( segid "    " and resid 1130 and name HD1 ))
 )(
   (( segid "    " and resid 1130 and name HD2 ))
 )
      2.700     2.700     0.000 peak  9649 weight  0.10000E+01 volume -0.39120E+01 ppm1      3.659 ppm2      3.405
 ASSI (
   (( segid "    " and resid 1130 and name HB2 ))
 )(
   (( segid "    " and resid 1130 and name HD2 ))
 )
      6.000     6.000     0.000 peak  9093 weight  0.10000E+01 volume  0.22800E+00 ppm1      1.889 ppm2      3.419
 ASSI (
   (( segid "    " and resid 1108 and name HA  ))
 )(
   (( segid "    " and resid 1130 and name HD2 ))
 )
      5.000     5.000     0.000 peak  6716 weight  0.10000E+01 volume -0.88500E+00 ppm1      4.280 ppm2      3.422
 ASSI (
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )(
   (( segid "    " and resid 1142 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9635 weight  0.10000E+01 volume -0.14500E+00 ppm1      6.675 ppm2      3.449
 ASSI (
   (( segid "    " and resid 1112 and name HD1 ))
 )(
   (( segid "    " and resid 1112 and name HD2 ))
 )
      2.700     2.700     0.000 peak  9696 weight  0.10000E+01 volume -0.36150E+01 ppm1      3.538 ppm2      3.449
 ASSI (
   (( segid "    " and resid 1109 and name HA  ))
  OR 
   (( segid "    " and resid 1106 and name HA  ))
 )(
   (( segid "    " and resid 1157 and name HB1 ))
  OR 
   (( segid "    " and resid 1112 and name HD2 ))
  OR 
   (( segid "    " and resid 1107 and name HA2 ))
 )
      6.000     6.000     0.000 peak  7162 weight  0.10000E+01 volume -0.34200E+00 ppm1      4.537 ppm2      3.492
 ASSI (
   (( segid "    " and resid 1219 and name HZ3 ))
 )(
   (( segid "    " and resid 1194 and name HA2 ))
 )
      6.000     6.000     0.000 peak  6821 weight  0.10000E+01 volume -0.15000E+00 ppm1      7.061 ppm2      3.588
 ASSI (
   (( segid "    " and resid 1114 and name HD1 ))
 )(
   (( segid "    " and resid 1114 and name HD2 ))
 )
      2.700     2.700     0.000 peak  9689 weight  0.10000E+01 volume -0.32130E+01 ppm1      3.805 ppm2      3.633
 ASSI (
   (( segid "    " and resid 1209 and name HB2 ))
  OR 
   (( segid "    " and resid 1209 and name HB1 ))
 )(
   (( segid "    " and resid 1208 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8003 weight  0.10000E+01 volume -0.52300E+00 ppm1      3.981 ppm2      3.636
 ASSI (
   (( segid "    " and resid 1130 and name HB1 ))
  OR 
   (( segid "    " and resid 1113 and name HB1 ))
 )(
   (( segid "    " and resid 1160 and name HD2 ))
  OR 
   (( segid "    " and resid 1130 and name HD1 ))
  OR 
   (( segid "    " and resid 1114 and name HD2 ))
 )
      6.000     6.000     0.000 peak  9092 weight  0.10000E+01 volume  0.37900E+00 ppm1      2.283 ppm2      3.656
 ASSI (
   (( segid "    " and resid 1130 and name HB2 ))
 )(
   (( segid "    " and resid 1130 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9089 weight  0.10000E+01 volume  0.32400E+00 ppm1      1.889 ppm2      3.658
 ASSI (
   (( segid "    " and resid 1205 and name HA  ))
  OR 
   (( segid "    " and resid 1167 and name HA  ))
 )(
   (( segid "    " and resid 1230 and name HA  ))
  OR 
   (( segid "    " and resid 1228 and name HB1 ))
  OR 
   (( segid "    " and resid 1221 and name HA2 ))
 )
      3.300     3.300     0.000 peak  6483 weight  0.10000E+01 volume -0.18260E+01 ppm1      4.794 ppm2      3.728
 ASSI (
   (( segid "    " and resid 1209 and name HB2 ))
  OR 
   (( segid "    " and resid 1209 and name HB1 ))
  OR 
   (( segid "    " and resid 1184 and name HA  ))
 )(
   (( segid "    " and resid 1211 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HA  ))
 )
      5.000     5.000     0.000 peak  8002 weight  0.10000E+01 volume -0.59400E+00 ppm1      3.980 ppm2      3.755
 ASSI (
   (( segid "    " and resid 1198 and name HB1 ))
  OR 
   (( segid "    " and resid 1130 and name HB2 ))
 )(
   (( segid "    " and resid 1182 and name HA  ))
  OR 
   (( segid "    " and resid 1131 and name HA  ))
  OR 
   (( segid "    " and resid 1107 and name HA1 ))
 )
      6.000     6.000     0.000 peak  9090 weight  0.10000E+01 volume  0.26400E+00 ppm1      1.892 ppm2      3.784
 ASSI (
   (( segid "    " and resid 1181 and name HA  ))
  OR 
   (( segid "    " and resid 1159 and name HA  ))
  OR 
   (( segid "    " and resid 1116 and name HA  ))
 )(
   (( segid "    " and resid 1182 and name HA  ))
  OR 
   (( segid "    " and resid 1118 and name HA2 ))
  OR 
   (( segid "    " and resid 1117 and name HA  ))
  OR 
   (( segid "    " and resid 1114 and name HD1 ))
 )
      5.000     5.000     0.000 peak  6956 weight  0.10000E+01 volume -0.99600E+00 ppm1      4.358 ppm2      3.791
 ASSI (
   (( segid "    " and resid 1113 and name HB1 ))
 )(
   (( segid "    " and resid 1114 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9229 weight  0.10000E+01 volume  0.35100E+00 ppm1      2.234 ppm2      3.805
 ASSI (
   (( segid "    " and resid 1130 and name HB1 ))
 )(
   (( segid "    " and resid 1131 and name HA  ))
  OR 
   (( segid "    " and resid 1107 and name HA1 ))
 )
      6.000     6.000     0.000 peak  9091 weight  0.10000E+01 volume  0.36300E+00 ppm1      2.290 ppm2      3.806
 ASSI (
   (( segid "    " and resid 1109 and name HA  ))
  OR 
   (( segid "    " and resid 1106 and name HA  ))
 )(
   (( segid "    " and resid 1155 and name HA1 ))
  OR 
   (( segid "    " and resid 1107 and name HA1 ))
 )
      5.000     5.000     0.000 peak  7164 weight  0.10000E+01 volume -0.59400E+00 ppm1      4.534 ppm2      3.835
 ASSI (
   (( segid "    " and resid 1109 and name HA  ))
 )(
   (( segid "    " and resid 1155 and name HA1 ))
  OR 
   (( segid "    " and resid 1110 and name HA2 ))
 )
      5.000     5.000     0.000 peak  7163 weight  0.10000E+01 volume -0.60100E+00 ppm1      4.540 ppm2      3.934
 ASSI (
   (( segid "    " and resid 1203 and name HB1 ))
  OR 
   (( segid "    " and resid 1171 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HB1 ))
 )(
   (( segid "    " and resid 1202 and name HA  ))
  OR 
   (( segid "    " and resid 1178 and name HA  ))
  OR 
   (( segid "    " and resid 1175 and name HA  ))
  OR 
   (( segid "    " and resid 1170 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8117 weight  0.10000E+01 volume  0.46300E+00 ppm1      1.856 ppm2      3.953
 ASSI (
   (( segid "    " and resid 1202 and name HE2 ))
  OR 
   (( segid "    " and resid 1202 and name HE1 ))
 )(
   (( segid "    " and resid 1202 and name HA  ))
  OR 
   (( segid "    " and resid 1178 and name HA  ))
  OR 
   (( segid "    " and resid 1175 and name HA  ))
 )
      6.000     6.000     0.000 peak  2907 weight  0.10000E+01 volume  0.28700E+00 ppm1      2.836 ppm2      3.958
 ASSI (
   (( segid "    " and resid 1203 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
 )(
   (( segid "    " and resid 1202 and name HA  ))
  OR 
   (( segid "    " and resid 1148 and name HA  ))
 )
      5.000     5.000     0.000 peak  8123 weight  0.10000E+01 volume  0.42900E+00 ppm1      1.766 ppm2      3.960
 ASSI (
   (( segid "    " and resid 1130 and name HD1 ))
  OR 
   (( segid "    " and resid 1114 and name HD2 ))
 )(
   (( segid "    " and resid 1160 and name HD1 ))
  OR 
   (( segid "    " and resid 1132 and name HB2 ))
  OR 
   (( segid "    " and resid 1130 and name HA  ))
 )
      5.000     5.000     0.000 peak  9695 weight  0.10000E+01 volume -0.51400E+00 ppm1      3.633 ppm2      3.998
 ASSI (
   (( segid "    " and resid 1215 and name HB1 ))
  OR 
   (( segid "    " and resid 1198 and name HB2 ))
 )(
   (( segid "    " and resid 1216 and name HB  ))
  OR 
   (( segid "    " and resid 1197 and name HA  ))
 )
      6.000     6.000     0.000 peak  8210 weight  0.10000E+01 volume  0.16500E+00 ppm1      1.788 ppm2      4.037
 ASSI (
   (( segid "    " and resid 1205 and name HA  ))
  OR 
   (( segid "    " and resid 1167 and name HA  ))
 )(
   (( segid "    " and resid 1231 and name HA  ))
  OR 
   (( segid "    " and resid 1221 and name HA1 ))
 )
      5.000     5.000     0.000 peak  6482 weight  0.10000E+01 volume -0.55400E+00 ppm1      4.792 ppm2      4.059
 ASSI (
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
  OR 
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )(
   (( segid "    " and resid 1231 and name HA  ))
  OR 
   (( segid "    " and resid 1165 and name HA  ))
  OR 
   (( segid "    " and resid 1139 and name HA  ))
 )
      6.000     6.000     0.000 peak  8089 weight  0.10000E+01 volume -0.34700E+00 ppm1      6.670 ppm2      4.063
 ASSI (
   (( segid "    " and resid 1204 and name HA2 ))
 )(
   (( segid "    " and resid 1203 and name HA  ))
 )
      5.000     5.000     0.000 peak  8115 weight  0.10000E+01 volume -0.11000E+01 ppm1      3.592 ppm2      4.099
 ASSI (
   (( segid "    " and resid 1203 and name HB1 ))
  OR 
   (( segid "    " and resid 1171 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HB1 ))
 )(
   (( segid "    " and resid 1203 and name HA  ))
  OR 
   (( segid "    " and resid 1171 and name HA  ))
 )
      3.300     3.300     0.000 peak  8116 weight  0.10000E+01 volume  0.21860E+01 ppm1      1.860 ppm2      4.101
 ASSI (
   (( segid "    " and resid 1187 and name HG2 ))
  OR 
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
 )(
   (( segid "    " and resid 1187 and name HA  ))
  OR 
   (( segid "    " and resid 1171 and name HA  ))
 )
      5.000     5.000     0.000 peak  8577 weight  0.10000E+01 volume  0.69400E+00 ppm1      2.228 ppm2      4.105
 ASSI (
   (( segid "    " and resid 1226 and name HG2 ))
  OR 
   (( segid "    " and resid 1214 and name HG  ))
 )(
   (( segid "    " and resid 1225 and name HA  ))
  OR 
   (( segid "    " and resid 1214 and name HA  ))
 )
      5.000     5.000     0.000 peak  6936 weight  0.10000E+01 volume  0.56900E+00 ppm1      1.696 ppm2      4.159
 ASSI (
   (( segid "    " and resid 1226 and name HG1 ))
 )(
   (( segid "    " and resid 1225 and name HA  ))
  OR 
   (( segid "    " and resid 1214 and name HA  ))
 )
      5.000     5.000     0.000 peak  7923 weight  0.10000E+01 volume  0.52800E+00 ppm1      2.080 ppm2      4.165
 ASSI (
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )(
   (( segid "    " and resid 1169 and name HA  ))
  OR 
   (( segid "    " and resid 1168 and name HA  ))
 )
      6.000     6.000     0.000 peak  3242 weight  0.10000E+01 volume -0.14400E+00 ppm1      6.841 ppm2      4.204
 ASSI (
   (( segid "    " and resid 1188 and name HB1 ))
  OR 
   (( segid "    " and resid 1186 and name HB2 ))
 )(
   (( segid "    " and resid 1186 and name HA  ))
  OR 
   (( segid "    " and resid 1185 and name HA  ))
 )
      5.000     5.000     0.000 peak  8308 weight  0.10000E+01 volume  0.11150E+01 ppm1      1.729 ppm2      4.266
 ASSI (
   (( segid "    " and resid 1186 and name HB1 ))
  OR 
   (( segid "    " and resid 1108 and name HB1 ))
 )(
   (( segid "    " and resid 1186 and name HA  ))
  OR 
   (( segid "    " and resid 1108 and name HA  ))
 )
      3.300     3.300     0.000 peak  8307 weight  0.10000E+01 volume  0.16130E+01 ppm1      1.816 ppm2      4.266
 ASSI (
   (( segid "    " and resid 1130 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG1 ))
 )(
   (( segid "    " and resid 1124 and name HA  ))
  OR 
   (( segid "    " and resid 1108 and name HA  ))
 )
      5.000     5.000     0.000 peak  9490 weight  0.10000E+01 volume  0.67500E+00 ppm1      1.892 ppm2      4.268
 ASSI (
   (( segid "    " and resid 1209 and name HB2 ))
  OR 
   (( segid "    " and resid 1209 and name HB1 ))
  OR 
   (( segid "    " and resid 1184 and name HA  ))
 )(
   (( segid "    " and resid 1209 and name HA  ))
  OR 
   (( segid "    " and resid 1185 and name HA  ))
 )
      2.700     2.700     0.000 peak  6849 weight  0.10000E+01 volume -0.40540E+01 ppm1      3.985 ppm2      4.275
 ASSI (
   (( segid "    " and resid 1108 and name HB2 ))
 )(
   (( segid "    " and resid 1108 and name HA  ))
 )
      5.000     5.000     0.000 peak  8309 weight  0.10000E+01 volume  0.68800E+00 ppm1      1.674 ppm2      4.276
 ASSI (
   (( segid "    " and resid 1210 and name HG2 ))
  OR 
   (( segid "    " and resid 1210 and name HG1 ))
  OR 
   (( segid "    " and resid 1125 and name HG  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )(
   (( segid "    " and resid 1210 and name HA  ))
  OR 
   (( segid "    " and resid 1209 and name HA  ))
  OR 
   (( segid "    " and resid 1124 and name HA  ))
 )
      5.000     5.000     0.000 peak  9335 weight  0.10000E+01 volume  0.15060E+01 ppm1      1.592 ppm2      4.290
 ASSI (
   (( segid "    " and resid 1163 and name HB2 ))
  OR 
   (( segid "    " and resid 1116 and name HB2 ))
  OR 
   (( segid "    " and resid 1116 and name HB1 ))
 )(
   (( segid "    " and resid 1164 and name HA  ))
  OR 
   (( segid "    " and resid 1116 and name HA  ))
 )
      3.300     3.300     0.000 peak  9208 weight  0.10000E+01 volume  0.21300E+01 ppm1      2.504 ppm2      4.358
 ASSI (
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )(
   (( segid "    " and resid 1164 and name HA  ))
  OR 
   (( segid "    " and resid 1142 and name HA  ))
  OR 
   (( segid "    " and resid 1140 and name HA  ))
 )
      6.000     6.000     0.000 peak  9634 weight  0.10000E+01 volume -0.10200E+00 ppm1      6.668 ppm2      4.380
 ASSI (
   (( segid "    " and resid 1220 and name HB2 ))
 )(
   (( segid "    " and resid 1220 and name HA  ))
 )
      6.000     6.000     0.000 peak  7586 weight  0.10000E+01 volume  0.24400E+00 ppm1      1.775 ppm2      4.487
 ASSI (
   (( segid "    " and resid 1153 and name HB2 ))
  OR 
   (( segid "    " and resid 1153 and name HB1 ))
 )(
   (( segid "    " and resid 1153 and name HA  ))
 )
      3.300     3.300     0.000 peak  8841 weight  0.10000E+01 volume  0.18560E+01 ppm1      1.717 ppm2      4.511
 ASSI (
   (( segid "    " and resid 1201 and name HB2 ))
 )(
   (( segid "    " and resid 1227 and name HA  ))
  OR 
   (( segid "    " and resid 1200 and name HA  ))
 )
      6.000     6.000     0.000 peak  8152 weight  0.10000E+01 volume  0.28700E+00 ppm1      2.670 ppm2      4.566
 ASSI (
   (( segid "    " and resid 1114 and name HD2 ))
 )(
   (( segid "    " and resid 1113 and name HA  ))
 )
      2.700     2.700     0.000 peak  9657 weight  0.10000E+01 volume -0.31240E+01 ppm1      3.631 ppm2      4.595
 ASSI (
   (( segid "    " and resid 1114 and name HD1 ))
 )(
   (( segid "    " and resid 1113 and name HA  ))
 )
      3.300     3.300     0.000 peak  7215 weight  0.10000E+01 volume -0.19670E+01 ppm1      3.805 ppm2      4.595
 ASSI (
   (( segid "    " and resid 1156 and name HB1 ))
 )(
   (( segid "    " and resid 1156 and name HA  ))
 )
      5.000     5.000     0.000 peak  8910 weight  0.10000E+01 volume  0.89800E+00 ppm1      2.104 ppm2      4.606
 ASSI (
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
  OR 
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )(
   (( segid "    " and resid 1219 and name HA  ))
  OR 
   (( segid "    " and resid 1218 and name HA  ))
  OR 
   (( segid "    " and resid 1150 and name HA  ))
 )
      3.300     3.300     0.000 peak  9313 weight  0.10000E+01 volume  0.18130E+01 ppm1      1.045 ppm2      4.641
 ASSI (
   (( segid "    " and resid 1166 and name HD2 ))
 )(
   (( segid "    " and resid 1219 and name HA  ))
  OR 
   (( segid "    " and resid 1218 and name HA  ))
  OR 
   (( segid "    " and resid 1191 and name HA  ))
  OR 
   (( segid "    " and resid 1144 and name HA  ))
  OR 
   (( segid "    " and resid 1143 and name HA  ))
 )
      6.000     6.000     0.000 peak  9570 weight  0.10000E+01 volume -0.13900E+00 ppm1      1.990 ppm2      4.644
 ASSI (
   (( segid "    " and resid 1145 and name HB2 ))
 )(
   (( segid "    " and resid 1145 and name HA  ))
  OR 
   (( segid "    " and resid 1144 and name HA  ))
 )
      5.000     5.000     0.000 peak  8667 weight  0.10000E+01 volume  0.76300E+00 ppm1      1.787 ppm2      4.678
 ASSI (
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )(
   (( segid "    " and resid 1127 and name HA  ))
  OR 
   (( segid "    " and resid 1111 and name HA  ))
  OR 
   (( segid "    " and resid 1110 and name HA1 ))
 )
      6.000     6.000     0.000 peak  9660 weight  0.10000E+01 volume -0.19000E+00 ppm1      7.120 ppm2      4.721
 ASSI (
   (( segid "    " and resid 1231 and name HG2 ))
  OR 
   (( segid "    " and resid 1231 and name HG1 ))
  OR 
   (( segid "    " and resid 1215 and name HG2 ))
  OR 
   (( segid "    " and resid 1215 and name HG1 ))
 )(
   (( segid "    " and resid 1217 and name HA  ))
  OR 
   (( segid "    " and resid 1205 and name HA  ))
  OR 
   (( segid "    " and resid 1198 and name HA  ))
 )
      6.000     6.000     0.000 peak  8622 weight  0.10000E+01 volume  0.38600E+00 ppm1      1.456 ppm2      4.795
 ASSI (
   (( segid "    " and resid 1205 and name HA  ))
 )(
   (( segid "    " and resid 1229 and name HA  ))
  OR 
   (( segid "    " and resid 1206 and name HA  ))
 )
      6.000     6.000     0.000 peak  7569 weight  0.10000E+01 volume -0.27800E+00 ppm1      4.791 ppm2      4.967
 ASSI (
   (( segid "    " and resid 1149 and name HB1 ))
  OR 
   (( segid "    " and resid 1135 and name HB2 ))
 )(
   (( segid "    " and resid 1149 and name HA  ))
  OR 
   (( segid "    " and resid 1135 and name HA  ))
 )
      5.000     5.000     0.000 peak  6272 weight  0.10000E+01 volume  0.10070E+01 ppm1      1.719 ppm2      5.392
 ASSI (
   (( segid "    " and resid 1149 and name HB2 ))
 )(
   (( segid "    " and resid 1149 and name HA  ))
  OR 
   (( segid "    " and resid 1135 and name HA  ))
 )
      5.000     5.000     0.000 peak  8903 weight  0.10000E+01 volume  0.50600E+00 ppm1      1.622 ppm2      5.393
 ASSI (
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )(
   (( segid "    " and resid 1157 and name HZ2 ))
 )
      6.000     6.000     0.000 peak  9659 weight  0.10000E+01 volume -0.16300E+00 ppm1      7.129 ppm2      6.531
 ASSI (
   (( segid "    " and resid 1230 and name HE2 ))
  OR 
   (( segid "    " and resid 1230 and name HE1 ))
  OR 
   (( segid "    " and resid 1202 and name HE2 ))
 )(
   (( segid "    " and resid 1205 and name HE2 ))
  OR 
   (( segid "    " and resid 1205 and name HE1 ))
  OR 
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9607 weight  0.10000E+01 volume  0.67700E+00 ppm1      2.802 ppm2      6.685
 ASSI (
   (( segid "    " and resid 1225 and name HB1 ))
  OR 
   (( segid "    " and resid 1176 and name HB2 ))
 )(
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
  OR 
   (( segid "    " and resid 1177 and name HD1 ))
  OR 
   (( segid "    " and resid 1176 and name HD22))
 )
      5.000     5.000     0.000 peak  7492 weight  0.10000E+01 volume  0.12250E+01 ppm1      2.568 ppm2      6.773
 ASSI (
   (( segid "    " and resid 1225 and name HA  ))
 )(
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6645 weight  0.10000E+01 volume -0.37700E+00 ppm1      4.157 ppm2      6.782
 ASSI (
   (( segid "    " and resid 1219 and name HE3 ))
 )(
   (( segid "    " and resid 1219 and name HZ3 ))
 )
      5.000     5.000     0.000 peak  8203 weight  0.10000E+01 volume -0.59000E+00 ppm1      7.592 ppm2      7.076
 ASSI (
   (( segid "    " and resid 1125 and name HD13))
  OR 
   (( segid "    " and resid 1125 and name HD12))
  OR 
   (( segid "    " and resid 1125 and name HD11))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9664 weight  0.10000E+01 volume  0.20900E+00 ppm1      0.688 ppm2      7.118
 ASSI (
   (( segid "    " and resid 1225 and name HA  ))
  OR 
   (( segid "    " and resid 1214 and name HA  ))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
  OR 
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )
      5.000     5.000     0.000 peak  6636 weight  0.10000E+01 volume -0.54400E+00 ppm1      4.157 ppm2      7.161
 ASSI (
   (( segid "    " and resid 1181 and name HA  ))
  OR 
   (( segid "    " and resid 1164 and name HA  ))
 )(
   (( segid "    " and resid 1219 and name HD1 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
  OR 
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )
      5.000     5.000     0.000 peak  6955 weight  0.10000E+01 volume -0.43000E+00 ppm1      4.349 ppm2      7.165
 ASSI (
   (( segid "    " and resid 1220 and name HB2 ))
 )(
   (( segid "    " and resid 1219 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7585 weight  0.10000E+01 volume  0.20900E+00 ppm1      1.780 ppm2      7.177
 ASSI (
   (( segid "    " and resid 1206 and name HD2 ))
  OR 
   (( segid "    " and resid 1206 and name HD1 ))
 )(
   (( segid "    " and resid 1206 and name HE  ))
 )
      6.000     6.000     0.000 peak  9587 weight  0.10000E+01 volume  0.29000E+00 ppm1      3.190 ppm2      7.205
 ASSI (
   (( segid "    " and resid 1190 and name HD1 ))
 )(
   (( segid "    " and resid 1199 and name HE1 ))
 )
      6.000     6.000     0.000 peak  9598 weight  0.10000E+01 volume -0.20100E+00 ppm1      6.844 ppm2      7.216
 ASSI (
   (( segid "    " and resid 1170 and name HB1 ))
 )(
   (( segid "    " and resid 1173 and name HN  ))
 )
      6.000     6.000     0.000 peak  8580 weight  0.10000E+01 volume -0.17300E+00 ppm1      3.955 ppm2      7.366
 ASSI (
   (( segid "    " and resid 1189 and name HA  ))
  OR 
   (( segid "    " and resid 1188 and name HA  ))
 )(
   (( segid "    " and resid 1190 and name HN  ))
 )
      5.000     5.000     0.000 peak  8276 weight  0.10000E+01 volume -0.53900E+00 ppm1      4.385 ppm2      7.385
 ASSI (
   (( segid "    " and resid 1176 and name HA  ))
 )(
   (( segid "    " and resid 1178 and name HN  ))
  OR 
   (( segid "    " and resid 1176 and name HN  ))
 )
      3.300     3.300     0.000 peak  7649 weight  0.10000E+01 volume -0.17930E+01 ppm1      4.380 ppm2      7.542
 ASSI (
   (( segid "    " and resid 1210 and name HA  ))
 )(
   (( segid "    " and resid 1211 and name HN  ))
 )
      5.000     5.000     0.000 peak  8297 weight  0.10000E+01 volume -0.42200E+00 ppm1      4.288 ppm2      7.585
 ASSI (
   (( segid "    " and resid 1186 and name HB1 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
 )(
   (( segid "    " and resid 1186 and name HN  ))
  OR 
   (( segid "    " and resid 1149 and name HN  ))
 )
      5.000     5.000     0.000 peak  8314 weight  0.10000E+01 volume  0.95600E+00 ppm1      1.817 ppm2      7.739
 ASSI (
   (( segid "    " and resid 1186 and name HA  ))
 )(
   (( segid "    " and resid 1186 and name HN  ))
 )
      5.000     5.000     0.000 peak  6697 weight  0.10000E+01 volume -0.12880E+01 ppm1      4.278 ppm2      7.744
 ASSI (
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )(
   (( segid "    " and resid 1149 and name HN  ))
 )
      6.000     6.000     0.000 peak  9631 weight  0.10000E+01 volume  0.19400E+00 ppm1      0.579 ppm2      7.751
 ASSI (
   (( segid "    " and resid 1222 and name HG2 ))
  OR 
   (( segid "    " and resid 1186 and name HG2 ))
 )(
   (( segid "    " and resid 1222 and name HN  ))
  OR 
   (( segid "    " and resid 1186 and name HN  ))
 )
      5.000     5.000     0.000 peak  9318 weight  0.10000E+01 volume  0.61400E+00 ppm1      1.356 ppm2      7.770
 ASSI (
   (( segid "    " and resid 1222 and name HG1 ))
  OR 
   (( segid "    " and resid 1186 and name HG2 ))
  OR 
   (( segid "    " and resid 1148 and name HG2 ))
 )(
   (( segid "    " and resid 1222 and name HN  ))
  OR 
   (( segid "    " and resid 1175 and name HN  ))
  OR 
   (( segid "    " and resid 1147 and name HD21))
 )
      6.000     6.000     0.000 peak  9317 weight  0.10000E+01 volume  0.39700E+00 ppm1      1.428 ppm2      7.781
 ASSI (
   (( segid "    " and resid 1132 and name HA  ))
 )(
   (( segid "    " and resid 1132 and name HN  ))
 )
      5.000     5.000     0.000 peak  7399 weight  0.10000E+01 volume -0.62600E+00 ppm1      4.557 ppm2      7.860
 ASSI (
   (( segid "    " and resid 1195 and name HA  ))
  OR 
   (( segid "    " and resid 1188 and name HA  ))
 )(
   (( segid "    " and resid 1195 and name HN  ))
  OR 
   (( segid "    " and resid 1188 and name HN  ))
 )
      5.000     5.000     0.000 peak  8275 weight  0.10000E+01 volume -0.13490E+01 ppm1      4.402 ppm2      8.037
 ASSI (
   (( segid "    " and resid 1195 and name HG1 ))
 )(
   (( segid "    " and resid 1195 and name HN  ))
 )
      5.000     5.000     0.000 peak  8230 weight  0.10000E+01 volume  0.63300E+00 ppm1      2.243 ppm2      8.040
 ASSI (
   (( segid "    " and resid 1191 and name HB2 ))
 )(
   (( segid "    " and resid 1195 and name HN  ))
 )
      6.000     6.000     0.000 peak  7813 weight  0.10000E+01 volume -0.17100E+00 ppm1      3.442 ppm2      8.040
 ASSI (
   (( segid "    " and resid 1186 and name HB1 ))
  OR 
   (( segid "    " and resid 1161 and name HB1 ))
 )(
   (( segid "    " and resid 1187 and name HN  ))
  OR 
   (( segid "    " and resid 1162 and name HN  ))
 )
      6.000     6.000     0.000 peak  8302 weight  0.10000E+01 volume  0.39100E+00 ppm1      1.810 ppm2      8.045
 ASSI (
   (( segid "    " and resid 1188 and name HG2 ))
 )(
   (( segid "    " and resid 1188 and name HN  ))
  OR 
   (( segid "    " and resid 1187 and name HN  ))
  OR 
   (( segid "    " and resid 1182 and name HN  ))
 )
      6.000     6.000     0.000 peak  7545 weight  0.10000E+01 volume  0.31800E+00 ppm1      1.296 ppm2      8.049
 ASSI (
   (( segid "    " and resid 1188 and name HG1 ))
  OR 
   (( segid "    " and resid 1186 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
 )(
   (( segid "    " and resid 1188 and name HN  ))
  OR 
   (( segid "    " and resid 1187 and name HN  ))
  OR 
   (( segid "    " and resid 1162 and name HN  ))
 )
      5.000     5.000     0.000 peak  7543 weight  0.10000E+01 volume  0.10690E+01 ppm1      1.364 ppm2      8.054
 ASSI (
   (( segid "    " and resid 1187 and name HB2 ))
  OR 
   (( segid "    " and resid 1187 and name HB1 ))
  OR 
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )(
   (( segid "    " and resid 1188 and name HN  ))
  OR 
   (( segid "    " and resid 1187 and name HN  ))
 )
      3.300     3.300     0.000 peak  8291 weight  0.10000E+01 volume  0.18100E+01 ppm1      2.011 ppm2      8.057
 ASSI (
   (( segid "    " and resid 1210 and name HA  ))
  OR 
   (( segid "    " and resid 1186 and name HA  ))
 )(
   (( segid "    " and resid 1210 and name HN  ))
  OR 
   (( segid "    " and resid 1187 and name HN  ))
 )
      2.700     2.700     0.000 peak  6695 weight  0.10000E+01 volume -0.31240E+01 ppm1      4.274 ppm2      8.065
 ASSI (
   (( segid "    " and resid 1210 and name HG2 ))
  OR 
   (( segid "    " and resid 1210 and name HG1 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
 )(
   (( segid "    " and resid 1210 and name HN  ))
  OR 
   (( segid "    " and resid 1182 and name HN  ))
 )
      5.000     5.000     0.000 peak  9336 weight  0.10000E+01 volume  0.40800E+00 ppm1      1.588 ppm2      8.071
 ASSI (
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
 )(
   (( segid "    " and resid 1148 and name HN  ))
 )
      6.000     6.000     0.000 peak  8132 weight  0.10000E+01 volume  0.32100E+00 ppm1      1.766 ppm2      8.137
 ASSI (
   (( segid "    " and resid 1147 and name HB2 ))
 )(
   (( segid "    " and resid 1148 and name HN  ))
 )
      5.000     5.000     0.000 peak  8918 weight  0.10000E+01 volume  0.49100E+00 ppm1      2.754 ppm2      8.155
 ASSI (
   (( segid "    " and resid 1147 and name HA  ))
 )(
   (( segid "    " and resid 1148 and name HN  ))
 )
      2.700     2.700     0.000 peak  7054 weight  0.10000E+01 volume -0.36760E+01 ppm1      4.555 ppm2      8.155
 ASSI (
   (( segid "    " and resid 1159 and name HA  ))
  OR 
   (( segid "    " and resid 1116 and name HA  ))
 )(
   (( segid "    " and resid 1158 and name HN  ))
  OR 
   (( segid "    " and resid 1116 and name HN  ))
 )
      5.000     5.000     0.000 peak  6952 weight  0.10000E+01 volume -0.14520E+01 ppm1      4.355 ppm2      8.181
 ASSI (
   (( segid "    " and resid 1225 and name HA  ))
 )(
   (( segid "    " and resid 1225 and name HN  ))
 )
      3.300     3.300     0.000 peak  7505 weight  0.10000E+01 volume -0.25990E+01 ppm1      4.201 ppm2      8.183
 ASSI (
   (( segid "    " and resid 1225 and name HB2 ))
 )(
   (( segid "    " and resid 1225 and name HN  ))
 )
      5.000     5.000     0.000 peak  7494 weight  0.10000E+01 volume  0.44000E+00 ppm1      2.474 ppm2      8.206
 ASSI (
   (( segid "    " and resid 1225 and name HB1 ))
 )(
   (( segid "    " and resid 1225 and name HN  ))
 )
      6.000     6.000     0.000 peak  7496 weight  0.10000E+01 volume  0.32400E+00 ppm1      2.564 ppm2      8.210
 ASSI (
   (( segid "    " and resid 1134 and name HA  ))
 )(
   (( segid "    " and resid 1135 and name HN  ))
  OR 
   (( segid "    " and resid 1134 and name HN  ))
 )
      2.700     2.700     0.000 peak  6999 weight  0.10000E+01 volume -0.50320E+01 ppm1      4.387 ppm2      8.279
 ASSI (
   (( segid "    " and resid 1188 and name HB1 ))
  OR 
   (( segid "    " and resid 1186 and name HB2 ))
  OR 
   (( segid "    " and resid 1149 and name HB1 ))
  OR 
   (( segid "    " and resid 1135 and name HB2 ))
 )(
   (( segid "    " and resid 1185 and name HN  ))
  OR 
   (( segid "    " and resid 1181 and name HN  ))
  OR 
   (( segid "    " and resid 1135 and name HN  ))
  OR 
   (( segid "    " and resid 1134 and name HN  ))
  OR 
   (( segid "    " and resid 1121 and name HN  ))
 )
      5.000     5.000     0.000 peak  8299 weight  0.10000E+01 volume  0.12200E+01 ppm1      1.738 ppm2      8.293
 ASSI (
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )(
   (( segid "    " and resid 1129 and name HN  ))
  OR 
   (( segid "    " and resid 1126 and name HN  ))
 )
      6.000     6.000     0.000 peak  9469 weight  0.10000E+01 volume  0.38400E+00 ppm1      0.855 ppm2      8.296
 ASSI (
   (( segid "    " and resid 1203 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
 )(
   (( segid "    " and resid 1205 and name HN  ))
  OR 
   (( segid "    " and resid 1203 and name HN  ))
  OR 
   (( segid "    " and resid 1135 and name HN  ))
 )
      3.300     3.300     0.000 peak  8121 weight  0.10000E+01 volume  0.19900E+01 ppm1      1.768 ppm2      8.298
 ASSI (
   (( segid "    " and resid 1203 and name HB1 ))
  OR 
   (( segid "    " and resid 1171 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HB1 ))
 )(
   (( segid "    " and resid 1203 and name HN  ))
  OR 
   (( segid "    " and resid 1172 and name HN  ))
 )
      3.300     3.300     0.000 peak  8120 weight  0.10000E+01 volume  0.25460E+01 ppm1      1.861 ppm2      8.298
 ASSI (
   (( segid "    " and resid 1135 and name HB1 ))
 )(
   (( segid "    " and resid 1135 and name HN  ))
  OR 
   (( segid "    " and resid 1121 and name HN  ))
 )
      5.000     5.000     0.000 peak  8071 weight  0.10000E+01 volume  0.10340E+01 ppm1      1.847 ppm2      8.299
 ASSI (
   (( segid "    " and resid 1202 and name HG1 ))
 )(
   (( segid "    " and resid 1205 and name HN  ))
  OR 
   (( segid "    " and resid 1203 and name HN  ))
 )
      6.000     6.000     0.000 peak  9356 weight  0.10000E+01 volume  0.24600E+00 ppm1      1.179 ppm2      8.300
 ASSI (
   (( segid "    " and resid 1203 and name HG1 ))
 )(
   (( segid "    " and resid 1203 and name HN  ))
 )
      5.000     5.000     0.000 peak  9351 weight  0.10000E+01 volume  0.84500E+00 ppm1      1.754 ppm2      8.300
 ASSI (
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
  OR 
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )(
   (( segid "    " and resid 1218 and name HN  ))
  OR 
   (( segid "    " and resid 1152 and name HN  ))
 )
      3.300     3.300     0.000 peak  9324 weight  0.10000E+01 volume  0.20570E+01 ppm1      1.049 ppm2      8.309
 ASSI (
   (( segid "    " and resid 1205 and name HA  ))
 )(
   (( segid "    " and resid 1205 and name HN  ))
 )
      5.000     5.000     0.000 peak  6479 weight  0.10000E+01 volume -0.41200E+00 ppm1      4.793 ppm2      8.310
 ASSI (
   (( segid "    " and resid 1203 and name HD2 ))
  OR 
   (( segid "    " and resid 1203 and name HD1 ))
  OR 
   (( segid "    " and resid 1171 and name HD2 ))
  OR 
   (( segid "    " and resid 1171 and name HD1 ))
  OR 
   (( segid "    " and resid 1153 and name HD1 ))
 )(
   (( segid "    " and resid 1203 and name HN  ))
  OR 
   (( segid "    " and resid 1172 and name HN  ))
  OR 
   (( segid "    " and resid 1152 and name HN  ))
 )
      6.000     6.000     0.000 peak  9583 weight  0.10000E+01 volume  0.37300E+00 ppm1      3.236 ppm2      8.315
 ASSI (
   (( segid "    " and resid 1134 and name HA  ))
  OR 
   (( segid "    " and resid 1126 and name HA  ))
 )(
   (( segid "    " and resid 1135 and name HN  ))
  OR 
   (( segid "    " and resid 1126 and name HN  ))
 )
      2.700     2.700     0.000 peak  7000 weight  0.10000E+01 volume -0.51430E+01 ppm1      4.386 ppm2      8.319
 ASSI (
   (( segid "    " and resid 1203 and name HG2 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
 )(
   (( segid "    " and resid 1203 and name HN  ))
  OR 
   (( segid "    " and resid 1181 and name HN  ))
 )
      5.000     5.000     0.000 peak  9352 weight  0.10000E+01 volume  0.98200E+00 ppm1      1.617 ppm2      8.329
 ASSI (
   (( segid "    " and resid 1203 and name HG2 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
  OR 
   (( segid "    " and resid 1125 and name HG  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )(
   (( segid "    " and resid 1205 and name HN  ))
  OR 
   (( segid "    " and resid 1181 and name HN  ))
  OR 
   (( segid "    " and resid 1129 and name HN  ))
  OR 
   (( segid "    " and resid 1126 and name HN  ))
  OR 
   (( segid "    " and resid 1123 and name HN  ))
 )
      5.000     5.000     0.000 peak  9394 weight  0.10000E+01 volume  0.92100E+00 ppm1      1.591 ppm2      8.341
 ASSI (
   (( segid "    " and resid 1147 and name HA  ))
  OR 
   (( segid "    " and resid 1125 and name HA  ))
 )(
   (( segid "    " and resid 1147 and name HN  ))
  OR 
   (( segid "    " and resid 1126 and name HN  ))
 )
      3.300     3.300     0.000 peak  7053 weight  0.10000E+01 volume -0.26690E+01 ppm1      4.581 ppm2      8.341
 ASSI (
   (( segid "    " and resid 1198 and name HG2 ))
  OR 
   (( segid "    " and resid 1135 and name HG2 ))
 )(
   (( segid "    " and resid 1214 and name HN  ))
  OR 
   (( segid "    " and resid 1181 and name HN  ))
  OR 
   (( segid "    " and resid 1136 and name HN  ))
 )
      6.000     6.000     0.000 peak  9366 weight  0.10000E+01 volume  0.36100E+00 ppm1      2.054 ppm2      8.348
 ASSI (
   (( segid "    " and resid 1181 and name HA  ))
 )(
   (( segid "    " and resid 1181 and name HN  ))
 )
      5.000     5.000     0.000 peak  8373 weight  0.10000E+01 volume -0.59100E+00 ppm1      4.353 ppm2      8.350
 ASSI (
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )(
   (( segid "    " and resid 1147 and name HN  ))
  OR 
   (( segid "    " and resid 1139 and name HN  ))
  OR 
   (( segid "    " and resid 1136 and name HN  ))
 )
      6.000     6.000     0.000 peak  9630 weight  0.10000E+01 volume  0.20900E+00 ppm1      0.758 ppm2      8.382
 ASSI (
   (( segid "    " and resid 1188 and name HB1 ))
  OR 
   (( segid "    " and resid 1186 and name HB2 ))
  OR 
   (( segid "    " and resid 1149 and name HB1 ))
 )(
   (( segid "    " and resid 1189 and name HN  ))
  OR 
   (( segid "    " and resid 1183 and name HN  ))
  OR 
   (( segid "    " and resid 1151 and name HN  ))
 )
      5.000     5.000     0.000 peak  8317 weight  0.10000E+01 volume  0.50600E+00 ppm1      1.735 ppm2      8.422
 ASSI (
   (( segid "    " and resid 1195 and name HA  ))
  OR 
   (( segid "    " and resid 1188 and name HA  ))
 )(
   (( segid "    " and resid 1196 and name HN  ))
  OR 
   (( segid "    " and resid 1189 and name HN  ))
 )
      2.700     2.700     0.000 peak  7650 weight  0.10000E+01 volume -0.46400E+01 ppm1      4.399 ppm2      8.451
 ASSI (
   (( segid "    " and resid 1188 and name HD2 ))
  OR 
   (( segid "    " and resid 1188 and name HD1 ))
  OR 
   (( segid "    " and resid 1139 and name HB2 ))
 )(
   (( segid "    " and resid 1189 and name HN  ))
  OR 
   (( segid "    " and resid 1183 and name HN  ))
  OR 
   (( segid "    " and resid 1142 and name HN  ))
  OR 
   (( segid "    " and resid 1140 and name HN  ))
 )
      5.000     5.000     0.000 peak  9614 weight  0.10000E+01 volume  0.56700E+00 ppm1      1.610 ppm2      8.462
 ASSI (
   (( segid "    " and resid 1198 and name HB1 ))
  OR 
   (( segid "    " and resid 1124 and name HB2 ))
 )(
   (( segid "    " and resid 1199 and name HN  ))
  OR 
   (( segid "    " and resid 1120 and name HN  ))
 )
      6.000     6.000     0.000 peak  8215 weight  0.10000E+01 volume  0.21500E+00 ppm1      1.888 ppm2      8.474
 ASSI (
   (( segid "    " and resid 1139 and name HB1 ))
 )(
   (( segid "    " and resid 1140 and name HN  ))
 )
      5.000     5.000     0.000 peak  9036 weight  0.10000E+01 volume  0.68300E+00 ppm1      1.927 ppm2      8.479
 ASSI (
   (( segid "    " and resid 1198 and name HG1 ))
  OR 
   (( segid "    " and resid 1195 and name HG2 ))
  OR 
   (( segid "    " and resid 1195 and name HG1 ))
 )(
   (( segid "    " and resid 1199 and name HN  ))
  OR 
   (( segid "    " and resid 1196 and name HN  ))
 )
      5.000     5.000     0.000 peak  8232 weight  0.10000E+01 volume  0.69900E+00 ppm1      2.200 ppm2      8.480
 ASSI (
   (( segid "    " and resid 1195 and name HG1 ))
 )(
   (( segid "    " and resid 1196 and name HN  ))
 )
      5.000     5.000     0.000 peak  8231 weight  0.10000E+01 volume  0.55400E+00 ppm1      2.244 ppm2      8.481
 ASSI (
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
  OR 
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )(
   (( segid "    " and resid 1196 and name HN  ))
  OR 
   (( segid "    " and resid 1133 and name HN  ))
 )
      5.000     5.000     0.000 peak  9327 weight  0.10000E+01 volume  0.40900E+00 ppm1      1.044 ppm2      8.482
 ASSI (
   (( segid "    " and resid 1215 and name HB1 ))
  OR 
   (( segid "    " and resid 1198 and name HB2 ))
  OR 
   (( segid "    " and resid 1145 and name HB2 ))
 )(
   (( segid "    " and resid 1199 and name HN  ))
  OR 
   (( segid "    " and resid 1183 and name HN  ))
  OR 
   (( segid "    " and resid 1146 and name HN  ))
 )
      6.000     6.000     0.000 peak  8214 weight  0.10000E+01 volume  0.32300E+00 ppm1      1.794 ppm2      8.487
 ASSI (
   (( segid "    " and resid 1215 and name HG2 ))
  OR 
   (( segid "    " and resid 1215 and name HG1 ))
 )(
   (( segid "    " and resid 1216 and name HN  ))
 )
      5.000     5.000     0.000 peak  9271 weight  0.10000E+01 volume  0.48900E+00 ppm1      1.462 ppm2      8.757
 ASSI (
   (( segid "    " and resid 1149 and name HB1 ))
  OR 
   (( segid "    " and resid 1135 and name HB2 ))
 )(
   (( segid "    " and resid 1150 and name HN  ))
  OR 
   (( segid "    " and resid 1137 and name HN  ))
 )
      6.000     6.000     0.000 peak  8319 weight  0.10000E+01 volume  0.35000E+00 ppm1      1.713 ppm2      8.758
 ASSI (
   (( segid "    " and resid 1215 and name HD2 ))
  OR 
   (( segid "    " and resid 1215 and name HD1 ))
  OR 
   (( segid "    " and resid 1206 and name HD2 ))
  OR 
   (( segid "    " and resid 1206 and name HD1 ))
  OR 
   (( segid "    " and resid 1153 and name HD1 ))
  OR 
   (( segid "    " and resid 1149 and name HD2 ))
  OR 
   (( segid "    " and resid 1149 and name HD1 ))
 )(
   (( segid "    " and resid 1216 and name HN  ))
  OR 
   (( segid "    " and resid 1207 and name HN  ))
  OR 
   (( segid "    " and resid 1153 and name HN  ))
  OR 
   (( segid "    " and resid 1150 and name HN  ))
 )
      6.000     6.000     0.000 peak  9585 weight  0.10000E+01 volume  0.30400E+00 ppm1      3.193 ppm2      8.761
 ASSI (
   (( segid "    " and resid 1164 and name HA  ))
  OR 
   (( segid "    " and resid 1116 and name HA  ))
 )(
   (( segid "    " and resid 1220 and name HN  ))
  OR 
   (( segid "    " and resid 1117 and name HN  ))
 )
      3.300     3.300     0.000 peak  6951 weight  0.10000E+01 volume -0.29600E+01 ppm1      4.359 ppm2      8.883
 ASSI (
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )(
   (( segid "    " and resid 1138 and name HN  ))
 )
      6.000     6.000     0.000 peak  9633 weight  0.10000E+01 volume  0.24400E+00 ppm1      0.580 ppm2      8.884
 ASSI (
   (( segid "    " and resid 1171 and name HD2 ))
  OR 
   (( segid "    " and resid 1171 and name HD1 ))
 )(
   (( segid "    " and resid 1171 and name HN  ))
 )
      6.000     6.000     0.000 peak  9584 weight  0.10000E+01 volume  0.38400E+00 ppm1      3.227 ppm2      8.997
 ASSI (
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
  OR 
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )(
   (( segid "    " and resid 1197 and name HN  ))
  OR 
   (( segid "    " and resid 1131 and name HN  ))
 )
      5.000     5.000     0.000 peak  9329 weight  0.10000E+01 volume  0.64000E+00 ppm1      1.045 ppm2      9.001
 ASSI (
   (( segid "    " and resid 1130 and name HB2 ))
 )(
   (( segid "    " and resid 1131 and name HN  ))
 )
      6.000     6.000     0.000 peak  9095 weight  0.10000E+01 volume  0.18700E+00 ppm1      1.888 ppm2      9.003
 ASSI (
   (( segid "    " and resid 1130 and name HB1 ))
 )(
   (( segid "    " and resid 1131 and name HN  ))
 )
      5.000     5.000     0.000 peak  9094 weight  0.10000E+01 volume  0.42700E+00 ppm1      2.291 ppm2      9.009
 ASSI (
   (( segid "    " and resid 1181 and name HA  ))
  OR 
   (( segid "    " and resid 1164 and name HA  ))
 )(
   (( segid "    " and resid 1200 and name HN  ))
  OR 
   (( segid "    " and resid 1163 and name HN  ))
 )
      6.000     6.000     0.000 peak  6950 weight  0.10000E+01 volume -0.35400E+00 ppm1      4.353 ppm2      9.042
 ASSI (
   (( segid "    " and resid 1145 and name HB2 ))
 )(
   (( segid "    " and resid 1145 and name HN  ))
 )
      6.000     6.000     0.000 peak  8957 weight  0.10000E+01 volume  0.26400E+00 ppm1      1.795 ppm2      9.416
 ASSI (
   (( segid "    " and resid 1111 and name HB2 ))
 )(
   (( segid "    " and resid 1111 and name HB1 ))
 )
      2.700     2.700     0.000 peak  7148 weight  0.10000E+01 volume  0.39070E+01 ppm1      1.841 ppm2      2.516
 ASSI (
   (( segid "    " and resid 1111 and name HB2 ))
 )(
   (( segid "    " and resid 1112 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7249 weight  0.10000E+01 volume  0.35900E+00 ppm1      1.838 ppm2      3.530
 ASSI (
   (( segid "    " and resid 1111 and name HB2 ))
 )(
   (( segid "    " and resid 1114 and name HD2 ))
  OR 
   (( segid "    " and resid 1111 and name HD2 ))
 )
      6.000     6.000     0.000 peak  7250 weight  0.10000E+01 volume  0.39100E+00 ppm1      1.839 ppm2      3.661
 ASSI (
   (( segid "    " and resid 1111 and name HB2 ))
 )(
   (( segid "    " and resid 1111 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7251 weight  0.10000E+01 volume  0.25900E+00 ppm1      1.836 ppm2      3.869
 ASSI (
   (( segid "    " and resid 1111 and name HB2 ))
 )(
   (( segid "    " and resid 1111 and name HA  ))
 )
      5.000     5.000     0.000 peak  7252 weight  0.10000E+01 volume  0.56400E+00 ppm1      1.841 ppm2      4.762
 ASSI (
   (( segid "    " and resid 1190 and name HE2 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )(
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )
      6.000     6.000     0.000 peak  4371 weight  0.10000E+01 volume -0.17100E+00 ppm1      6.737 ppm2      0.659
 ASSI (
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )(
   (( segid "    " and resid 1108 and name HG2 ))
 )
      2.700     2.700     0.000 peak  9701 weight  0.10000E+01 volume  0.32290E+01 ppm1      1.548 ppm2      1.301
 ASSI (
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )(
   (( segid "    " and resid 1108 and name HG1 ))
 )
      2.700     2.700     0.000 peak  9702 weight  0.10000E+01 volume  0.54390E+01 ppm1      1.550 ppm2      1.406
 ASSI (
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )(
   (( segid "    " and resid 1108 and name HE2 ))
  OR 
   (( segid "    " and resid 1108 and name HE1 ))
 )
      3.300     3.300     0.000 peak  7031 weight  0.10000E+01 volume  0.23760E+01 ppm1      1.549 ppm2      2.914
 ASSI (
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )(
   (( segid "    " and resid 1108 and name HA  ))
 )
      6.000     6.000     0.000 peak  9146 weight  0.10000E+01 volume  0.32100E+00 ppm1      1.552 ppm2      4.281
 ASSI (
   (( segid "    " and resid 1108 and name HG1 ))
 )(
   (( segid "    " and resid 1108 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9505 weight  0.10000E+01 volume  0.53200E+00 ppm1      1.408 ppm2      1.807
 ASSI (
   (( segid "    " and resid 1108 and name HG2 ))
 )(
   (( segid "    " and resid 1108 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9504 weight  0.10000E+01 volume  0.48600E+00 ppm1      1.282 ppm2      1.807
 ASSI (
   (( segid "    " and resid 1109 and name HB1 ))
 )(
   (( segid "    " and resid 1157 and name HD1 ))
  OR 
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8653 weight  0.10000E+01 volume -0.15100E+00 ppm1      2.864 ppm2      7.126
 ASSI (
   (( segid "    " and resid 1109 and name HB2 ))
 )(
   (( segid "    " and resid 1128 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8654 weight  0.10000E+01 volume -0.32900E+00 ppm1      2.059 ppm2      2.507
 ASSI (
   (( segid "    " and resid 1109 and name HB2 ))
 )(
   (( segid "    " and resid 1157 and name HD1 ))
  OR 
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8652 weight  0.10000E+01 volume -0.19300E+00 ppm1      2.060 ppm2      7.120
 ASSI (
   (( segid "    " and resid 1111 and name HA  ))
 )(
   (( segid "    " and resid 1125 and name HG  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )
      6.000     6.000     0.000 peak  7273 weight  0.10000E+01 volume -0.25100E+00 ppm1      4.765 ppm2      1.545
 ASSI (
   (( segid "    " and resid 1111 and name HA  ))
 )(
   (( segid "    " and resid 1157 and name HD1 ))
  OR 
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7275 weight  0.10000E+01 volume -0.20100E+00 ppm1      4.760 ppm2      7.140
 ASSI (
   (( segid "    " and resid 1111 and name HB1 ))
 )(
   (( segid "    " and resid 1125 and name HG  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )
      6.000     6.000     0.000 peak  7254 weight  0.10000E+01 volume  0.28900E+00 ppm1      2.515 ppm2      1.554
 ASSI (
   (( segid "    " and resid 1111 and name HB1 ))
 )(
   (( segid "    " and resid 1126 and name HA  ))
 )
      6.000     6.000     0.000 peak  7259 weight  0.10000E+01 volume  0.18900E+00 ppm1      2.515 ppm2      4.382
 ASSI (
   (( segid "    " and resid 1111 and name HD1 ))
 )(
   (( segid "    " and resid 1111 and name HG2 ))
  OR 
   (( segid "    " and resid 1111 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7144 weight  0.10000E+01 volume -0.14170E+01 ppm1      3.872 ppm2      2.189
 ASSI (
   (( segid "    " and resid 1111 and name HD1 ))
 )(
   (( segid "    " and resid 1111 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7143 weight  0.10000E+01 volume -0.21600E+00 ppm1      3.875 ppm2      2.511
 ASSI (
   (( segid "    " and resid 1111 and name HD1 ))
 )(
   (( segid "    " and resid 1126 and name HA  ))
 )
      6.000     6.000     0.000 peak  7135 weight  0.10000E+01 volume -0.28000E+00 ppm1      3.866 ppm2      4.397
 ASSI (
   (( segid "    " and resid 1111 and name HD2 ))
 )(
   (( segid "    " and resid 1111 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7142 weight  0.10000E+01 volume -0.53900E+00 ppm1      3.650 ppm2      1.837
 ASSI (
   (( segid "    " and resid 1111 and name HD2 ))
 )(
   (( segid "    " and resid 1111 and name HG2 ))
  OR 
   (( segid "    " and resid 1111 and name HG1 ))
 )
      3.300     3.300     0.000 peak  7141 weight  0.10000E+01 volume -0.20460E+01 ppm1      3.650 ppm2      2.186
 ASSI (
   (( segid "    " and resid 1111 and name HD2 ))
 )(
   (( segid "    " and resid 1111 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7140 weight  0.10000E+01 volume -0.40200E+00 ppm1      3.650 ppm2      2.511
 ASSI (
   (( segid "    " and resid 1111 and name HD2 ))
 )(
   (( segid "    " and resid 1111 and name HD1 ))
 )
      2.700     2.700     0.000 peak  7137 weight  0.10000E+01 volume -0.32670E+01 ppm1      3.650 ppm2      3.873
 ASSI (
   (( segid "    " and resid 1111 and name HD2 ))
 )(
   (( segid "    " and resid 1126 and name HA  ))
 )
      6.000     6.000     0.000 peak  7134 weight  0.10000E+01 volume -0.28500E+00 ppm1      3.648 ppm2      4.397
 ASSI (
   (( segid "    " and resid 1112 and name HA  ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      6.000     6.000     0.000 peak  9232 weight  0.10000E+01 volume -0.15100E+00 ppm1      3.272 ppm2      0.098
 ASSI (
   (( segid "    " and resid 1112 and name HA  ))
 )(
   (( segid "    " and resid 1114 and name HB2 ))
  OR 
   (( segid "    " and resid 1113 and name HG2 ))
  OR 
   (( segid "    " and resid 1111 and name HB2 ))
 )
      6.000     6.000     0.000 peak  9540 weight  0.10000E+01 volume -0.26800E+00 ppm1      3.277 ppm2      1.862
 ASSI (
   (( segid "    " and resid 1112 and name HA  ))
 )(
   (( segid "    " and resid 1150 and name HB  ))
  OR 
   (( segid "    " and resid 1114 and name HG2 ))
  OR 
   (( segid "    " and resid 1114 and name HG1 ))
  OR 
   (( segid "    " and resid 1113 and name HG1 ))
 )
      6.000     6.000     0.000 peak  9524 weight  0.10000E+01 volume -0.24500E+00 ppm1      3.277 ppm2      1.984
 ASSI (
   (( segid "    " and resid 1112 and name HA  ))
 )(
   (( segid "    " and resid 1114 and name HB1 ))
  OR 
   (( segid "    " and resid 1113 and name HB1 ))
  OR 
   (( segid "    " and resid 1111 and name HG2 ))
  OR 
   (( segid "    " and resid 1111 and name HG1 ))
 )
      6.000     6.000     0.000 peak  9549 weight  0.10000E+01 volume -0.13100E+00 ppm1      3.280 ppm2      2.235
 ASSI (
   (( segid "    " and resid 1112 and name HB1 ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      5.000     5.000     0.000 peak  9544 weight  0.10000E+01 volume  0.53300E+00 ppm1      1.291 ppm2      0.091
 ASSI (
   (( segid "    " and resid 1112 and name HB2 ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      5.000     5.000     0.000 peak  7211 weight  0.10000E+01 volume  0.68800E+00 ppm1      0.371 ppm2      0.104
 ASSI (
   (( segid "    " and resid 1112 and name HB2 ))
 )(
   (( segid "    " and resid 1157 and name HB2 ))
  OR 
   (( segid "    " and resid 1128 and name HB1 ))
  OR 
   (( segid "    " and resid 1113 and name HD2 ))
  OR 
   (( segid "    " and resid 1113 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9533 weight  0.10000E+01 volume  0.29800E+00 ppm1      0.372 ppm2      2.957
 ASSI (
   (( segid "    " and resid 1112 and name HD1 ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      6.000     6.000     0.000 peak  7310 weight  0.10000E+01 volume -0.32800E+00 ppm1      3.537 ppm2      0.093
 ASSI (
   (( segid "    " and resid 1112 and name HD1 ))
 )(
   (( segid "    " and resid 1124 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG1 ))
  OR 
   (( segid "    " and resid 1113 and name HG2 ))
  OR 
   (( segid "    " and resid 1111 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9231 weight  0.10000E+01 volume -0.66600E+00 ppm1      3.538 ppm2      1.844
 ASSI (
   (( segid "    " and resid 1112 and name HD1 ))
 )(
   (( segid "    " and resid 1128 and name HB2 ))
  OR 
   (( segid "    " and resid 1111 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7279 weight  0.10000E+01 volume -0.73600E+00 ppm1      3.538 ppm2      2.518
 ASSI (
   (( segid "    " and resid 1112 and name HG1 ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      5.000     5.000     0.000 peak  9233 weight  0.10000E+01 volume  0.10960E+01 ppm1      1.547 ppm2      0.104
 ASSI (
   (( segid "    " and resid 1112 and name HG2 ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      5.000     5.000     0.000 peak  9184 weight  0.10000E+01 volume  0.12740E+01 ppm1      1.100 ppm2      0.104
 ASSI (
   (( segid "    " and resid 1112 and name HG2 ))
 )(
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )
      5.000     5.000     0.000 peak  9236 weight  0.10000E+01 volume  0.54000E+00 ppm1      1.097 ppm2      0.589
 ASSI (
   (( segid "    " and resid 1112 and name HG2 ))
 )(
   (( segid "    " and resid 1120 and name HG11))
 )
      5.000     5.000     0.000 peak  7321 weight  0.10000E+01 volume  0.50700E+00 ppm1      1.105 ppm2      1.412
 ASSI (
   (( segid "    " and resid 1113 and name HA  ))
 )(
   (( segid "    " and resid 1113 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7222 weight  0.10000E+01 volume -0.12430E+01 ppm1      4.593 ppm2      1.750
 ASSI (
   (( segid "    " and resid 1113 and name HA  ))
 )(
   (( segid "    " and resid 1114 and name HG2 ))
  OR 
   (( segid "    " and resid 1114 and name HG1 ))
  OR 
   (( segid "    " and resid 1113 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7221 weight  0.10000E+01 volume -0.11520E+01 ppm1      4.593 ppm2      1.981
 ASSI (
   (( segid "    " and resid 1113 and name HA  ))
 )(
   (( segid "    " and resid 1113 and name HB1 ))
 )
      3.300     3.300     0.000 peak  7219 weight  0.10000E+01 volume -0.18750E+01 ppm1      4.593 ppm2      2.229
 ASSI (
   (( segid "    " and resid 1113 and name HB2 ))
 )(
   (( segid "    " and resid 1113 and name HD2 ))
  OR 
   (( segid "    " and resid 1113 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9230 weight  0.10000E+01 volume  0.21100E+00 ppm1      1.753 ppm2      2.944
 ASSI (
   (( segid "    " and resid 1113 and name HD2 ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )
      6.000     6.000     0.000 peak  9543 weight  0.10000E+01 volume -0.27600E+00 ppm1      2.948 ppm2      0.430
 ASSI (
   (( segid "    " and resid 1114 and name HA  ))
 )(
   (( segid "    " and resid 1115 and name HN  ))
 )
      2.700     2.700     0.000 peak  6537 weight  0.10000E+01 volume -0.32420E+01 ppm1      4.670 ppm2      8.712
 ASSI (
   (( segid "    " and resid 1114 and name HD1 ))
 )(
   (( segid "    " and resid 1114 and name HB1 ))
  OR 
   (( segid "    " and resid 1113 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9219 weight  0.10000E+01 volume -0.63200E+00 ppm1      3.808 ppm2      2.217
 ASSI (
   (( segid "    " and resid 1114 and name HD2 ))
 )(
   (( segid "    " and resid 1114 and name HB1 ))
  OR 
   (( segid "    " and resid 1113 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9220 weight  0.10000E+01 volume -0.94700E+00 ppm1      3.631 ppm2      2.222
 ASSI (
   (( segid "    " and resid 1115 and name HA  ))
 )(
   (( segid "    " and resid 1115 and name HG11))
 )
      6.000     6.000     0.000 peak  7125 weight  0.10000E+01 volume -0.23100E+00 ppm1      4.520 ppm2      0.863
 ASSI (
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )(
   (( segid "    " and resid 1115 and name HG12))
 )
      5.000     5.000     0.000 peak  9676 weight  0.10000E+01 volume  0.11020E+01 ppm1      0.192 ppm2      0.640
 ASSI (
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )(
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HG12))
 )
      5.000     5.000     0.000 peak  9677 weight  0.10000E+01 volume  0.11500E+01 ppm1      0.192 ppm2      0.715
 ASSI (
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )(
   (( segid "    " and resid 1115 and name HG11))
 )
      5.000     5.000     0.000 peak  9678 weight  0.10000E+01 volume  0.15150E+01 ppm1      0.194 ppm2      0.876
 ASSI (
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      5.000     5.000     0.000 peak  9679 weight  0.10000E+01 volume  0.84600E+00 ppm1      0.196 ppm2      0.984
 ASSI (
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )(
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
  OR 
   (( segid "    " and resid 1144 and name HG  ))
 )
      6.000     6.000     0.000 peak  9687 weight  0.10000E+01 volume  0.21700E+00 ppm1      0.194 ppm2      1.361
 ASSI (
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )(
   (( segid "    " and resid 1144 and name HB2 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
  OR 
   (( segid "    " and resid 1115 and name HB  ))
 )
      5.000     5.000     0.000 peak  8269 weight  0.10000E+01 volume  0.15170E+01 ppm1      0.196 ppm2      1.569
 ASSI (
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )(
   (( segid "    " and resid 1160 and name HG1 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
  OR 
   (( segid "    " and resid 1137 and name HB2 ))
  OR 
   (( segid "    " and resid 1114 and name HB2 ))
 )
      6.000     6.000     0.000 peak  9680 weight  0.10000E+01 volume  0.22900E+00 ppm1      0.196 ppm2      1.805
 ASSI (
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )(
   (( segid "    " and resid 1115 and name HN  ))
 )
      6.000     6.000     0.000 peak  9684 weight  0.10000E+01 volume  0.28400E+00 ppm1      0.200 ppm2      8.719
 ASSI (
   (( segid "    " and resid 1115 and name HG12))
 )(
   (( segid "    " and resid 1115 and name HG11))
 )
      5.000     5.000     0.000 peak  9520 weight  0.10000E+01 volume  0.43600E+00 ppm1      0.686 ppm2      0.883
 ASSI (
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )(
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
  OR 
   (( segid "    " and resid 1115 and name HG12))
 )
      5.000     5.000     0.000 peak  9686 weight  0.10000E+01 volume  0.64400E+00 ppm1      0.436 ppm2      0.726
 ASSI (
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )(
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
  OR 
   (( segid "    " and resid 1144 and name HG  ))
 )
      6.000     6.000     0.000 peak  9688 weight  0.10000E+01 volume  0.25500E+00 ppm1      0.442 ppm2      1.361
 ASSI (
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )(
   (( segid "    " and resid 1162 and name HA  ))
  OR 
   (( segid "    " and resid 1115 and name HA  ))
 )
      3.300     3.300     0.000 peak  7126 weight  0.10000E+01 volume  0.20080E+01 ppm1      0.439 ppm2      4.526
 ASSI (
   (( segid "    " and resid 1116 and name HB1 ))
 )(
   (( segid "    " and resid 1162 and name HA  ))
  OR 
   (( segid "    " and resid 1118 and name HA1 ))
  OR 
   (( segid "    " and resid 1115 and name HA  ))
 )
      5.000     5.000     0.000 peak  7127 weight  0.10000E+01 volume  0.48600E+00 ppm1      2.514 ppm2      4.525
 ASSI (
   (( segid "    " and resid 1116 and name HB2 ))
 )(
   (( segid "    " and resid 1162 and name HA  ))
  OR 
   (( segid "    " and resid 1118 and name HA1 ))
  OR 
   (( segid "    " and resid 1115 and name HA  ))
 )
      5.000     5.000     0.000 peak  7128 weight  0.10000E+01 volume  0.48400E+00 ppm1      2.491 ppm2      4.523
 ASSI (
   (( segid "    " and resid 1117 and name HA  ))
 )(
   (( segid "    " and resid 1163 and name HB2 ))
  OR 
   (( segid "    " and resid 1138 and name HB2 ))
  OR 
   (( segid "    " and resid 1119 and name HB2 ))
  OR 
   (( segid "    " and resid 1116 and name HB2 ))
  OR 
   (( segid "    " and resid 1116 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7114 weight  0.10000E+01 volume -0.20300E+00 ppm1      3.780 ppm2      2.518
 ASSI (
   (( segid "    " and resid 1117 and name HA  ))
 )(
   (( segid "    " and resid 1116 and name HA  ))
 )
      5.000     5.000     0.000 peak  7113 weight  0.10000E+01 volume -0.43700E+00 ppm1      3.780 ppm2      4.349
 ASSI (
   (( segid "    " and resid 1119 and name HA  ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
  OR 
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )
      6.000     6.000     0.000 peak  6399 weight  0.10000E+01 volume -0.21200E+00 ppm1      5.002 ppm2      0.485
 ASSI (
   (( segid "    " and resid 1119 and name HA  ))
 )(
   (( segid "    " and resid 1120 and name HG12))
 )
      5.000     5.000     0.000 peak  6397 weight  0.10000E+01 volume -0.76200E+00 ppm1      5.006 ppm2      0.755
 ASSI (
   (( segid "    " and resid 1119 and name HA  ))
 )(
   (( segid "    " and resid 1120 and name HG11))
 )
      6.000     6.000     0.000 peak  6396 weight  0.10000E+01 volume -0.30800E+00 ppm1      5.006 ppm2      1.418
 ASSI (
   (( segid "    " and resid 1119 and name HA  ))
 )(
   (( segid "    " and resid 1119 and name HB2 ))
 )
      3.300     3.300     0.000 peak  6395 weight  0.10000E+01 volume -0.20200E+01 ppm1      5.006 ppm2      2.548
 ASSI (
   (( segid "    " and resid 1119 and name HA  ))
 )(
   (( segid "    " and resid 1119 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6394 weight  0.10000E+01 volume -0.24280E+01 ppm1      5.006 ppm2      2.651
 ASSI (
   (( segid "    " and resid 1119 and name HA  ))
 )(
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )
      6.000     6.000     0.000 peak  7708 weight  0.10000E+01 volume -0.16100E+00 ppm1      5.002 ppm2      6.430
 ASSI (
   (( segid "    " and resid 1120 and name HA  ))
 )(
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )
      6.000     6.000     0.000 peak  6577 weight  0.10000E+01 volume -0.26800E+00 ppm1      4.736 ppm2      0.514
 ASSI (
   (( segid "    " and resid 1120 and name HA  ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      5.000     5.000     0.000 peak  6576 weight  0.10000E+01 volume -0.42700E+00 ppm1      4.744 ppm2      0.992
 ASSI (
   (( segid "    " and resid 1120 and name HB  ))
 )(
   (( segid "    " and resid 1120 and name HG12))
 )
      5.000     5.000     0.000 peak  9179 weight  0.10000E+01 volume  0.48400E+00 ppm1      1.503 ppm2      0.750
 ASSI (
   (( segid "    " and resid 1120 and name HB  ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      6.000     6.000     0.000 peak  9180 weight  0.10000E+01 volume  0.13000E+00 ppm1      1.502 ppm2      0.985
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1120 and name HG12))
 )
      2.700     2.700     0.000 peak  7084 weight  0.10000E+01 volume  0.41550E+01 ppm1      0.502 ppm2      0.759
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1125 and name HB1 ))
  OR 
   (( segid "    " and resid 1112 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7082 weight  0.10000E+01 volume  0.46100E+00 ppm1      0.496 ppm2      1.296
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1120 and name HG11))
 )
      2.700     2.700     0.000 peak  7081 weight  0.10000E+01 volume  0.35210E+01 ppm1      0.498 ppm2      1.420
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1124 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG1 ))
  OR 
   (( segid "    " and resid 1124 and name HB2 ))
  OR 
   (( segid "    " and resid 1114 and name HB2 ))
  OR 
   (( segid "    " and resid 1111 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7079 weight  0.10000E+01 volume  0.12130E+01 ppm1      0.498 ppm2      1.876
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1123 and name HA  ))
  OR 
   (( segid "    " and resid 1122 and name HA  ))
 )
      5.000     5.000     0.000 peak  7075 weight  0.10000E+01 volume  0.92000E+00 ppm1      0.500 ppm2      4.648
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1120 and name HA  ))
  OR 
   (( segid "    " and resid 1111 and name HA  ))
 )
      6.000     6.000     0.000 peak  7076 weight  0.10000E+01 volume  0.35800E+00 ppm1      0.501 ppm2      4.755
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
  OR 
   (( segid "    " and resid 1122 and name HN  ))
 )
      5.000     5.000     0.000 peak  7074 weight  0.10000E+01 volume  0.52200E+00 ppm1      0.502 ppm2      7.083
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1135 and name HN  ))
  OR 
   (( segid "    " and resid 1123 and name HN  ))
  OR 
   (( segid "    " and resid 1121 and name HN  ))
 )
      6.000     6.000     0.000 peak  7073 weight  0.10000E+01 volume  0.35600E+00 ppm1      0.499 ppm2      8.270
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1120 and name HN  ))
 )
      5.000     5.000     0.000 peak  7071 weight  0.10000E+01 volume  0.82500E+00 ppm1      0.501 ppm2      8.521
 ASSI (
   (( segid "    " and resid 1120 and name HG11))
 )(
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      5.000     5.000     0.000 peak  9186 weight  0.10000E+01 volume  0.58300E+00 ppm1      1.420 ppm2      0.104
 ASSI (
   (( segid "    " and resid 1120 and name HG12))
 )(
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      5.000     5.000     0.000 peak  9185 weight  0.10000E+01 volume  0.70000E+00 ppm1      0.755 ppm2      0.104
 ASSI (
   (( segid "    " and resid 1120 and name HG12))
 )(
   (( segid "    " and resid 1136 and name HA  ))
  OR 
   (( segid "    " and resid 1119 and name HA  ))
 )
      6.000     6.000     0.000 peak  6415 weight  0.10000E+01 volume  0.10300E+00 ppm1      0.746 ppm2      5.014
 ASSI (
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )(
   (( segid "    " and resid 1136 and name HA  ))
  OR 
   (( segid "    " and resid 1119 and name HA  ))
 )
      5.000     5.000     0.000 peak  6400 weight  0.10000E+01 volume  0.62200E+00 ppm1      0.106 ppm2      4.999
 ASSI (
   (( segid "    " and resid 1122 and name HB1 ))
 )(
   (( segid "    " and resid 1123 and name HB2 ))
  OR 
   (( segid "    " and resid 1123 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9168 weight  0.10000E+01 volume -0.19100E+00 ppm1      3.965 ppm2      3.034
 ASSI (
   (( segid "    " and resid 1122 and name HB2 ))
 )(
   (( segid "    " and resid 1123 and name HB2 ))
  OR 
   (( segid "    " and resid 1123 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9167 weight  0.10000E+01 volume -0.19100E+00 ppm1      3.830 ppm2      3.046
 ASSI (
   (( segid "    " and resid 1123 and name HA  ))
 )(
   (( segid "    " and resid 1123 and name HD2 ))
  OR 
   (( segid "    " and resid 1123 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7056 weight  0.10000E+01 volume -0.40900E+00 ppm1      4.687 ppm2      7.272
 ASSI (
   (( segid "    " and resid 1123 and name HA  ))
 )(
   (( segid "    " and resid 1123 and name HN  ))
 )
      5.000     5.000     0.000 peak  7055 weight  0.10000E+01 volume -0.74100E+00 ppm1      4.687 ppm2      8.308
 ASSI (
   (( segid "    " and resid 1123 and name HB1 ))
 )(
   (( segid "    " and resid 1124 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9156 weight  0.10000E+01 volume  0.20800E+00 ppm1      3.074 ppm2      3.735
 ASSI (
   (( segid "    " and resid 1123 and name HB2 ))
 )(
   (( segid "    " and resid 1124 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8148 weight  0.10000E+01 volume  0.29500E+00 ppm1      3.024 ppm2      3.726
 ASSI (
   (( segid "    " and resid 1124 and name HA  ))
 )(
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
  OR 
   (( segid "    " and resid 1125 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7068 weight  0.10000E+01 volume -0.41100E+00 ppm1      4.266 ppm2      0.857
 ASSI (
   (( segid "    " and resid 1124 and name HA  ))
 )(
   (( segid "    " and resid 1125 and name HG  ))
  OR 
   (( segid "    " and resid 1120 and name HB  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )
      6.000     6.000     0.000 peak  7067 weight  0.10000E+01 volume -0.30200E+00 ppm1      4.266 ppm2      1.553
 ASSI (
   (( segid "    " and resid 1124 and name HA  ))
 )(
   (( segid "    " and resid 1124 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG1 ))
  OR 
   (( segid "    " and resid 1124 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7066 weight  0.10000E+01 volume -0.14180E+01 ppm1      4.267 ppm2      1.889
 ASSI (
   (( segid "    " and resid 1124 and name HD1 ))
 )(
   (( segid "    " and resid 1124 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG1 ))
  OR 
   (( segid "    " and resid 1124 and name HB2 ))
 )
      3.300     3.300     0.000 peak  9479 weight  0.10000E+01 volume -0.22550E+01 ppm1      3.736 ppm2      1.877
 ASSI (
   (( segid "    " and resid 1125 and name HA  ))
 )(
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
  OR 
   (( segid "    " and resid 1125 and name HB2 ))
 )
      2.700     2.700     0.000 peak  7045 weight  0.10000E+01 volume -0.34420E+01 ppm1      4.585 ppm2      0.870
 ASSI (
   (( segid "    " and resid 1125 and name HA  ))
 )(
   (( segid "    " and resid 1125 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7044 weight  0.10000E+01 volume -0.95100E+00 ppm1      4.584 ppm2      1.276
 ASSI (
   (( segid "    " and resid 1125 and name HA  ))
 )(
   (( segid "    " and resid 1125 and name HN  ))
 )
      5.000     5.000     0.000 peak  7051 weight  0.10000E+01 volume -0.74200E+00 ppm1      4.580 ppm2      7.738
 ASSI (
   (( segid "    " and resid 1125 and name HB1 ))
 )(
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HB2 ))
 )
      3.300     3.300     0.000 peak  9136 weight  0.10000E+01 volume  0.27510E+01 ppm1      1.264 ppm2      0.851
 ASSI (
   (( segid "    " and resid 1125 and name HB1 ))
 )(
   (( segid "    " and resid 1125 and name HG  ))
 )
      5.000     5.000     0.000 peak  9138 weight  0.10000E+01 volume  0.50700E+00 ppm1      1.264 ppm2      1.559
 ASSI (
   (( segid "    " and resid 1125 and name HB1 ))
 )(
   (( segid "    " and resid 1126 and name HN  ))
 )
      5.000     5.000     0.000 peak  9141 weight  0.10000E+01 volume  0.58400E+00 ppm1      1.265 ppm2      8.334
 ASSI (
   (( segid "    " and resid 1125 and name HD13))
  OR 
   (( segid "    " and resid 1125 and name HD12))
  OR 
   (( segid "    " and resid 1125 and name HD11))
 )(
   (( segid "    " and resid 1125 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9142 weight  0.10000E+01 volume  0.11870E+01 ppm1      0.688 ppm2      1.268
 ASSI (
   (( segid "    " and resid 1125 and name HD13))
  OR 
   (( segid "    " and resid 1125 and name HD12))
  OR 
   (( segid "    " and resid 1125 and name HD11))
 )(
   (( segid "    " and resid 1125 and name HG  ))
 )
      3.300     3.300     0.000 peak  2554 weight  0.10000E+01 volume  0.26060E+01 ppm1      0.688 ppm2      1.566
 ASSI (
   (( segid "    " and resid 1125 and name HD13))
  OR 
   (( segid "    " and resid 1125 and name HD12))
  OR 
   (( segid "    " and resid 1125 and name HD11))
 )(
   (( segid "    " and resid 1128 and name HA  ))
  OR 
   (( segid "    " and resid 1125 and name HA  ))
 )
      5.000     5.000     0.000 peak  2820 weight  0.10000E+01 volume  0.64400E+00 ppm1      0.689 ppm2      4.591
 ASSI (
   (( segid "    " and resid 1125 and name HD13))
  OR 
   (( segid "    " and resid 1125 and name HD12))
  OR 
   (( segid "    " and resid 1125 and name HD11))
 )(
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )
      5.000     5.000     0.000 peak  9123 weight  0.10000E+01 volume  0.40700E+00 ppm1      0.693 ppm2      6.830
 ASSI (
   (( segid "    " and resid 1125 and name HD13))
  OR 
   (( segid "    " and resid 1125 and name HD12))
  OR 
   (( segid "    " and resid 1125 and name HD11))
 )(
   (( segid "    " and resid 1129 and name HN  ))
  OR 
   (( segid "    " and resid 1126 and name HN  ))
  OR 
   (( segid "    " and resid 1123 and name HN  ))
 )
      6.000     6.000     0.000 peak  9145 weight  0.10000E+01 volume  0.31700E+00 ppm1      0.691 ppm2      8.340
 ASSI (
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
 )(
   (( segid "    " and resid 1125 and name HD13))
  OR 
   (( segid "    " and resid 1125 and name HD12))
  OR 
   (( segid "    " and resid 1125 and name HD11))
 )
      2.700     2.700     0.000 peak  9667 weight  0.10000E+01 volume  0.63330E+01 ppm1      0.874 ppm2      0.681
 ASSI (
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
 )(
   (( segid "    " and resid 1125 and name HB1 ))
 )
      3.300     3.300     0.000 peak  9666 weight  0.10000E+01 volume  0.21870E+01 ppm1      0.875 ppm2      1.250
 ASSI (
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
 )(
   (( segid "    " and resid 1120 and name HG11))
 )
      5.000     5.000     0.000 peak  9665 weight  0.10000E+01 volume  0.57800E+00 ppm1      0.877 ppm2      1.402
 ASSI (
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
 )(
   (( segid "    " and resid 1125 and name HG  ))
 )
      3.300     3.300     0.000 peak  9480 weight  0.10000E+01 volume  0.25800E+01 ppm1      0.878 ppm2      1.564
 ASSI (
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
 )(
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )
      6.000     6.000     0.000 peak  9668 weight  0.10000E+01 volume  0.17000E+00 ppm1      0.879 ppm2      6.837
 ASSI (
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
 )(
   (( segid "    " and resid 1127 and name HN  ))
 )
      6.000     6.000     0.000 peak  9669 weight  0.10000E+01 volume  0.21000E+00 ppm1      0.879 ppm2      6.986
 ASSI (
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9670 weight  0.10000E+01 volume  0.10200E+00 ppm1      0.879 ppm2      7.115
 ASSI (
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
 )(
   (( segid "    " and resid 1123 and name HD2 ))
  OR 
   (( segid "    " and resid 1123 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9671 weight  0.10000E+01 volume  0.39100E+00 ppm1      0.881 ppm2      7.268
 ASSI (
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
 )(
   (( segid "    " and resid 1125 and name HN  ))
 )
      6.000     6.000     0.000 peak  9672 weight  0.10000E+01 volume  0.31700E+00 ppm1      0.880 ppm2      7.747
 ASSI (
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
 )(
   (( segid "    " and resid 1126 and name HN  ))
  OR 
   (( segid "    " and resid 1123 and name HN  ))
 )
      5.000     5.000     0.000 peak  9673 weight  0.10000E+01 volume  0.53800E+00 ppm1      0.881 ppm2      8.333
 ASSI (
   (( segid "    " and resid 1125 and name HD22))
 )(
   (( segid "    " and resid 1120 and name HN  ))
 )
      6.000     6.000     0.000 peak  9674 weight  0.10000E+01 volume  0.16200E+00 ppm1      0.878 ppm2      8.503
 ASSI (
   (( segid "    " and resid 1127 and name HA  ))
 )(
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
  OR 
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )
      3.300     3.300     0.000 peak  6586 weight  0.10000E+01 volume -0.25120E+01 ppm1      4.720 ppm2      0.834
 ASSI (
   (( segid "    " and resid 1127 and name HA  ))
 )(
   (( segid "    " and resid 1128 and name HA  ))
  OR 
   (( segid "    " and resid 1125 and name HA  ))
  OR 
   (( segid "    " and resid 1109 and name HA  ))
 )
      5.000     5.000     0.000 peak  6584 weight  0.10000E+01 volume -0.86800E+00 ppm1      4.718 ppm2      4.572
 ASSI (
   (( segid "    " and resid 1128 and name HA  ))
 )(
   (( segid "    " and resid 1128 and name HN  ))
 )
      6.000     6.000     0.000 peak  7034 weight  0.10000E+01 volume -0.29800E+00 ppm1      4.585 ppm2      8.952
 ASSI (
   (( segid "    " and resid 1128 and name HB2 ))
 )(
   (( segid "    " and resid 1128 and name HA  ))
 )
      6.000     6.000     0.000 peak  7038 weight  0.10000E+01 volume  0.35300E+00 ppm1      2.511 ppm2      4.577
 ASSI (
   (( segid "    " and resid 1128 and name HB2 ))
 )(
   (( segid "    " and resid 1157 and name HZ2 ))
 )
      6.000     6.000     0.000 peak  3239 weight  0.10000E+01 volume  0.25400E+00 ppm1      2.502 ppm2      6.539
 ASSI (
   (( segid "    " and resid 1128 and name HB2 ))
 )(
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )
      6.000     6.000     0.000 peak  3254 weight  0.10000E+01 volume  0.16400E+00 ppm1      2.505 ppm2      6.826
 ASSI (
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )(
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
  OR 
   (( segid "    " and resid 1125 and name HB2 ))
 )
      6.000     6.000     0.000 peak  9119 weight  0.10000E+01 volume -0.26700E+00 ppm1      6.818 ppm2      0.856
 ASSI (
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )(
   (( segid "    " and resid 1112 and name HG2 ))
 )
      6.000     6.000     0.000 peak  9120 weight  0.10000E+01 volume -0.16300E+00 ppm1      6.819 ppm2      1.115
 ASSI (
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )(
   (( segid "    " and resid 1128 and name HB2 ))
  OR 
   (( segid "    " and resid 1111 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9116 weight  0.10000E+01 volume -0.19000E+00 ppm1      6.818 ppm2      2.518
 ASSI (
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )(
   (( segid "    " and resid 1157 and name HB2 ))
  OR 
   (( segid "    " and resid 1128 and name HB1 ))
  OR 
   (( segid "    " and resid 1124 and name HD2 ))
  OR 
   (( segid "    " and resid 1113 and name HD2 ))
 )
      6.000     6.000     0.000 peak  9122 weight  0.10000E+01 volume -0.22300E+00 ppm1      6.820 ppm2      2.928
 ASSI (
   (( segid "    " and resid 1129 and name HA  ))
 )(
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7020 weight  0.10000E+01 volume -0.27000E+00 ppm1      4.350 ppm2      1.548
 ASSI (
   (( segid "    " and resid 1129 and name HA  ))
 )(
   (( segid "    " and resid 1128 and name HB1 ))
  OR 
   (( segid "    " and resid 1108 and name HE2 ))
  OR 
   (( segid "    " and resid 1108 and name HE1 ))
 )
      6.000     6.000     0.000 peak  7017 weight  0.10000E+01 volume -0.22800E+00 ppm1      4.348 ppm2      2.924
 ASSI (
   (( segid "    " and resid 1129 and name HA  ))
 )(
   (( segid "    " and resid 1129 and name HN  ))
 )
      5.000     5.000     0.000 peak  7014 weight  0.10000E+01 volume -0.77100E+00 ppm1      4.351 ppm2      8.334
 ASSI (
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
 )(
   (( segid "    " and resid 1128 and name HA  ))
 )
      5.000     5.000     0.000 peak  9097 weight  0.10000E+01 volume  0.77200E+00 ppm1      1.384 ppm2      4.615
 ASSI (
   (( segid "    " and resid 1130 and name HA  ))
 )(
   (( segid "    " and resid 1130 and name HG1 ))
  OR 
   (( segid "    " and resid 1109 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7012 weight  0.10000E+01 volume -0.27900E+00 ppm1      3.966 ppm2      2.046
 ASSI (
   (( segid "    " and resid 1130 and name HB1 ))
 )(
   (( segid "    " and resid 1130 and name HG2 ))
  OR 
   (( segid "    " and resid 1130 and name HB2 ))
 )
      2.700     2.700     0.000 peak  9450 weight  0.10000E+01 volume  0.54990E+01 ppm1      2.285 ppm2      1.893
 ASSI (
   (( segid "    " and resid 1130 and name HB2 ))
 )(
   (( segid "    " and resid 1130 and name HB1 ))
 )
      2.700     2.700     0.000 peak  9458 weight  0.10000E+01 volume  0.46410E+01 ppm1      1.891 ppm2      2.286
 ASSI (
   (( segid "    " and resid 1130 and name HD2 ))
 )(
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9658 weight  0.10000E+01 volume -0.48900E+00 ppm1      3.402 ppm2      1.554
 ASSI (
   (( segid "    " and resid 1130 and name HD2 ))
 )(
   (( segid "    " and resid 1130 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9650 weight  0.10000E+01 volume -0.44800E+00 ppm1      3.407 ppm2      2.274
 ASSI (
   (( segid "    " and resid 1130 and name HD2 ))
 )(
   (( segid "    " and resid 1130 and name HA  ))
 )
      6.000     6.000     0.000 peak  9656 weight  0.10000E+01 volume -0.33400E+00 ppm1      3.409 ppm2      3.968
 ASSI (
   (( segid "    " and resid 1130 and name HG1 ))
 )(
   (( segid "    " and resid 1129 and name HA  ))
 )
      5.000     5.000     0.000 peak  7025 weight  0.10000E+01 volume  0.44900E+00 ppm1      2.030 ppm2      4.337
 ASSI (
   (( segid "    " and resid 1131 and name HA  ))
 )(
   (( segid "    " and resid 1152 and name HA  ))
  OR 
   (( segid "    " and resid 1130 and name HA  ))
 )
      5.000     5.000     0.000 peak  7003 weight  0.10000E+01 volume -0.76800E+00 ppm1      3.804 ppm2      3.962
 ASSI (
   (( segid "    " and resid 1131 and name HB3 ))
  OR 
   (( segid "    " and resid 1131 and name HB2 ))
  OR 
   (( segid "    " and resid 1131 and name HB1 ))
 )(
   (( segid "    " and resid 1152 and name HB1 ))
  OR 
   (( segid "    " and resid 1130 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7009 weight  0.10000E+01 volume  0.23600E+00 ppm1      1.613 ppm2      2.297
 ASSI (
   (( segid "    " and resid 1132 and name HB1 ))
 )(
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9072 weight  0.10000E+01 volume -0.19500E+00 ppm1      4.204 ppm2      1.394
 ASSI (
   (( segid "    " and resid 1132 and name HB1 ))
 )(
   (( segid "    " and resid 1132 and name HB2 ))
 )
      3.300     3.300     0.000 peak  9065 weight  0.10000E+01 volume -0.25470E+01 ppm1      4.203 ppm2      4.027
 ASSI (
   (( segid "    " and resid 1132 and name HB1 ))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9073 weight  0.10000E+01 volume -0.41200E+00 ppm1      4.205 ppm2      7.124
 ASSI (
   (( segid "    " and resid 1132 and name HB1 ))
 )(
   (( segid "    " and resid 1152 and name HN  ))
  OR 
   (( segid "    " and resid 1129 and name HN  ))
 )
      6.000     6.000     0.000 peak  9077 weight  0.10000E+01 volume -0.21300E+00 ppm1      4.206 ppm2      8.335
 ASSI (
   (( segid "    " and resid 1132 and name HB2 ))
 )(
   (( segid "    " and resid 1128 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9071 weight  0.10000E+01 volume -0.26600E+00 ppm1      4.028 ppm2      2.942
 ASSI (
   (( segid "    " and resid 1132 and name HB2 ))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9074 weight  0.10000E+01 volume -0.30100E+00 ppm1      4.028 ppm2      7.120
 ASSI (
   (( segid "    " and resid 1133 and name HA  ))
 )(
   (( segid "    " and resid 1157 and name HH2 ))
 )
      5.000     5.000     0.000 peak  6241 weight  0.10000E+01 volume -0.59400E+00 ppm1      6.015 ppm2      6.737
 ASSI (
   (( segid "    " and resid 1133 and name HB1 ))
 )(
   (( segid "    " and resid 1149 and name HG2 ))
 )
      5.000     5.000     0.000 peak  7188 weight  0.10000E+01 volume -0.42100E+00 ppm1      3.823 ppm2      1.390
 ASSI (
   (( segid "    " and resid 1133 and name HB1 ))
 )(
   (( segid "    " and resid 1149 and name HB1 ))
  OR 
   (( segid "    " and resid 1135 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7192 weight  0.10000E+01 volume -0.16400E+00 ppm1      3.822 ppm2      1.710
 ASSI (
   (( segid "    " and resid 1133 and name HB1 ))
 )(
   (( segid "    " and resid 1149 and name HD2 ))
  OR 
   (( segid "    " and resid 1149 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7186 weight  0.10000E+01 volume -0.67800E+00 ppm1      3.822 ppm2      3.148
 ASSI (
   (( segid "    " and resid 1133 and name HB1 ))
 )(
   (( segid "    " and resid 1132 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7185 weight  0.10000E+01 volume -0.17900E+00 ppm1      3.820 ppm2      4.008
 ASSI (
   (( segid "    " and resid 1133 and name HB1 ))
 )(
   (( segid "    " and resid 1135 and name HN  ))
  OR 
   (( segid "    " and resid 1134 and name HN  ))
 )
      5.000     5.000     0.000 peak  7199 weight  0.10000E+01 volume -0.68900E+00 ppm1      3.822 ppm2      8.260
 ASSI (
   (( segid "    " and resid 1133 and name HB1 ))
 )(
   (( segid "    " and resid 1133 and name HN  ))
 )
      5.000     5.000     0.000 peak  7196 weight  0.10000E+01 volume -0.54400E+00 ppm1      3.822 ppm2      8.486
 ASSI (
   (( segid "    " and resid 1133 and name HB2 ))
 )(
   (( segid "    " and resid 1149 and name HG2 ))
 )
      5.000     5.000     0.000 peak  7189 weight  0.10000E+01 volume -0.46700E+00 ppm1      3.755 ppm2      1.390
 ASSI (
   (( segid "    " and resid 1133 and name HB2 ))
 )(
   (( segid "    " and resid 1149 and name HB1 ))
  OR 
   (( segid "    " and resid 1135 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7193 weight  0.10000E+01 volume -0.24000E+00 ppm1      3.755 ppm2      1.712
 ASSI (
   (( segid "    " and resid 1133 and name HB2 ))
 )(
   (( segid "    " and resid 1149 and name HD2 ))
  OR 
   (( segid "    " and resid 1149 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7187 weight  0.10000E+01 volume -0.66600E+00 ppm1      3.754 ppm2      3.146
 ASSI (
   (( segid "    " and resid 1133 and name HB2 ))
 )(
   (( segid "    " and resid 1148 and name HA  ))
  OR 
   (( segid "    " and resid 1132 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7184 weight  0.10000E+01 volume -0.15600E+00 ppm1      3.742 ppm2      4.008
 ASSI (
   (( segid "    " and resid 1133 and name HB2 ))
 )(
   (( segid "    " and resid 1134 and name HN  ))
 )
      5.000     5.000     0.000 peak  7198 weight  0.10000E+01 volume -0.85400E+00 ppm1      3.754 ppm2      8.270
 ASSI (
   (( segid "    " and resid 1133 and name HB2 ))
 )(
   (( segid "    " and resid 1133 and name HN  ))
 )
      5.000     5.000     0.000 peak  7197 weight  0.10000E+01 volume -0.57400E+00 ppm1      3.754 ppm2      8.485
 ASSI (
   (( segid "    " and resid 1134 and name HB  ))
 )(
   (( segid "    " and resid 1134 and name HA  ))
 )
      5.000     5.000     0.000 peak  8699 weight  0.10000E+01 volume  0.84400E+00 ppm1      1.573 ppm2      4.387
 ASSI (
   (( segid "    " and resid 1134 and name HB  ))
 )(
   (( segid "    " and resid 1135 and name HN  ))
  OR 
   (( segid "    " and resid 1134 and name HN  ))
 )
      5.000     5.000     0.000 peak  9056 weight  0.10000E+01 volume  0.11970E+01 ppm1      1.573 ppm2      8.286
 ASSI (
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      2.700     2.700     0.000 peak  9055 weight  0.10000E+01 volume  0.53460E+01 ppm1      0.578 ppm2      0.102
 ASSI (
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )(
   (( segid "    " and resid 1135 and name HN  ))
  OR 
   (( segid "    " and resid 1134 and name HN  ))
  OR 
   (( segid "    " and resid 1121 and name HN  ))
 )
      5.000     5.000     0.000 peak  9054 weight  0.10000E+01 volume  0.10100E+01 ppm1      0.577 ppm2      8.283
 ASSI (
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )(
   (( segid "    " and resid 1150 and name HG11))
 )
      5.000     5.000     0.000 peak  7771 weight  0.10000E+01 volume  0.65200E+00 ppm1      0.099 ppm2      0.868
 ASSI (
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )(
   (( segid "    " and resid 1157 and name HH2 ))
  OR 
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )
      6.000     6.000     0.000 peak  7763 weight  0.10000E+01 volume  0.29300E+00 ppm1      0.100 ppm2      6.768
 ASSI (
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )(
   (( segid "    " and resid 1135 and name HN  ))
  OR 
   (( segid "    " and resid 1134 and name HN  ))
 )
      5.000     5.000     0.000 peak  7761 weight  0.10000E+01 volume  0.98000E+00 ppm1      0.102 ppm2      8.278
 ASSI (
   (( segid "    " and resid 1135 and name HA  ))
 )(
   (( segid "    " and resid 1149 and name HG1 ))
  OR 
   (( segid "    " and resid 1149 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
  OR 
   (( segid "    " and resid 1134 and name HB  ))
 )
      5.000     5.000     0.000 peak  6435 weight  0.10000E+01 volume -0.56400E+00 ppm1      5.358 ppm2      1.586
 ASSI (
   (( segid "    " and resid 1135 and name HA  ))
 )(
   (( segid "    " and resid 1135 and name HG2 ))
 )
      5.000     5.000     0.000 peak  6279 weight  0.10000E+01 volume -0.50300E+00 ppm1      5.358 ppm2      2.059
 ASSI (
   (( segid "    " and resid 1135 and name HA  ))
 )(
   (( segid "    " and resid 1148 and name HB1 ))
  OR 
   (( segid "    " and resid 1135 and name HG1 ))
 )
      6.000     6.000     0.000 peak  6278 weight  0.10000E+01 volume -0.38700E+00 ppm1      5.357 ppm2      2.168
 ASSI (
   (( segid "    " and resid 1135 and name HA  ))
 )(
   (( segid "    " and resid 1161 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6277 weight  0.10000E+01 volume -0.34200E+00 ppm1      5.356 ppm2      2.443
 ASSI (
   (( segid "    " and resid 1135 and name HA  ))
 )(
   (( segid "    " and resid 1135 and name HN  ))
  OR 
   (( segid "    " and resid 1134 and name HN  ))
 )
      5.000     5.000     0.000 peak  6434 weight  0.10000E+01 volume -0.52800E+00 ppm1      5.357 ppm2      8.291
 ASSI (
   (( segid "    " and resid 1135 and name HA  ))
 )(
   (( segid "    " and resid 1136 and name HN  ))
 )
      3.300     3.300     0.000 peak  6275 weight  0.10000E+01 volume -0.22100E+01 ppm1      5.358 ppm2      8.364
 ASSI (
   (( segid "    " and resid 1135 and name HB1 ))
 )(
   (( segid "    " and resid 1149 and name HA  ))
  OR 
   (( segid "    " and resid 1135 and name HA  ))
 )
      5.000     5.000     0.000 peak  6282 weight  0.10000E+01 volume  0.75700E+00 ppm1      1.846 ppm2      5.368
 ASSI (
   (( segid "    " and resid 1135 and name HB2 ))
 )(
   (( segid "    " and resid 1149 and name HA  ))
  OR 
   (( segid "    " and resid 1135 and name HA  ))
 )
      5.000     5.000     0.000 peak  6283 weight  0.10000E+01 volume  0.10700E+01 ppm1      1.742 ppm2      5.373
 ASSI (
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
  OR 
   (( segid "    " and resid 1150 and name HG12))
  OR 
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )
      5.000     5.000     0.000 peak  6456 weight  0.10000E+01 volume  0.54000E+00 ppm1      2.455 ppm2      0.762
 ASSI (
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      6.000     6.000     0.000 peak  6457 weight  0.10000E+01 volume  0.32000E+00 ppm1      2.453 ppm2      0.963
 ASSI (
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      6.000     6.000     0.000 peak  7701 weight  0.10000E+01 volume -0.28800E+00 ppm1      6.597 ppm2      0.107
 ASSI (
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
  OR 
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )
      5.000     5.000     0.000 peak  7699 weight  0.10000E+01 volume -0.48900E+00 ppm1      6.600 ppm2      0.441
 ASSI (
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
  OR 
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )
      6.000     6.000     0.000 peak  9647 weight  0.10000E+01 volume -0.17900E+00 ppm1      6.590 ppm2      0.609
 ASSI (
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
  OR 
   (( segid "    " and resid 1150 and name HG12))
  OR 
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
  OR 
   (( segid "    " and resid 1120 and name HG12))
 )
      5.000     5.000     0.000 peak  7698 weight  0.10000E+01 volume -0.46300E+00 ppm1      6.599 ppm2      0.751
 ASSI (
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )(
   (( segid "    " and resid 1150 and name HG11))
  OR 
   (( segid "    " and resid 1115 and name HG11))
 )
      6.000     6.000     0.000 peak  7697 weight  0.10000E+01 volume -0.25100E+00 ppm1      6.594 ppm2      0.860
 ASSI (
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      6.000     6.000     0.000 peak  7696 weight  0.10000E+01 volume -0.24400E+00 ppm1      6.601 ppm2      0.975
 ASSI (
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )(
   (( segid "    " and resid 1149 and name HG1 ))
  OR 
   (( segid "    " and resid 1149 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
  OR 
   (( segid "    " and resid 1144 and name HB2 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
  OR 
   (( segid "    " and resid 1134 and name HB  ))
  OR 
   (( segid "    " and resid 1115 and name HB  ))
 )
      6.000     6.000     0.000 peak  7695 weight  0.10000E+01 volume -0.37600E+00 ppm1      6.599 ppm2      1.608
 ASSI (
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )(
   (( segid "    " and resid 1136 and name HA  ))
  OR 
   (( segid "    " and resid 1119 and name HA  ))
 )
      5.000     5.000     0.000 peak  6390 weight  0.10000E+01 volume -0.43000E+00 ppm1      6.599 ppm2      4.999
 ASSI (
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )(
   (( segid "    " and resid 1149 and name HA  ))
  OR 
   (( segid "    " and resid 1135 and name HA  ))
 )
      6.000     6.000     0.000 peak  7693 weight  0.10000E+01 volume -0.14700E+00 ppm1      6.599 ppm2      5.378
 ASSI (
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      5.000     5.000     0.000 peak  7736 weight  0.10000E+01 volume -0.47100E+00 ppm1      6.432 ppm2      0.105
 ASSI (
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      6.000     6.000     0.000 peak  7735 weight  0.10000E+01 volume -0.17900E+00 ppm1      6.428 ppm2      0.193
 ASSI (
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )
      5.000     5.000     0.000 peak  7734 weight  0.10000E+01 volume -0.11040E+01 ppm1      6.433 ppm2      0.441
 ASSI (
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
  OR 
   (( segid "    " and resid 1150 and name HG12))
  OR 
   (( segid "    " and resid 1120 and name HG12))
 )
      5.000     5.000     0.000 peak  7733 weight  0.10000E+01 volume -0.52700E+00 ppm1      6.432 ppm2      0.758
 ASSI (
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )(
   (( segid "    " and resid 1150 and name HG11))
  OR 
   (( segid "    " and resid 1115 and name HG11))
 )
      6.000     6.000     0.000 peak  7732 weight  0.10000E+01 volume -0.33700E+00 ppm1      6.432 ppm2      0.872
 ASSI (
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )(
   (( segid "    " and resid 1120 and name HG11))
 )
      6.000     6.000     0.000 peak  7731 weight  0.10000E+01 volume -0.29200E+00 ppm1      6.424 ppm2      1.390
 ASSI (
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )(
   (( segid "    " and resid 1134 and name HB  ))
  OR 
   (( segid "    " and resid 1120 and name HB  ))
  OR 
   (( segid "    " and resid 1115 and name HB  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )
      6.000     6.000     0.000 peak  7730 weight  0.10000E+01 volume -0.20200E+00 ppm1      6.432 ppm2      1.542
 ASSI (
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )(
   (( segid "    " and resid 1161 and name HD2 ))
  OR 
   (( segid "    " and resid 1159 and name HG2 ))
  OR 
   (( segid "    " and resid 1159 and name HG1 ))
  OR 
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7729 weight  0.10000E+01 volume -0.29400E+00 ppm1      6.432 ppm2      2.459
 ASSI (
   (( segid "    " and resid 1137 and name HA  ))
 )(
   (( segid "    " and resid 1137 and name HG2 ))
  OR 
   (( segid "    " and resid 1137 and name HG1 ))
 )
      5.000     5.000     0.000 peak  6971 weight  0.10000E+01 volume -0.56500E+00 ppm1      4.528 ppm2      2.234
 ASSI (
   (( segid "    " and resid 1137 and name HA  ))
 )(
   (( segid "    " and resid 1163 and name HB2 ))
  OR 
   (( segid "    " and resid 1138 and name HB2 ))
  OR 
   (( segid "    " and resid 1119 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6972 weight  0.10000E+01 volume -0.66400E+00 ppm1      4.524 ppm2      2.540
 ASSI (
   (( segid "    " and resid 1137 and name HA  ))
 )(
   (( segid "    " and resid 1138 and name HN  ))
 )
      2.700     2.700     0.000 peak  6974 weight  0.10000E+01 volume -0.37460E+01 ppm1      4.528 ppm2      8.884
 ASSI (
   (( segid "    " and resid 1138 and name HA  ))
 )(
   (( segid "    " and resid 1144 and name HB2 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
  OR 
   (( segid "    " and resid 1139 and name HB2 ))
 )
      6.000     6.000     0.000 peak  9037 weight  0.10000E+01 volume -0.22100E+00 ppm1      5.149 ppm2      1.616
 ASSI (
   (( segid "    " and resid 1138 and name HA  ))
 )(
   (( segid "    " and resid 1142 and name HB2 ))
  OR 
   (( segid "    " and resid 1139 and name HG1 ))
  OR 
   (( segid "    " and resid 1137 and name HG2 ))
  OR 
   (( segid "    " and resid 1137 and name HG1 ))
 )
      6.000     6.000     0.000 peak  6351 weight  0.10000E+01 volume -0.23200E+00 ppm1      5.140 ppm2      2.280
 ASSI (
   (( segid "    " and resid 1138 and name HA  ))
 )(
   (( segid "    " and resid 1138 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6341 weight  0.10000E+01 volume -0.54300E+00 ppm1      5.140 ppm2      2.972
 ASSI (
   (( segid "    " and resid 1139 and name HG1 ))
 )(
   (( segid "    " and resid 1142 and name HN  ))
  OR 
   (( segid "    " and resid 1140 and name HN  ))
 )
      6.000     6.000     0.000 peak  9436 weight  0.10000E+01 volume  0.21600E+00 ppm1      2.288 ppm2      8.473
 ASSI (
   (( segid "    " and resid 1139 and name HG2 ))
 )(
   (( segid "    " and resid 1142 and name HD1 ))
  OR 
   (( segid "    " and resid 1139 and name HE22))
 )
      6.000     6.000     0.000 peak  9433 weight  0.10000E+01 volume  0.31400E+00 ppm1      2.163 ppm2      6.673
 ASSI (
   (( segid "    " and resid 1139 and name HG2 ))
 )(
   (( segid "    " and resid 1140 and name HN  ))
 )
      6.000     6.000     0.000 peak  9437 weight  0.10000E+01 volume  0.26000E+00 ppm1      2.159 ppm2      8.486
 ASSI (
   (( segid "    " and resid 1141 and name HA  ))
 )(
   (( segid "    " and resid 1192 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HB2 ))
  OR 
   (( segid "    " and resid 1139 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8992 weight  0.10000E+01 volume -0.40000E+00 ppm1      3.691 ppm2      1.652
 ASSI (
   (( segid "    " and resid 1141 and name HA  ))
 )(
   (( segid "    " and resid 1192 and name HD2 ))
  OR 
   (( segid "    " and resid 1192 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8990 weight  0.10000E+01 volume -0.35200E+00 ppm1      3.687 ppm2      3.140
 ASSI (
   (( segid "    " and resid 1141 and name HA  ))
 )(
   (( segid "    " and resid 1142 and name HN  ))
  OR 
   (( segid "    " and resid 1140 and name HN  ))
 )
      5.000     5.000     0.000 peak  8989 weight  0.10000E+01 volume -0.41600E+00 ppm1      3.692 ppm2      8.458
 ASSI (
   (( segid "    " and resid 1141 and name HB1 ))
 )(
   (( segid "    " and resid 1166 and name HG2 ))
  OR 
   (( segid "    " and resid 1141 and name HG  ))
 )
      5.000     5.000     0.000 peak  9002 weight  0.10000E+01 volume  0.67600E+00 ppm1      2.076 ppm2      1.421
 ASSI (
   (( segid "    " and resid 1141 and name HB2 ))
 )(
   (( segid "    " and resid 1166 and name HG2 ))
  OR 
   (( segid "    " and resid 1141 and name HG  ))
 )
      5.000     5.000     0.000 peak  9001 weight  0.10000E+01 volume  0.74400E+00 ppm1      1.192 ppm2      1.421
 ASSI (
   (( segid "    " and resid 1141 and name HB2 ))
 )(
   (( segid "    " and resid 1166 and name HB2 ))
 )
      6.000     6.000     0.000 peak  9007 weight  0.10000E+01 volume  0.25100E+00 ppm1      1.181 ppm2      1.787
 ASSI (
   (( segid "    " and resid 1141 and name HB2 ))
 )(
   (( segid "    " and resid 1141 and name HB1 ))
 )
      3.300     3.300     0.000 peak  3675 weight  0.10000E+01 volume  0.19040E+01 ppm1      1.193 ppm2      2.083
 ASSI (
   (( segid "    " and resid 1141 and name HB2 ))
 )(
   (( segid "    " and resid 1166 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9006 weight  0.10000E+01 volume  0.34200E+00 ppm1      1.181 ppm2      2.205
 ASSI (
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )(
   (( segid "    " and resid 1141 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9015 weight  0.10000E+01 volume  0.12900E+01 ppm1      0.437 ppm2      1.201
 ASSI (
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )(
   (( segid "    " and resid 1141 and name HG  ))
 )
      3.300     3.300     0.000 peak  7858 weight  0.10000E+01 volume  0.22770E+01 ppm1      0.435 ppm2      1.418
 ASSI (
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )(
   (( segid "    " and resid 1141 and name HB1 ))
 )
      3.300     3.300     0.000 peak  7856 weight  0.10000E+01 volume  0.18180E+01 ppm1      0.433 ppm2      2.082
 ASSI (
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )(
   (( segid "    " and resid 1167 and name HB2 ))
  OR 
   (( segid "    " and resid 1140 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7854 weight  0.10000E+01 volume  0.40000E+00 ppm1      0.432 ppm2      2.711
 ASSI (
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )(
   (( segid "    " and resid 1190 and name HB2 ))
  OR 
   (( segid "    " and resid 1190 and name HB1 ))
  OR 
   (( segid "    " and resid 1167 and name HB1 ))
  OR 
   (( segid "    " and resid 1140 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7855 weight  0.10000E+01 volume  0.10920E+01 ppm1      0.432 ppm2      2.811
 ASSI (
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1166 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9645 weight  0.10000E+01 volume  0.32000E+00 ppm1      0.627 ppm2      2.221
 ASSI (
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1140 and name HB2 ))
 )
      6.000     6.000     0.000 peak  9644 weight  0.10000E+01 volume  0.26700E+00 ppm1      0.627 ppm2      2.671
 ASSI (
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1190 and name HB2 ))
  OR 
   (( segid "    " and resid 1190 and name HB1 ))
  OR 
   (( segid "    " and resid 1140 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9024 weight  0.10000E+01 volume  0.32700E+00 ppm1      0.629 ppm2      2.806
 ASSI (
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1192 and name HD2 ))
  OR 
   (( segid "    " and resid 1192 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9636 weight  0.10000E+01 volume  0.44200E+00 ppm1      0.629 ppm2      3.130
 ASSI (
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1192 and name HA  ))
  OR 
   (( segid "    " and resid 1168 and name HA  ))
 )
      6.000     6.000     0.000 peak  9643 weight  0.10000E+01 volume  0.22100E+00 ppm1      0.627 ppm2      4.222
 ASSI (
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1141 and name HN  ))
 )
      5.000     5.000     0.000 peak  9640 weight  0.10000E+01 volume  0.77000E+00 ppm1      0.629 ppm2      8.289
 ASSI (
   (( segid "    " and resid 1142 and name HA  ))
 )(
   (( segid "    " and resid 1143 and name HN  ))
 )
      5.000     5.000     0.000 peak  8968 weight  0.10000E+01 volume -0.78200E+00 ppm1      4.368 ppm2      7.888
 ASSI (
   (( segid "    " and resid 1142 and name HA  ))
 )(
   (( segid "    " and resid 1142 and name HN  ))
 )
      6.000     6.000     0.000 peak  8969 weight  0.10000E+01 volume -0.30800E+00 ppm1      4.368 ppm2      8.437
 ASSI (
   (( segid "    " and resid 1142 and name HB1 ))
 )(
   (( segid "    " and resid 1142 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8976 weight  0.10000E+01 volume  0.46300E+00 ppm1      3.427 ppm2      2.272
 ASSI (
   (( segid "    " and resid 1142 and name HB1 ))
 )(
   (( segid "    " and resid 1163 and name HB2 ))
  OR 
   (( segid "    " and resid 1138 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8977 weight  0.10000E+01 volume  0.67100E+00 ppm1      3.427 ppm2      2.540
 ASSI (
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )(
   (( segid "    " and resid 1142 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8099 weight  0.10000E+01 volume -0.46800E+00 ppm1      6.667 ppm2      2.277
 ASSI (
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )(
   (( segid "    " and resid 1163 and name HB2 ))
  OR 
   (( segid "    " and resid 1138 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8100 weight  0.10000E+01 volume -0.40300E+00 ppm1      6.665 ppm2      2.518
 ASSI (
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )(
   (( segid "    " and resid 1166 and name HD1 ))
  OR 
   (( segid "    " and resid 1138 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8984 weight  0.10000E+01 volume -0.29100E+00 ppm1      6.670 ppm2      2.952
 ASSI (
   (( segid "    " and resid 1142 and name HE2 ))
  OR 
   (( segid "    " and resid 1142 and name HE1 ))
 )(
   (( segid "    " and resid 1141 and name HB1 ))
  OR 
   (( segid "    " and resid 1117 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7727 weight  0.10000E+01 volume -0.25300E+00 ppm1      6.188 ppm2      2.108
 ASSI (
   (( segid "    " and resid 1142 and name HE2 ))
  OR 
   (( segid "    " and resid 1142 and name HE1 ))
 )(
   (( segid "    " and resid 1165 and name HA  ))
 )
      6.000     6.000     0.000 peak  6231 weight  0.10000E+01 volume -0.14400E+00 ppm1      6.198 ppm2      4.021
 ASSI (
   (( segid "    " and resid 1142 and name HE2 ))
  OR 
   (( segid "    " and resid 1142 and name HE1 ))
 )(
   (( segid "    " and resid 1139 and name HE21))
  OR 
   (( segid "    " and resid 1117 and name HD21))
 )
      6.000     6.000     0.000 peak  7725 weight  0.10000E+01 volume -0.21000E+00 ppm1      6.195 ppm2      7.416
 ASSI (
   (( segid "    " and resid 1142 and name HE2 ))
  OR 
   (( segid "    " and resid 1142 and name HE1 ))
 )(
   (( segid "    " and resid 1140 and name HD21))
 )
      6.000     6.000     0.000 peak  7726 weight  0.10000E+01 volume -0.14600E+00 ppm1      6.187 ppm2      7.705
 ASSI (
   (( segid "    " and resid 1143 and name HG2 ))
  OR 
   (( segid "    " and resid 1143 and name HG1 ))
 )(
   (( segid "    " and resid 1143 and name HB2 ))
 )
      3.300     3.300     0.000 peak  9423 weight  0.10000E+01 volume  0.16860E+01 ppm1      2.174 ppm2      1.665
 ASSI (
   (( segid "    " and resid 1143 and name HG2 ))
  OR 
   (( segid "    " and resid 1143 and name HG1 ))
 )(
   (( segid "    " and resid 1144 and name HA  ))
  OR 
   (( segid "    " and resid 1143 and name HA  ))
 )
      5.000     5.000     0.000 peak  9425 weight  0.10000E+01 volume  0.71400E+00 ppm1      2.173 ppm2      4.662
 ASSI (
   (( segid "    " and resid 1144 and name HB1 ))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      5.000     5.000     0.000 peak  8961 weight  0.10000E+01 volume  0.94500E+00 ppm1      1.613 ppm2      0.585
 ASSI (
   (( segid "    " and resid 1144 and name HB2 ))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      5.000     5.000     0.000 peak  8960 weight  0.10000E+01 volume  0.11720E+01 ppm1      1.589 ppm2      0.584
 ASSI (
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      2.700     2.700     0.000 peak  8535 weight  0.10000E+01 volume  0.36830E+01 ppm1      0.757 ppm2      0.584
 ASSI (
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )(
   (( segid "    " and resid 1144 and name HG  ))
 )
      3.300     3.300     0.000 peak  8534 weight  0.10000E+01 volume  0.16520E+01 ppm1      0.757 ppm2      1.333
 ASSI (
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )(
   (( segid "    " and resid 1148 and name HG1 ))
  OR 
   (( segid "    " and resid 1144 and name HB2 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
 )
      2.700     2.700     0.000 peak  8533 weight  0.10000E+01 volume  0.33820E+01 ppm1      0.762 ppm2      1.605
 ASSI (
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )(
   (( segid "    " and resid 1161 and name HB1 ))
  OR 
   (( segid "    " and resid 1160 and name HG1 ))
  OR 
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
  OR 
   (( segid "    " and resid 1137 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8532 weight  0.10000E+01 volume  0.14680E+01 ppm1      0.758 ppm2      1.806
 ASSI (
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )(
   (( segid "    " and resid 1161 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8530 weight  0.10000E+01 volume  0.85000E+00 ppm1      0.759 ppm2      2.453
 ASSI (
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )(
   (( segid "    " and resid 1161 and name HA  ))
  OR 
   (( segid "    " and resid 1144 and name HA  ))
  OR 
   (( segid "    " and resid 1143 and name HA  ))
 )
      5.000     5.000     0.000 peak  8528 weight  0.10000E+01 volume  0.72800E+00 ppm1      0.756 ppm2      4.640
 ASSI (
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )(
   (( segid "    " and resid 1144 and name HG  ))
 )
      3.300     3.300     0.000 peak  8522 weight  0.10000E+01 volume  0.20940E+01 ppm1      0.580 ppm2      1.338
 ASSI (
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )(
   (( segid "    " and resid 1148 and name HG2 ))
 )
      3.300     3.300     0.000 peak  8523 weight  0.10000E+01 volume  0.17300E+01 ppm1      0.581 ppm2      1.502
 ASSI (
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )(
   (( segid "    " and resid 1161 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
  OR 
   (( segid "    " and resid 1144 and name HB2 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
 )
      2.700     2.700     0.000 peak  8521 weight  0.10000E+01 volume  0.44140E+01 ppm1      0.580 ppm2      1.598
 ASSI (
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )(
   (( segid "    " and resid 1161 and name HB1 ))
  OR 
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
  OR 
   (( segid "    " and resid 1145 and name HB2 ))
  OR 
   (( segid "    " and resid 1137 and name HB2 ))
 )
      3.300     3.300     0.000 peak  8520 weight  0.10000E+01 volume  0.28910E+01 ppm1      0.580 ppm2      1.817
 ASSI (
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )(
   (( segid "    " and resid 1148 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8518 weight  0.10000E+01 volume  0.11510E+01 ppm1      0.578 ppm2      2.119
 ASSI (
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )(
   (( segid "    " and resid 1161 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8519 weight  0.10000E+01 volume  0.39700E+00 ppm1      0.580 ppm2      2.463
 ASSI (
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )(
   (( segid "    " and resid 1148 and name HA  ))
 )
      3.300     3.300     0.000 peak  6888 weight  0.10000E+01 volume  0.21550E+01 ppm1      0.583 ppm2      3.975
 ASSI (
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )(
   (( segid "    " and resid 1162 and name HA  ))
  OR 
   (( segid "    " and resid 1147 and name HA  ))
  OR 
   (( segid "    " and resid 1137 and name HA  ))
 )
      5.000     5.000     0.000 peak  8514 weight  0.10000E+01 volume  0.90200E+00 ppm1      0.581 ppm2      4.572
 ASSI (
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )(
   (( segid "    " and resid 1161 and name HA  ))
  OR 
   (( segid "    " and resid 1145 and name HA  ))
  OR 
   (( segid "    " and resid 1144 and name HA  ))
  OR 
   (( segid "    " and resid 1143 and name HA  ))
 )
      5.000     5.000     0.000 peak  8513 weight  0.10000E+01 volume  0.12330E+01 ppm1      0.580 ppm2      4.669
 ASSI (
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )(
   (( segid "    " and resid 1148 and name HN  ))
 )
      5.000     5.000     0.000 peak  8517 weight  0.10000E+01 volume  0.61600E+00 ppm1      0.578 ppm2      8.149
 ASSI (
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )(
   (( segid "    " and resid 1146 and name HN  ))
  OR 
   (( segid "    " and resid 1144 and name HN  ))
 )
      5.000     5.000     0.000 peak  8516 weight  0.10000E+01 volume  0.77500E+00 ppm1      0.581 ppm2      8.562
 ASSI (
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )(
   (( segid "    " and resid 1145 and name HN  ))
 )
      5.000     5.000     0.000 peak  8515 weight  0.10000E+01 volume  0.52600E+00 ppm1      0.581 ppm2      9.416
 ASSI (
   (( segid "    " and resid 1145 and name HA  ))
 )(
   (( segid "    " and resid 1145 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8951 weight  0.10000E+01 volume -0.11550E+01 ppm1      4.699 ppm2      1.793
 ASSI (
   (( segid "    " and resid 1145 and name HA  ))
 )(
   (( segid "    " and resid 1145 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8948 weight  0.10000E+01 volume -0.11560E+01 ppm1      4.703 ppm2      2.260
 ASSI (
   (( segid "    " and resid 1145 and name HB2 ))
 )(
   (( segid "    " and resid 1145 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG1 ))
 )
      5.000     5.000     0.000 peak  9415 weight  0.10000E+01 volume  0.15050E+01 ppm1      1.793 ppm2      2.261
 ASSI (
   (( segid "    " and resid 1145 and name HB1 ))
 )(
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
  OR 
   (( segid "    " and resid 1144 and name HG  ))
 )
      5.000     5.000     0.000 peak  8954 weight  0.10000E+01 volume  0.42000E+00 ppm1      1.960 ppm2      1.375
 ASSI (
   (( segid "    " and resid 1145 and name HB1 ))
 )(
   (( segid "    " and resid 1145 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG1 ))
 )
      3.300     3.300     0.000 peak  9414 weight  0.10000E+01 volume  0.18390E+01 ppm1      1.958 ppm2      2.255
 ASSI (
   (( segid "    " and resid 1146 and name HA1 ))
 )(
   (( segid "    " and resid 1146 and name HA2 ))
 )
      2.700     2.700     0.000 peak  8940 weight  0.10000E+01 volume  0.37640E+01 ppm1      4.449 ppm2      3.633
 ASSI (
   (( segid "    " and resid 1146 and name HA1 ))
 )(
   (( segid "    " and resid 1147 and name HN  ))
 )
      5.000     5.000     0.000 peak  8947 weight  0.10000E+01 volume  0.15630E+01 ppm1      4.451 ppm2      8.360
 ASSI (
   (( segid "    " and resid 1146 and name HA2 ))
 )(
   (( segid "    " and resid 1161 and name HB1 ))
  OR 
   (( segid "    " and resid 1145 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8941 weight  0.10000E+01 volume  0.18400E+00 ppm1      3.628 ppm2      1.795
 ASSI (
   (( segid "    " and resid 1146 and name HA2 ))
 )(
   (( segid "    " and resid 1145 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG1 ))
 )
      6.000     6.000     0.000 peak  8942 weight  0.10000E+01 volume  0.23800E+00 ppm1      3.628 ppm2      2.263
 ASSI (
   (( segid "    " and resid 1146 and name HA2 ))
 )(
   (( segid "    " and resid 1147 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8943 weight  0.10000E+01 volume  0.22000E+00 ppm1      3.628 ppm2      2.754
 ASSI (
   (( segid "    " and resid 1146 and name HA2 ))
 )(
   (( segid "    " and resid 1145 and name HA  ))
 )
      5.000     5.000     0.000 peak  8939 weight  0.10000E+01 volume  0.55700E+00 ppm1      3.625 ppm2      4.686
 ASSI (
   (( segid "    " and resid 1146 and name HA2 ))
 )(
   (( segid "    " and resid 1147 and name HN  ))
 )
      5.000     5.000     0.000 peak  8945 weight  0.10000E+01 volume  0.12410E+01 ppm1      3.628 ppm2      8.360
 ASSI (
   (( segid "    " and resid 1147 and name HA  ))
 )(
   (( segid "    " and resid 1161 and name HB2 ))
  OR 
   (( segid "    " and resid 1149 and name HG1 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7043 weight  0.10000E+01 volume -0.52800E+00 ppm1      4.553 ppm2      1.566
 ASSI (
   (( segid "    " and resid 1147 and name HA  ))
 )(
   (( segid "    " and resid 1161 and name HB1 ))
  OR 
   (( segid "    " and resid 1160 and name HG1 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
  OR 
   (( segid "    " and resid 1145 and name HB2 ))
  OR 
   (( segid "    " and resid 1135 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7042 weight  0.10000E+01 volume -0.35100E+00 ppm1      4.555 ppm2      1.842
 ASSI (
   (( segid "    " and resid 1147 and name HB1 ))
 )(
   (( segid "    " and resid 1147 and name HB2 ))
 )
      2.700     2.700     0.000 peak  8925 weight  0.10000E+01 volume  0.67500E+01 ppm1      2.936 ppm2      2.750
 ASSI (
   (( segid "    " and resid 1147 and name HB2 ))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
  OR 
   (( segid "    " and resid 1150 and name HG12))
  OR 
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )
      6.000     6.000     0.000 peak  8926 weight  0.10000E+01 volume  0.34200E+00 ppm1      2.749 ppm2      0.755
 ASSI (
   (( segid "    " and resid 1147 and name HB2 ))
 )(
   (( segid "    " and resid 1147 and name HD21))
 )
      5.000     5.000     0.000 peak  8920 weight  0.10000E+01 volume  0.71500E+00 ppm1      2.753 ppm2      7.847
 ASSI (
   (( segid "    " and resid 1147 and name HB2 ))
 )(
   (( segid "    " and resid 1147 and name HN  ))
 )
      3.300     3.300     0.000 peak  8917 weight  0.10000E+01 volume  0.24580E+01 ppm1      2.747 ppm2      8.355
 ASSI (
   (( segid "    " and resid 1148 and name HA  ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      6.000     6.000     0.000 peak  6884 weight  0.10000E+01 volume -0.33000E+00 ppm1      3.966 ppm2      0.976
 ASSI (
   (( segid "    " and resid 1148 and name HA  ))
 )(
   (( segid "    " and resid 1148 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6889 weight  0.10000E+01 volume -0.19760E+01 ppm1      3.967 ppm2      2.104
 ASSI (
   (( segid "    " and resid 1148 and name HA  ))
 )(
   (( segid "    " and resid 1161 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6890 weight  0.10000E+01 volume -0.43500E+00 ppm1      3.970 ppm2      2.454
 ASSI (
   (( segid "    " and resid 1148 and name HA  ))
 )(
   (( segid "    " and resid 1149 and name HN  ))
 )
      5.000     5.000     0.000 peak  8445 weight  0.10000E+01 volume -0.50600E+00 ppm1      3.969 ppm2      7.740
 ASSI (
   (( segid "    " and resid 1148 and name HB1 ))
 )(
   (( segid "    " and resid 1148 and name HG2 ))
 )
      5.000     5.000     0.000 peak  8911 weight  0.10000E+01 volume  0.79100E+00 ppm1      2.121 ppm2      1.485
 ASSI (
   (( segid "    " and resid 1148 and name HB1 ))
 )(
   (( segid "    " and resid 1148 and name HG1 ))
  OR 
   (( segid "    " and resid 1144 and name HB2 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8912 weight  0.10000E+01 volume  0.12320E+01 ppm1      2.121 ppm2      1.595
 ASSI (
   (( segid "    " and resid 1148 and name HB1 ))
 )(
   (( segid "    " and resid 1149 and name HN  ))
 )
      6.000     6.000     0.000 peak  8909 weight  0.10000E+01 volume  0.27300E+00 ppm1      2.123 ppm2      7.719
 ASSI (
   (( segid "    " and resid 1149 and name HA  ))
 )(
   (( segid "    " and resid 1136 and name HN  ))
 )
      5.000     5.000     0.000 peak  6270 weight  0.10000E+01 volume -0.10950E+01 ppm1      5.393 ppm2      8.374
 ASSI (
   (( segid "    " and resid 1150 and name HB  ))
 )(
   (( segid "    " and resid 1150 and name HA  ))
 )
      5.000     5.000     0.000 peak  8853 weight  0.10000E+01 volume  0.81800E+00 ppm1      2.031 ppm2      4.641
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      3.300     3.300     0.000 peak  8736 weight  0.10000E+01 volume  0.26970E+01 ppm1      0.443 ppm2      0.101
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
  OR 
   (( segid "    " and resid 1150 and name HG12))
 )
      2.700     2.700     0.000 peak  8734 weight  0.10000E+01 volume  0.42630E+01 ppm1      0.447 ppm2      0.771
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1150 and name HG11))
 )
      5.000     5.000     0.000 peak  8735 weight  0.10000E+01 volume  0.13300E+01 ppm1      0.444 ppm2      0.877
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1112 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8733 weight  0.10000E+01 volume  0.66100E+00 ppm1      0.438 ppm2      1.306
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1149 and name HG2 ))
  OR 
   (( segid "    " and resid 1120 and name HG11))
 )
      5.000     5.000     0.000 peak  8732 weight  0.10000E+01 volume  0.12410E+01 ppm1      0.438 ppm2      1.409
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1149 and name HG1 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
  OR 
   (( segid "    " and resid 1134 and name HB  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8731 weight  0.10000E+01 volume  0.75600E+00 ppm1      0.438 ppm2      1.554
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1160 and name HG2 ))
  OR 
   (( segid "    " and resid 1135 and name HB2 ))
  OR 
   (( segid "    " and resid 1113 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8730 weight  0.10000E+01 volume  0.58900E+00 ppm1      0.440 ppm2      1.764
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1160 and name HG1 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
  OR 
   (( segid "    " and resid 1135 and name HB1 ))
  OR 
   (( segid "    " and resid 1114 and name HB2 ))
  OR 
   (( segid "    " and resid 1113 and name HG2 ))
 )
      5.000     5.000     0.000 peak  8729 weight  0.10000E+01 volume  0.73800E+00 ppm1      0.444 ppm2      1.869
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1150 and name HB  ))
 )
      5.000     5.000     0.000 peak  8728 weight  0.10000E+01 volume  0.10820E+01 ppm1      0.440 ppm2      2.030
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1149 and name HD2 ))
  OR 
   (( segid "    " and resid 1149 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8727 weight  0.10000E+01 volume  0.37800E+00 ppm1      0.442 ppm2      3.153
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1160 and name HA  ))
  OR 
   (( segid "    " and resid 1159 and name HA  ))
  OR 
   (( segid "    " and resid 1158 and name HB1 ))
  OR 
   (( segid "    " and resid 1134 and name HA  ))
 )
      6.000     6.000     0.000 peak  8725 weight  0.10000E+01 volume  0.27600E+00 ppm1      0.445 ppm2      4.381
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1150 and name HA  ))
  OR 
   (( segid "    " and resid 1114 and name HA  ))
  OR 
   (( segid "    " and resid 1113 and name HA  ))
 )
      5.000     5.000     0.000 peak  8724 weight  0.10000E+01 volume  0.48900E+00 ppm1      0.446 ppm2      4.637
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1157 and name HA  ))
  OR 
   (( segid "    " and resid 1136 and name HA  ))
  OR 
   (( segid "    " and resid 1119 and name HA  ))
 )
      6.000     6.000     0.000 peak  6433 weight  0.10000E+01 volume  0.19200E+00 ppm1      0.452 ppm2      5.034
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )
      3.300     3.300     0.000 peak  8721 weight  0.10000E+01 volume  0.16820E+01 ppm1      0.439 ppm2      6.439
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7704 weight  0.10000E+01 volume  0.37400E+00 ppm1      0.445 ppm2      6.599
 ASSI (
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )(
   (( segid "    " and resid 1149 and name HG2 ))
 )
      6.000     6.000     0.000 peak  8860 weight  0.10000E+01 volume  0.30200E+00 ppm1      0.755 ppm2      1.395
 ASSI (
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )(
   (( segid "    " and resid 1161 and name HB2 ))
  OR 
   (( segid "    " and resid 1149 and name HG1 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
  OR 
   (( segid "    " and resid 1134 and name HB  ))
  OR 
   (( segid "    " and resid 1115 and name HB  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )
      6.000     6.000     0.000 peak  8861 weight  0.10000E+01 volume  0.35600E+00 ppm1      0.754 ppm2      1.555
 ASSI (
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )(
   (( segid "    " and resid 1160 and name HG2 ))
  OR 
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8862 weight  0.10000E+01 volume  0.51100E+00 ppm1      0.758 ppm2      1.772
 ASSI (
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )(
   (( segid "    " and resid 1161 and name HD2 ))
  OR 
   (( segid "    " and resid 1159 and name HG2 ))
  OR 
   (( segid "    " and resid 1159 and name HG1 ))
  OR 
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8863 weight  0.10000E+01 volume  0.39800E+00 ppm1      0.759 ppm2      2.458
 ASSI (
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )(
   (( segid "    " and resid 1157 and name HB2 ))
  OR 
   (( segid "    " and resid 1147 and name HB1 ))
  OR 
   (( segid "    " and resid 1113 and name HD2 ))
  OR 
   (( segid "    " and resid 1113 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8865 weight  0.10000E+01 volume  0.22200E+00 ppm1      0.758 ppm2      2.947
 ASSI (
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )(
   (( segid "    " and resid 1150 and name HA  ))
 )
      5.000     5.000     0.000 peak  8866 weight  0.10000E+01 volume  0.15730E+01 ppm1      0.757 ppm2      4.640
 ASSI (
   (( segid "    " and resid 1151 and name HA  ))
 )(
   (( segid "    " and resid 1152 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6260 weight  0.10000E+01 volume -0.19800E+00 ppm1      5.439 ppm2      2.323
 ASSI (
   (( segid "    " and resid 1151 and name HA  ))
 )(
   (( segid "    " and resid 1151 and name HB  ))
  OR 
   (( segid "    " and resid 1133 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6259 weight  0.10000E+01 volume -0.47100E+00 ppm1      5.437 ppm2      3.716
 ASSI (
   (( segid "    " and resid 1151 and name HA  ))
 )(
   (( segid "    " and resid 1157 and name HH2 ))
 )
      6.000     6.000     0.000 peak  6257 weight  0.10000E+01 volume -0.34600E+00 ppm1      5.435 ppm2      6.741
 ASSI (
   (( segid "    " and resid 1151 and name HB  ))
 )(
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )
      2.700     2.700     0.000 peak  8464 weight  0.10000E+01 volume -0.39500E+01 ppm1      3.706 ppm2      1.059
 ASSI (
   (( segid "    " and resid 1151 and name HB  ))
 )(
   (( segid "    " and resid 1153 and name HG2 ))
  OR 
   (( segid "    " and resid 1153 and name HG1 ))
  OR 
   (( segid "    " and resid 1149 and name HG1 ))
  OR 
   (( segid "    " and resid 1134 and name HB  ))
 )
      6.000     6.000     0.000 peak  8468 weight  0.10000E+01 volume -0.25400E+00 ppm1      3.702 ppm2      1.535
 ASSI (
   (( segid "    " and resid 1151 and name HB  ))
 )(
   (( segid "    " and resid 1151 and name HN  ))
 )
      5.000     5.000     0.000 peak  8465 weight  0.10000E+01 volume -0.10920E+01 ppm1      3.706 ppm2      8.437
 ASSI (
   (( segid "    " and resid 1153 and name HA  ))
 )(
   (( segid "    " and resid 1153 and name HG2 ))
  OR 
   (( segid "    " and resid 1153 and name HG1 ))
 )
      5.000     5.000     0.000 peak  2964 weight  0.10000E+01 volume -0.10350E+01 ppm1      4.514 ppm2      1.499
 ASSI (
   (( segid "    " and resid 1153 and name HA  ))
 )(
   (( segid "    " and resid 1153 and name HG1 ))
 )
      5.000     5.000     0.000 peak  2937 weight  0.10000E+01 volume -0.84700E+00 ppm1      4.516 ppm2      1.570
 ASSI (
   (( segid "    " and resid 1153 and name HA  ))
 )(
   (( segid "    " and resid 1156 and name HG2 ))
  OR 
   (( segid "    " and resid 1156 and name HG1 ))
  OR 
   (( segid "    " and resid 1152 and name HB1 ))
  OR 
   (( segid "    " and resid 1130 and name HB1 ))
 )
      6.000     6.000     0.000 peak  2855 weight  0.10000E+01 volume -0.24300E+00 ppm1      4.514 ppm2      2.296
 ASSI (
   (( segid "    " and resid 1153 and name HA  ))
 )(
   (( segid "    " and resid 1153 and name HD2 ))
  OR 
   (( segid "    " and resid 1153 and name HD1 ))
 )
      6.000     6.000     0.000 peak  2849 weight  0.10000E+01 volume -0.33000E+00 ppm1      4.518 ppm2      3.163
 ASSI (
   (( segid "    " and resid 1153 and name HA  ))
 )(
   (( segid "    " and resid 1152 and name HA  ))
  OR 
   (( segid "    " and resid 1130 and name HA  ))
 )
      6.000     6.000     0.000 peak  2796 weight  0.10000E+01 volume -0.38900E+00 ppm1      4.512 ppm2      3.951
 ASSI (
   (( segid "    " and resid 1153 and name HB2 ))
  OR 
   (( segid "    " and resid 1153 and name HB1 ))
 )(
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )
      5.000     5.000     0.000 peak  8837 weight  0.10000E+01 volume  0.62200E+00 ppm1      1.715 ppm2      1.060
 ASSI (
   (( segid "    " and resid 1154 and name HA  ))
 )(
   (( segid "    " and resid 1156 and name HN  ))
  OR 
   (( segid "    " and resid 1154 and name HD21))
  OR 
   (( segid "    " and resid 1108 and name HN  ))
 )
      6.000     6.000     0.000 peak  6994 weight  0.10000E+01 volume -0.20300E+00 ppm1      4.268 ppm2      7.541
 ASSI (
   (( segid "    " and resid 1154 and name HB1 ))
 )(
   (( segid "    " and resid 1154 and name HB2 ))
 )
      2.700     2.700     0.000 peak  8397 weight  0.10000E+01 volume  0.10515E+02 ppm1      3.020 ppm2      2.699
 ASSI (
   (( segid "    " and resid 1154 and name HB1 ))
 )(
   (( segid "    " and resid 1156 and name HN  ))
  OR 
   (( segid "    " and resid 1154 and name HD21))
 )
      5.000     5.000     0.000 peak  8398 weight  0.10000E+01 volume  0.42000E+00 ppm1      3.020 ppm2      7.557
 ASSI (
   (( segid "    " and resid 1154 and name HB2 ))
 )(
   (( segid "    " and resid 1154 and name HD22))
 )
      5.000     5.000     0.000 peak  8435 weight  0.10000E+01 volume  0.64000E+00 ppm1      2.695 ppm2      6.800
 ASSI (
   (( segid "    " and resid 1154 and name HB2 ))
 )(
   (( segid "    " and resid 1156 and name HN  ))
  OR 
   (( segid "    " and resid 1154 and name HD21))
 )
      5.000     5.000     0.000 peak  8457 weight  0.10000E+01 volume  0.11230E+01 ppm1      2.697 ppm2      7.557
 ASSI (
   (( segid "    " and resid 1155 and name HA2 ))
 )(
   (( segid "    " and resid 1157 and name HB1 ))
  OR 
   (( segid "    " and resid 1107 and name HA2 ))
 )
      6.000     6.000     0.000 peak  6989 weight  0.10000E+01 volume -0.36100E+00 ppm1      3.308 ppm2      3.485
 ASSI (
   (( segid "    " and resid 1156 and name HA  ))
 )(
   (( segid "    " and resid 1156 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7041 weight  0.10000E+01 volume -0.90000E+00 ppm1      4.601 ppm2      1.842
 ASSI (
   (( segid "    " and resid 1156 and name HA  ))
 )(
   (( segid "    " and resid 1156 and name HG2 ))
  OR 
   (( segid "    " and resid 1156 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7039 weight  0.10000E+01 volume -0.12360E+01 ppm1      4.602 ppm2      2.338
 ASSI (
   (( segid "    " and resid 1156 and name HA  ))
 )(
   (( segid "    " and resid 1157 and name HN  ))
 )
      2.700     2.700     0.000 peak  7052 weight  0.10000E+01 volume -0.41500E+01 ppm1      4.603 ppm2      8.555
 ASSI (
   (( segid "    " and resid 1156 and name HB1 ))
 )(
   (( segid "    " and resid 1156 and name HB2 ))
 )
      2.700     2.700     0.000 peak  8740 weight  0.10000E+01 volume  0.52010E+01 ppm1      2.094 ppm2      1.848
 ASSI (
   (( segid "    " and resid 1157 and name HA  ))
 )(
   (( segid "    " and resid 1152 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6426 weight  0.10000E+01 volume -0.23300E+00 ppm1      5.034 ppm2      0.942
 ASSI (
   (( segid "    " and resid 1157 and name HA  ))
 )(
   (( segid "    " and resid 1159 and name HB1 ))
  OR 
   (( segid "    " and resid 1150 and name HB  ))
  OR 
   (( segid "    " and resid 1109 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6425 weight  0.10000E+01 volume -0.22200E+00 ppm1      5.033 ppm2      2.031
 ASSI (
   (( segid "    " and resid 1157 and name HA  ))
 )(
   (( segid "    " and resid 1157 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6424 weight  0.10000E+01 volume -0.75600E+00 ppm1      5.033 ppm2      2.959
 ASSI (
   (( segid "    " and resid 1157 and name HA  ))
 )(
   (( segid "    " and resid 1158 and name HA  ))
  OR 
   (( segid "    " and resid 1153 and name HA  ))
  OR 
   (( segid "    " and resid 1109 and name HA  ))
 )
      6.000     6.000     0.000 peak  6421 weight  0.10000E+01 volume -0.35300E+00 ppm1      5.033 ppm2      4.494
 ASSI (
   (( segid "    " and resid 1157 and name HA  ))
 )(
   (( segid "    " and resid 1156 and name HA  ))
  OR 
   (( segid "    " and resid 1150 and name HA  ))
 )
      6.000     6.000     0.000 peak  6420 weight  0.10000E+01 volume -0.33200E+00 ppm1      5.032 ppm2      4.631
 ASSI (
   (( segid "    " and resid 1157 and name HB1 ))
 )(
   (( segid "    " and resid 1157 and name HB2 ))
 )
      3.300     3.300     0.000 peak  8713 weight  0.10000E+01 volume  0.18600E+01 ppm1      3.483 ppm2      2.964
 ASSI (
   (( segid "    " and resid 1157 and name HD1 ))
 )(
   (( segid "    " and resid 1157 and name HB2 ))
  OR 
   (( segid "    " and resid 1113 and name HD2 ))
  OR 
   (( segid "    " and resid 1113 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7617 weight  0.10000E+01 volume -0.64900E+00 ppm1      7.128 ppm2      2.957
 ASSI (
   (( segid "    " and resid 1157 and name HD1 ))
 )(
   (( segid "    " and resid 1153 and name HD2 ))
  OR 
   (( segid "    " and resid 1153 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7618 weight  0.10000E+01 volume -0.31800E+00 ppm1      7.128 ppm2      3.142
 ASSI (
   (( segid "    " and resid 1157 and name HD1 ))
 )(
   (( segid "    " and resid 1157 and name HB1 ))
  OR 
   (( segid "    " and resid 1112 and name HD2 ))
  OR 
   (( segid "    " and resid 1112 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7620 weight  0.10000E+01 volume -0.24100E+00 ppm1      7.127 ppm2      3.504
 ASSI (
   (( segid "    " and resid 1157 and name HD1 ))
 )(
   (( segid "    " and resid 1156 and name HA  ))
  OR 
   (( segid "    " and resid 1113 and name HA  ))
  OR 
   (( segid "    " and resid 1109 and name HA  ))
 )
      6.000     6.000     0.000 peak  7621 weight  0.10000E+01 volume -0.22800E+00 ppm1      7.125 ppm2      4.578
 ASSI (
   (( segid "    " and resid 1157 and name HZ2 ))
 )(
   (( segid "    " and resid 1157 and name HD1 ))
  OR 
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      5.000     5.000     0.000 peak  2347 weight  0.10000E+01 volume  0.44900E+00 ppm1      6.542 ppm2      7.125
 ASSI (
   (( segid "    " and resid 1158 and name HA  ))
 )(
   (( segid "    " and resid 1159 and name HB2 ))
  OR 
   (( segid "    " and resid 1159 and name HB1 ))
  OR 
   (( segid "    " and resid 1150 and name HB  ))
 )
      5.000     5.000     0.000 peak  2474 weight  0.10000E+01 volume -0.49300E+00 ppm1      4.485 ppm2      2.000
 ASSI (
   (( segid "    " and resid 1158 and name HA  ))
 )(
   (( segid "    " and resid 1158 and name HN  ))
 )
      5.000     5.000     0.000 peak  6977 weight  0.10000E+01 volume -0.62600E+00 ppm1      4.484 ppm2      8.170
 ASSI (
   (( segid "    " and resid 1158 and name HA  ))
 )(
   (( segid "    " and resid 1158 and name HB2 ))
 )
      3.300     3.300     0.000 peak  6978 weight  0.10000E+01 volume -0.21580E+01 ppm1      4.484 ppm2      4.192
 ASSI (
   (( segid "    " and resid 1158 and name HB1 ))
 )(
   (( segid "    " and resid 1158 and name HA  ))
 )
      5.000     5.000     0.000 peak  7173 weight  0.10000E+01 volume -0.15300E+01 ppm1      4.384 ppm2      4.482
 ASSI (
   (( segid "    " and resid 1158 and name HB2 ))
 )(
   (( segid "    " and resid 1159 and name HB1 ))
  OR 
   (( segid "    " and resid 1150 and name HB  ))
 )
      6.000     6.000     0.000 peak  7176 weight  0.10000E+01 volume -0.32000E+00 ppm1      4.190 ppm2      2.040
 ASSI (
   (( segid "    " and resid 1158 and name HB2 ))
 )(
   (( segid "    " and resid 1158 and name HB1 ))
 )
      2.700     2.700     0.000 peak  7064 weight  0.10000E+01 volume -0.36700E+01 ppm1      4.190 ppm2      4.385
 ASSI (
   (( segid "    " and resid 1159 and name HA  ))
 )(
   (( segid "    " and resid 1159 and name HG2 ))
  OR 
   (( segid "    " and resid 1159 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7645 weight  0.10000E+01 volume -0.10280E+01 ppm1      4.398 ppm2      2.406
 ASSI (
   (( segid "    " and resid 1159 and name HB1 ))
 )(
   (( segid "    " and resid 1160 and name HD2 ))
 )
      6.000     6.000     0.000 peak  8707 weight  0.10000E+01 volume  0.16800E+00 ppm1      2.028 ppm2      3.698
 ASSI (
   (( segid "    " and resid 1159 and name HB2 ))
 )(
   (( segid "    " and resid 1160 and name HD2 ))
 )
      6.000     6.000     0.000 peak  8706 weight  0.10000E+01 volume  0.22000E+00 ppm1      1.953 ppm2      3.698
 ASSI (
   (( segid "    " and resid 1160 and name HA  ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
  OR 
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )
      5.000     5.000     0.000 peak  8886 weight  0.10000E+01 volume -0.53200E+00 ppm1      4.374 ppm2      0.438
 ASSI (
   (( segid "    " and resid 1160 and name HA  ))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )
      3.300     3.300     0.000 peak  8887 weight  0.10000E+01 volume -0.21630E+01 ppm1      4.375 ppm2      0.763
 ASSI (
   (( segid "    " and resid 1160 and name HA  ))
 )(
   (( segid "    " and resid 1162 and name HB2 ))
  OR 
   (( segid "    " and resid 1161 and name HB2 ))
  OR 
   (( segid "    " and resid 1149 and name HG1 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
  OR 
   (( segid "    " and resid 1144 and name HB2 ))
  OR 
   (( segid "    " and resid 1115 and name HB  ))
 )
      5.000     5.000     0.000 peak  8889 weight  0.10000E+01 volume -0.83900E+00 ppm1      4.374 ppm2      1.548
 ASSI (
   (( segid "    " and resid 1160 and name HA  ))
 )(
   (( segid "    " and resid 1160 and name HG2 ))
 )
      5.000     5.000     0.000 peak  8891 weight  0.10000E+01 volume -0.10120E+01 ppm1      4.374 ppm2      1.753
 ASSI (
   (( segid "    " and resid 1160 and name HA  ))
 )(
   (( segid "    " and resid 1161 and name HB1 ))
  OR 
   (( segid "    " and resid 1160 and name HG1 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8890 weight  0.10000E+01 volume -0.13440E+01 ppm1      4.374 ppm2      1.801
 ASSI (
   (( segid "    " and resid 1160 and name HA  ))
 )(
   (( segid "    " and resid 1161 and name HD2 ))
  OR 
   (( segid "    " and resid 1159 and name HG2 ))
  OR 
   (( segid "    " and resid 1159 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8884 weight  0.10000E+01 volume -0.12860E+01 ppm1      4.375 ppm2      2.463
 ASSI (
   (( segid "    " and resid 1160 and name HA  ))
 )(
   (( segid "    " and resid 1161 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8883 weight  0.10000E+01 volume -0.12580E+01 ppm1      4.379 ppm2      3.381
 ASSI (
   (( segid "    " and resid 1160 and name HD2 ))
 )(
   (( segid "    " and resid 1162 and name HB2 ))
  OR 
   (( segid "    " and resid 1161 and name HB2 ))
  OR 
   (( segid "    " and resid 1115 and name HB  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )
      6.000     6.000     0.000 peak  7665 weight  0.10000E+01 volume -0.31100E+00 ppm1      3.686 ppm2      1.561
 ASSI (
   (( segid "    " and resid 1160 and name HD2 ))
 )(
   (( segid "    " and resid 1160 and name HG2 ))
 )
      5.000     5.000     0.000 peak  7664 weight  0.10000E+01 volume -0.10690E+01 ppm1      3.681 ppm2      1.750
 ASSI (
   (( segid "    " and resid 1160 and name HD2 ))
 )(
   (( segid "    " and resid 1160 and name HG1 ))
  OR 
   (( segid "    " and resid 1114 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7663 weight  0.10000E+01 volume -0.88600E+00 ppm1      3.678 ppm2      1.859
 ASSI (
   (( segid "    " and resid 1160 and name HD2 ))
 )(
   (( segid "    " and resid 1160 and name HD1 ))
 )
      2.700     2.700     0.000 peak  7656 weight  0.10000E+01 volume -0.32490E+01 ppm1      3.684 ppm2      3.987
 ASSI (
   (( segid "    " and resid 1160 and name HG1 ))
 )(
   (( segid "    " and resid 1160 and name HA  ))
  OR 
   (( segid "    " and resid 1159 and name HA  ))
 )
      5.000     5.000     0.000 peak  8540 weight  0.10000E+01 volume  0.65600E+00 ppm1      1.848 ppm2      4.389
 ASSI (
   (( segid "    " and resid 1160 and name HG2 ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
  OR 
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )
      5.000     5.000     0.000 peak  8536 weight  0.10000E+01 volume  0.59200E+00 ppm1      1.747 ppm2      0.440
 ASSI (
   (( segid "    " and resid 1160 and name HG2 ))
 )(
   (( segid "    " and resid 1160 and name HA  ))
  OR 
   (( segid "    " and resid 1159 and name HA  ))
 )
      5.000     5.000     0.000 peak  8539 weight  0.10000E+01 volume  0.47000E+00 ppm1      1.744 ppm2      4.384
 ASSI (
   (( segid "    " and resid 1161 and name HD1 ))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
  OR 
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )
      5.000     5.000     0.000 peak  8874 weight  0.10000E+01 volume -0.49000E+00 ppm1      3.380 ppm2      0.764
 ASSI (
   (( segid "    " and resid 1161 and name HD1 ))
 )(
   (( segid "    " and resid 1162 and name HB2 ))
  OR 
   (( segid "    " and resid 1161 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8877 weight  0.10000E+01 volume -0.47600E+00 ppm1      3.379 ppm2      1.575
 ASSI (
   (( segid "    " and resid 1161 and name HD1 ))
 )(
   (( segid "    " and resid 1161 and name HB1 ))
  OR 
   (( segid "    " and resid 1160 and name HG1 ))
  OR 
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8876 weight  0.10000E+01 volume -0.55000E+00 ppm1      3.379 ppm2      1.803
 ASSI (
   (( segid "    " and resid 1161 and name HD1 ))
 )(
   (( segid "    " and resid 1161 and name HD2 ))
 )
      5.000     5.000     0.000 peak  8873 weight  0.10000E+01 volume -0.10920E+01 ppm1      3.382 ppm2      2.465
 ASSI (
   (( segid "    " and resid 1161 and name HD2 ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
  OR 
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )
      6.000     6.000     0.000 peak  8882 weight  0.10000E+01 volume -0.29300E+00 ppm1      2.462 ppm2      0.433
 ASSI (
   (( segid "    " and resid 1161 and name HD2 ))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
  OR 
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )
      6.000     6.000     0.000 peak  8881 weight  0.10000E+01 volume -0.36700E+00 ppm1      2.464 ppm2      0.766
 ASSI (
   (( segid "    " and resid 1161 and name HD2 ))
 )(
   (( segid "    " and resid 1162 and name HB2 ))
  OR 
   (( segid "    " and resid 1161 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8879 weight  0.10000E+01 volume -0.57600E+00 ppm1      2.462 ppm2      1.554
 ASSI (
   (( segid "    " and resid 1161 and name HD2 ))
 )(
   (( segid "    " and resid 1161 and name HB1 ))
  OR 
   (( segid "    " and resid 1160 and name HG2 ))
  OR 
   (( segid "    " and resid 1160 and name HG1 ))
  OR 
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8878 weight  0.10000E+01 volume -0.50600E+00 ppm1      2.462 ppm2      1.793
 ASSI (
   (( segid "    " and resid 1161 and name HD2 ))
 )(
   (( segid "    " and resid 1160 and name HA  ))
 )
      5.000     5.000     0.000 peak  8872 weight  0.10000E+01 volume -0.65100E+00 ppm1      2.462 ppm2      4.383
 ASSI (
   (( segid "    " and resid 1162 and name HA  ))
 )(
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
 )
      5.000     5.000     0.000 peak  6964 weight  0.10000E+01 volume -0.13070E+01 ppm1      4.524 ppm2      1.372
 ASSI (
   (( segid "    " and resid 1162 and name HA  ))
 )(
   (( segid "    " and resid 1162 and name HD2 ))
  OR 
   (( segid "    " and resid 1162 and name HD1 ))
  OR 
   (( segid "    " and resid 1162 and name HB2 ))
  OR 
   (( segid "    " and resid 1161 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6963 weight  0.10000E+01 volume -0.14430E+01 ppm1      4.524 ppm2      1.549
 ASSI (
   (( segid "    " and resid 1162 and name HA  ))
 )(
   (( segid "    " and resid 1162 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6970 weight  0.10000E+01 volume -0.18220E+01 ppm1      4.523 ppm2      1.679
 ASSI (
   (( segid "    " and resid 1162 and name HB1 ))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
 )
      5.000     5.000     0.000 peak  8687 weight  0.10000E+01 volume  0.93200E+00 ppm1      1.698 ppm2      0.661
 ASSI (
   (( segid "    " and resid 1162 and name HB1 ))
 )(
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
 )
      3.300     3.300     0.000 peak  8689 weight  0.10000E+01 volume  0.16420E+01 ppm1      1.696 ppm2      1.370
 ASSI (
   (( segid "    " and resid 1162 and name HB1 ))
 )(
   (( segid "    " and resid 1162 and name HD2 ))
  OR 
   (( segid "    " and resid 1162 and name HD1 ))
  OR 
   (( segid "    " and resid 1162 and name HB2 ))
 )
      2.700     2.700     0.000 peak  8690 weight  0.10000E+01 volume  0.31070E+01 ppm1      1.697 ppm2      1.548
 ASSI (
   (( segid "    " and resid 1162 and name HB2 ))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
  OR 
   (( segid "    " and resid 1115 and name HG12))
 )
      5.000     5.000     0.000 peak  8686 weight  0.10000E+01 volume  0.67400E+00 ppm1      1.549 ppm2      0.662
 ASSI (
   (( segid "    " and resid 1162 and name HB2 ))
 )(
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
 )
      3.300     3.300     0.000 peak  8688 weight  0.10000E+01 volume  0.26860E+01 ppm1      1.548 ppm2      1.370
 ASSI (
   (( segid "    " and resid 1162 and name HB2 ))
 )(
   (( segid "    " and resid 1162 and name HB1 ))
 )
      2.700     2.700     0.000 peak  8685 weight  0.10000E+01 volume  0.35390E+01 ppm1      1.548 ppm2      1.691
 ASSI (
   (( segid "    " and resid 1162 and name HB2 ))
 )(
   (( segid "    " and resid 1162 and name HA  ))
 )
      5.000     5.000     0.000 peak  8692 weight  0.10000E+01 volume  0.73200E+00 ppm1      1.550 ppm2      4.528
 ASSI (
   (( segid "    " and resid 1163 and name HA  ))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
  OR 
   (( segid "    " and resid 1115 and name HG12))
 )
      5.000     5.000     0.000 peak  6381 weight  0.10000E+01 volume -0.55400E+00 ppm1      5.065 ppm2      0.651
 ASSI (
   (( segid "    " and resid 1163 and name HA  ))
 )(
   (( segid "    " and resid 1164 and name HB1 ))
  OR 
   (( segid "    " and resid 1162 and name HB1 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6380 weight  0.10000E+01 volume -0.82000E+00 ppm1      5.063 ppm2      1.649
 ASSI (
   (( segid "    " and resid 1163 and name HA  ))
 )(
   (( segid "    " and resid 1163 and name HB2 ))
  OR 
   (( segid "    " and resid 1138 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6439 weight  0.10000E+01 volume -0.91400E+00 ppm1      5.063 ppm2      2.535
 ASSI (
   (( segid "    " and resid 1163 and name HA  ))
 )(
   (( segid "    " and resid 1163 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6379 weight  0.10000E+01 volume -0.42800E+00 ppm1      5.064 ppm2      2.812
 ASSI (
   (( segid "    " and resid 1163 and name HA  ))
 )(
   (( segid "    " and resid 1164 and name HA  ))
  OR 
   (( segid "    " and resid 1142 and name HA  ))
 )
      6.000     6.000     0.000 peak  6383 weight  0.10000E+01 volume -0.19000E+00 ppm1      5.071 ppm2      4.359
 ASSI (
   (( segid "    " and resid 1163 and name HB1 ))
 )(
   (( segid "    " and resid 1163 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7593 weight  0.10000E+01 volume  0.12280E+01 ppm1      2.812 ppm2      2.523
 ASSI (
   (( segid "    " and resid 1164 and name HB1 ))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
 )
      5.000     5.000     0.000 peak  8642 weight  0.10000E+01 volume  0.76400E+00 ppm1      1.635 ppm2      0.657
 ASSI (
   (( segid "    " and resid 1164 and name HB2 ))
 )(
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )
      6.000     6.000     0.000 peak  8679 weight  0.10000E+01 volume  0.25400E+00 ppm1      1.131 ppm2      0.424
 ASSI (
   (( segid "    " and resid 1164 and name HB2 ))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
 )
      5.000     5.000     0.000 peak  8678 weight  0.10000E+01 volume  0.91200E+00 ppm1      1.135 ppm2      0.652
 ASSI (
   (( segid "    " and resid 1164 and name HB2 ))
 )(
   (( segid "    " and resid 1164 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8677 weight  0.10000E+01 volume  0.68600E+00 ppm1      1.135 ppm2      1.642
 ASSI (
   (( segid "    " and resid 1164 and name HG  ))
 )(
   (( segid "    " and resid 1164 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9301 weight  0.10000E+01 volume  0.62500E+00 ppm1      0.633 ppm2      1.156
 ASSI (
   (( segid "    " and resid 1164 and name HG  ))
 )(
   (( segid "    " and resid 1164 and name HB1 ))
 )
      3.300     3.300     0.000 peak  8656 weight  0.10000E+01 volume  0.19460E+01 ppm1      0.635 ppm2      1.652
 ASSI (
   (( segid "    " and resid 1164 and name HG  ))
 )(
   (( segid "    " and resid 1219 and name HA  ))
  OR 
   (( segid "    " and resid 1145 and name HA  ))
  OR 
   (( segid "    " and resid 1144 and name HA  ))
  OR 
   (( segid "    " and resid 1143 and name HA  ))
 )
      6.000     6.000     0.000 peak  8660 weight  0.10000E+01 volume  0.17500E+00 ppm1      0.635 ppm2      4.654
 ASSI (
   (( segid "    " and resid 1165 and name HA  ))
 )(
   (( segid "    " and resid 1141 and name HB1 ))
  OR 
   (( segid "    " and resid 1117 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9573 weight  0.10000E+01 volume -0.36300E+00 ppm1      4.026 ppm2      2.100
 ASSI (
   (( segid "    " and resid 1166 and name HA  ))
 )(
   (( segid "    " and resid 1192 and name HB2 ))
  OR 
   (( segid "    " and resid 1166 and name HG1 ))
 )
      6.000     6.000     0.000 peak  6524 weight  0.10000E+01 volume -0.29600E+00 ppm1      4.844 ppm2      1.478
 ASSI (
   (( segid "    " and resid 1166 and name HA  ))
 )(
   (( segid "    " and resid 1192 and name HB1 ))
  OR 
   (( segid "    " and resid 1164 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6525 weight  0.10000E+01 volume -0.32800E+00 ppm1      4.849 ppm2      1.640
 ASSI (
   (( segid "    " and resid 1166 and name HA  ))
 )(
   (( segid "    " and resid 1219 and name HA  ))
  OR 
   (( segid "    " and resid 1218 and name HA  ))
 )
      5.000     5.000     0.000 peak  6520 weight  0.10000E+01 volume -0.91400E+00 ppm1      4.844 ppm2      4.639
 ASSI (
   (( segid "    " and resid 1167 and name HB1 ))
 )(
   (( segid "    " and resid 1167 and name HA  ))
 )
      5.000     5.000     0.000 peak  8623 weight  0.10000E+01 volume  0.90800E+00 ppm1      2.791 ppm2      4.798
 ASSI (
   (( segid "    " and resid 1167 and name HB2 ))
 )(
   (( segid "    " and resid 1167 and name HA  ))
 )
      5.000     5.000     0.000 peak  8624 weight  0.10000E+01 volume  0.10380E+01 ppm1      2.708 ppm2      4.800
 ASSI (
   (( segid "    " and resid 1168 and name HA  ))
 )(
   (( segid "    " and resid 1189 and name HB1 ))
  OR 
   (( segid "    " and resid 1169 and name HB  ))
 )
      5.000     5.000     0.000 peak  6945 weight  0.10000E+01 volume -0.63100E+00 ppm1      4.205 ppm2      1.720
 ASSI (
   (( segid "    " and resid 1168 and name HA  ))
 )(
   (( segid "    " and resid 1190 and name HB2 ))
  OR 
   (( segid "    " and resid 1190 and name HB1 ))
  OR 
   (( segid "    " and resid 1167 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6943 weight  0.10000E+01 volume -0.38700E+00 ppm1      4.207 ppm2      2.798
 ASSI (
   (( segid "    " and resid 1169 and name HA  ))
 )(
   (( segid "    " and resid 1169 and name HB  ))
 )
      5.000     5.000     0.000 peak  6928 weight  0.10000E+01 volume -0.43700E+00 ppm1      4.161 ppm2      1.702
 ASSI (
   (( segid "    " and resid 1169 and name HA  ))
 )(
   (( segid "    " and resid 1221 and name HA2 ))
  OR 
   (( segid "    " and resid 1170 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6927 weight  0.10000E+01 volume -0.22100E+00 ppm1      4.161 ppm2      3.725
 ASSI (
   (( segid "    " and resid 1169 and name HA  ))
 )(
   (( segid "    " and resid 1169 and name HN  ))
 )
      5.000     5.000     0.000 peak  3128 weight  0.10000E+01 volume -0.47900E+00 ppm1      4.167 ppm2      8.240
 ASSI (
   (( segid "    " and resid 1169 and name HB  ))
 )(
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      5.000     5.000     0.000 peak  8594 weight  0.10000E+01 volume  0.60600E+00 ppm1      1.703 ppm2      0.735
 ASSI (
   (( segid "    " and resid 1169 and name HB  ))
 )(
   (( segid "    " and resid 1169 and name HG12))
 )
      5.000     5.000     0.000 peak  8595 weight  0.10000E+01 volume  0.41400E+00 ppm1      1.702 ppm2      0.942
 ASSI (
   (( segid "    " and resid 1169 and name HB  ))
 )(
   (( segid "    " and resid 1169 and name HA  ))
  OR 
   (( segid "    " and resid 1168 and name HA  ))
 )
      6.000     6.000     0.000 peak  6935 weight  0.10000E+01 volume  0.31900E+00 ppm1      1.699 ppm2      4.185
 ASSI (
   (( segid "    " and resid 1169 and name HB  ))
 )(
   (( segid "    " and resid 1189 and name HA  ))
  OR 
   (( segid "    " and resid 1181 and name HA  ))
 )
      6.000     6.000     0.000 peak  8596 weight  0.10000E+01 volume  0.31200E+00 ppm1      1.699 ppm2      4.341
 ASSI (
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )(
   (( segid "    " and resid 1223 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8589 weight  0.10000E+01 volume  0.37800E+00 ppm1      0.701 ppm2      1.199
 ASSI (
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )(
   (( segid "    " and resid 1197 and name HB  ))
  OR 
   (( segid "    " and resid 1189 and name HB2 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
 )
      5.000     5.000     0.000 peak  8586 weight  0.10000E+01 volume  0.60000E+00 ppm1      0.702 ppm2      1.571
 ASSI (
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )(
   (( segid "    " and resid 1225 and name HA  ))
  OR 
   (( segid "    " and resid 1169 and name HA  ))
 )
      6.000     6.000     0.000 peak  8582 weight  0.10000E+01 volume  0.37100E+00 ppm1      0.703 ppm2      4.171
 ASSI (
   (( segid "    " and resid 1169 and name HG11))
 )(
   (( segid "    " and resid 1169 and name HG12))
 )
      2.700     2.700     0.000 peak  8615 weight  0.10000E+01 volume  0.31660E+01 ppm1      1.370 ppm2      0.943
 ASSI (
   (( segid "    " and resid 1169 and name HG12))
 )(
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      5.000     5.000     0.000 peak  8616 weight  0.10000E+01 volume  0.12330E+01 ppm1      0.948 ppm2      0.707
 ASSI (
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )(
   (( segid "    " and resid 1189 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8604 weight  0.10000E+01 volume  0.11900E+01 ppm1      1.028 ppm2      1.567
 ASSI (
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )(
   (( segid "    " and resid 1187 and name HG2 ))
  OR 
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8612 weight  0.10000E+01 volume  0.20200E+00 ppm1      1.027 ppm2      2.241
 ASSI (
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )(
   (( segid "    " and resid 1174 and name HG1 ))
 )
      6.000     6.000     0.000 peak  8611 weight  0.10000E+01 volume  0.26000E+00 ppm1      1.027 ppm2      2.856
 ASSI (
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )(
   (( segid "    " and resid 1225 and name HE2 ))
  OR 
   (( segid "    " and resid 1225 and name HE1 ))
  OR 
   (( segid "    " and resid 1190 and name HE2 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )
      5.000     5.000     0.000 peak  8606 weight  0.10000E+01 volume  0.63300E+00 ppm1      1.028 ppm2      6.708
 ASSI (
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )(
   (( segid "    " and resid 1225 and name HE2 ))
  OR 
   (( segid "    " and resid 1225 and name HE1 ))
  OR 
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )
      5.000     5.000     0.000 peak  4325 weight  0.10000E+01 volume  0.74400E+00 ppm1      1.028 ppm2      6.749
 ASSI (
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )(
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8607 weight  0.10000E+01 volume  0.50500E+00 ppm1      1.028 ppm2      6.796
 ASSI (
   (( segid "    " and resid 1170 and name HB1 ))
 )(
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
  OR 
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      5.000     5.000     0.000 peak  8561 weight  0.10000E+01 volume -0.66500E+00 ppm1      3.947 ppm2      0.667
 ASSI (
   (( segid "    " and resid 1170 and name HB1 ))
 )(
   (( segid "    " and resid 1170 and name HN  ))
 )
      5.000     5.000     0.000 peak  5249 weight  0.10000E+01 volume -0.41400E+00 ppm1      3.949 ppm2      7.928
 ASSI (
   (( segid "    " and resid 1170 and name HB2 ))
 )(
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
  OR 
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      5.000     5.000     0.000 peak  8562 weight  0.10000E+01 volume -0.61400E+00 ppm1      3.723 ppm2      0.667
 ASSI (
   (( segid "    " and resid 1170 and name HB2 ))
 )(
   (( segid "    " and resid 1170 and name HN  ))
 )
      5.000     5.000     0.000 peak  6934 weight  0.10000E+01 volume -0.68200E+00 ppm1      3.727 ppm2      7.930
 ASSI (
   (( segid "    " and resid 1171 and name HA  ))
 )(
   (( segid "    " and resid 1171 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6924 weight  0.10000E+01 volume -0.29770E+01 ppm1      4.093 ppm2      1.852
 ASSI (
   (( segid "    " and resid 1171 and name HA  ))
 )(
   (( segid "    " and resid 1175 and name HB1 ))
 )
      3.300     3.300     0.000 peak  3496 weight  0.10000E+01 volume -0.19450E+01 ppm1      4.091 ppm2      2.095
 ASSI (
   (( segid "    " and resid 1171 and name HA  ))
 )(
   (( segid "    " and resid 1173 and name HA  ))
  OR 
   (( segid "    " and resid 1171 and name HD2 ))
  OR 
   (( segid "    " and resid 1171 and name HD1 ))
 )
      5.000     5.000     0.000 peak  2758 weight  0.10000E+01 volume -0.50300E+00 ppm1      4.092 ppm2      3.239
 ASSI (
   (( segid "    " and resid 1171 and name HA  ))
 )(
   (( segid "    " and resid 1172 and name HN  ))
 )
      6.000     6.000     0.000 peak  6920 weight  0.10000E+01 volume -0.36000E+00 ppm1      4.094 ppm2      8.356
 ASSI (
   (( segid "    " and resid 1171 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HB1 ))
 )(
   (( segid "    " and resid 1170 and name HA  ))
 )
      6.000     6.000     0.000 peak  8118 weight  0.10000E+01 volume  0.38400E+00 ppm1      1.857 ppm2      4.655
 ASSI (
   (( segid "    " and resid 1171 and name HG1 ))
 )(
   (( segid "    " and resid 1171 and name HD2 ))
  OR 
   (( segid "    " and resid 1171 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9395 weight  0.10000E+01 volume  0.11260E+01 ppm1      1.784 ppm2      3.227
 ASSI (
   (( segid "    " and resid 1171 and name HG1 ))
 )(
   (( segid "    " and resid 1171 and name HA  ))
 )
      6.000     6.000     0.000 peak  8576 weight  0.10000E+01 volume  0.28700E+00 ppm1      1.789 ppm2      4.100
 ASSI (
   (( segid "    " and resid 1171 and name HG2 ))
 )(
   (( segid "    " and resid 1171 and name HD2 ))
  OR 
   (( segid "    " and resid 1171 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9398 weight  0.10000E+01 volume  0.11600E+01 ppm1      1.677 ppm2      3.230
 ASSI (
   (( segid "    " and resid 1171 and name HG2 ))
 )(
   (( segid "    " and resid 1187 and name HA  ))
  OR 
   (( segid "    " and resid 1171 and name HA  ))
 )
      5.000     5.000     0.000 peak  8569 weight  0.10000E+01 volume  0.40900E+00 ppm1      1.676 ppm2      4.103
 ASSI (
   (( segid "    " and resid 1172 and name HA  ))
 )(
   (( segid "    " and resid 1187 and name HB2 ))
  OR 
   (( segid "    " and resid 1187 and name HB1 ))
  OR 
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
  OR 
   (( segid "    " and resid 1174 and name HG2 ))
 )
      5.000     5.000     0.000 peak  6916 weight  0.10000E+01 volume -0.90000E+00 ppm1      3.899 ppm2      2.048
 ASSI (
   (( segid "    " and resid 1172 and name HA  ))
 )(
   (( segid "    " and resid 1175 and name HN  ))
 )
      6.000     6.000     0.000 peak  6914 weight  0.10000E+01 volume -0.28600E+00 ppm1      3.904 ppm2      7.807
 ASSI (
   (( segid "    " and resid 1172 and name HA  ))
 )(
   (( segid "    " and resid 1172 and name HN  ))
 )
      5.000     5.000     0.000 peak  6913 weight  0.10000E+01 volume -0.10810E+01 ppm1      3.903 ppm2      8.367
 ASSI (
   (( segid "    " and resid 1172 and name HB1 ))
 )(
   (( segid "    " and resid 1172 and name HN  ))
 )
      3.300     3.300     0.000 peak  8575 weight  0.10000E+01 volume  0.18010E+01 ppm1      1.904 ppm2      8.360
 ASSI (
   (( segid "    " and resid 1172 and name HB2 ))
 )(
   (( segid "    " and resid 1172 and name HN  ))
 )
      5.000     5.000     0.000 peak  8574 weight  0.10000E+01 volume  0.11170E+01 ppm1      1.792 ppm2      8.357
 ASSI (
   (( segid "    " and resid 1172 and name HG2 ))
  OR 
   (( segid "    " and resid 1172 and name HG1 ))
 )(
   (( segid "    " and resid 1172 and name HN  ))
 )
      5.000     5.000     0.000 peak  8568 weight  0.10000E+01 volume  0.70300E+00 ppm1      2.211 ppm2      8.357
 ASSI (
   (( segid "    " and resid 1173 and name HB  ))
 )(
   (( segid "    " and resid 1173 and name HG11))
 )
      5.000     5.000     0.000 peak  8556 weight  0.10000E+01 volume  0.53200E+00 ppm1      1.129 ppm2      1.328
 ASSI (
   (( segid "    " and resid 1173 and name HB  ))
 )(
   (( segid "    " and resid 1170 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8557 weight  0.10000E+01 volume  0.58200E+00 ppm1      1.135 ppm2      3.725
 ASSI (
   (( segid "    " and resid 1173 and name HB  ))
 )(
   (( segid "    " and resid 1170 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8564 weight  0.10000E+01 volume  0.45300E+00 ppm1      1.144 ppm2      3.941
 ASSI (
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
 )(
   (( segid "    " and resid 1173 and name HB  ))
 )
      5.000     5.000     0.000 peak  7750 weight  0.10000E+01 volume  0.76800E+00 ppm1      0.658 ppm2      1.135
 ASSI (
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
 )(
   (( segid "    " and resid 1173 and name HG11))
 )
      3.300     3.300     0.000 peak  7751 weight  0.10000E+01 volume  0.19420E+01 ppm1      0.659 ppm2      1.328
 ASSI (
   (( segid "    " and resid 1173 and name HG12))
 )(
   (( segid "    " and resid 1173 and name HB  ))
 )
      6.000     6.000     0.000 peak  7755 weight  0.10000E+01 volume  0.28300E+00 ppm1      0.734 ppm2      1.143
 ASSI (
   (( segid "    " and resid 1173 and name HG12))
 )(
   (( segid "    " and resid 1173 and name HG11))
 )
      5.000     5.000     0.000 peak  7754 weight  0.10000E+01 volume  0.14120E+01 ppm1      0.745 ppm2      1.324
 ASSI (
   (( segid "    " and resid 1173 and name HG12))
 )(
   (( segid "    " and resid 1173 and name HN  ))
 )
      6.000     6.000     0.000 peak  7756 weight  0.10000E+01 volume  0.33700E+00 ppm1      0.743 ppm2      7.371
 ASSI (
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )(
   (( segid "    " and resid 1225 and name HB2 ))
  OR 
   (( segid "    " and resid 1225 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7745 weight  0.10000E+01 volume  0.25600E+00 ppm1     -0.390 ppm2      2.510
 ASSI (
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )(
   (( segid "    " and resid 1176 and name HB2 ))
  OR 
   (( segid "    " and resid 1176 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7746 weight  0.10000E+01 volume  0.34600E+00 ppm1     -0.389 ppm2      2.612
 ASSI (
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )(
   (( segid "    " and resid 1177 and name HB1 ))
  OR 
   (( segid "    " and resid 1170 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7748 weight  0.10000E+01 volume  0.25400E+00 ppm1     -0.383 ppm2      3.722
 ASSI (
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )(
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
  OR 
   (( segid "    " and resid 1177 and name HD2 ))
  OR 
   (( segid "    " and resid 1177 and name HD1 ))
 )
      5.000     5.000     0.000 peak  3030 weight  0.10000E+01 volume  0.12150E+01 ppm1     -0.393 ppm2      6.789
 ASSI (
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )(
   (( segid "    " and resid 1173 and name HN  ))
 )
      5.000     5.000     0.000 peak  7738 weight  0.10000E+01 volume  0.45800E+00 ppm1     -0.391 ppm2      7.392
 ASSI (
   (( segid "    " and resid 1174 and name HA  ))
 )(
   (( segid "    " and resid 1179 and name HG12))
 )
      5.000     5.000     0.000 peak  6895 weight  0.10000E+01 volume -0.10380E+01 ppm1      3.498 ppm2      1.030
 ASSI (
   (( segid "    " and resid 1174 and name HA  ))
 )(
   (( segid "    " and resid 1179 and name HG11))
 )
      5.000     5.000     0.000 peak  6896 weight  0.10000E+01 volume -0.85600E+00 ppm1      3.498 ppm2      1.139
 ASSI (
   (( segid "    " and resid 1174 and name HA  ))
 )(
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6893 weight  0.10000E+01 volume -0.12790E+01 ppm1      3.500 ppm2      2.227
 ASSI (
   (( segid "    " and resid 1174 and name HA  ))
 )(
   (( segid "    " and resid 1177 and name HB2 ))
  OR 
   (( segid "    " and resid 1176 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6892 weight  0.10000E+01 volume -0.27900E+00 ppm1      3.504 ppm2      2.683
 ASSI (
   (( segid "    " and resid 1174 and name HA  ))
 )(
   (( segid "    " and resid 1227 and name HB  ))
  OR 
   (( segid "    " and resid 1177 and name HB1 ))
  OR 
   (( segid "    " and resid 1170 and name HB2 ))
 )
      6.000     6.000     0.000 peak  3423 weight  0.10000E+01 volume -0.29900E+00 ppm1      3.502 ppm2      3.710
 ASSI (
   (( segid "    " and resid 1174 and name HA  ))
 )(
   (( segid "    " and resid 1179 and name HN  ))
  OR 
   (( segid "    " and resid 1177 and name HN  ))
 )
      5.000     5.000     0.000 peak  3355 weight  0.10000E+01 volume -0.80200E+00 ppm1      3.496 ppm2      7.882
 ASSI (
   (( segid "    " and resid 1174 and name HG1 ))
 )(
   (( segid "    " and resid 1174 and name HG2 ))
 )
      5.000     5.000     0.000 peak  8548 weight  0.10000E+01 volume  0.10210E+01 ppm1      2.858 ppm2      2.006
 ASSI (
   (( segid "    " and resid 1174 and name HG1 ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8549 weight  0.10000E+01 volume  0.51400E+00 ppm1      2.858 ppm2      2.094
 ASSI (
   (( segid "    " and resid 1174 and name HG1 ))
 )(
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8547 weight  0.10000E+01 volume  0.76800E+00 ppm1      2.858 ppm2      2.233
 ASSI (
   (( segid "    " and resid 1174 and name HG1 ))
 )(
   (( segid "    " and resid 1199 and name HE1 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8550 weight  0.10000E+01 volume  0.20300E+00 ppm1      2.858 ppm2      7.164
 ASSI (
   (( segid "    " and resid 1174 and name HG2 ))
 )(
   (( segid "    " and resid 1199 and name HE1 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8552 weight  0.10000E+01 volume  0.19100E+00 ppm1      2.006 ppm2      7.165
 ASSI (
   (( segid "    " and resid 1175 and name HA  ))
 )(
   (( segid "    " and resid 1226 and name HD2 ))
  OR 
   (( segid "    " and resid 1202 and name HE2 ))
  OR 
   (( segid "    " and resid 1202 and name HE1 ))
  OR 
   (( segid "    " and resid 1178 and name HB1 ))
  OR 
   (( segid "    " and resid 1174 and name HG1 ))
 )
      6.000     6.000     0.000 peak  6880 weight  0.10000E+01 volume -0.24500E+00 ppm1      3.969 ppm2      2.843
 ASSI (
   (( segid "    " and resid 1175 and name HG2 ))
 )(
   (( segid "    " and resid 1175 and name HN  ))
 )
      5.000     5.000     0.000 peak  9397 weight  0.10000E+01 volume  0.88100E+00 ppm1      2.291 ppm2      7.813
 ASSI (
   (( segid "    " and resid 1176 and name HB2 ))
 )(
   (( segid "    " and resid 1175 and name HG2 ))
  OR 
   (( segid "    " and resid 1175 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8493 weight  0.10000E+01 volume  0.42000E+00 ppm1      2.582 ppm2      2.321
 ASSI (
   (( segid "    " and resid 1177 and name HA  ))
 )(
   (( segid "    " and resid 1227 and name HG23))
  OR 
   (( segid "    " and resid 1227 and name HG22))
  OR 
   (( segid "    " and resid 1227 and name HG21))
  OR 
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
 )
      5.000     5.000     0.000 peak  8451 weight  0.10000E+01 volume -0.87000E+00 ppm1      4.731 ppm2      0.647
 ASSI (
   (( segid "    " and resid 1177 and name HA  ))
 )(
   (( segid "    " and resid 1177 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8452 weight  0.10000E+01 volume -0.82600E+00 ppm1      4.733 ppm2      2.684
 ASSI (
   (( segid "    " and resid 1177 and name HA  ))
 )(
   (( segid "    " and resid 1177 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8455 weight  0.10000E+01 volume -0.13270E+01 ppm1      4.734 ppm2      3.702
 ASSI (
   (( segid "    " and resid 1177 and name HA  ))
 )(
   (( segid "    " and resid 1177 and name HE2 ))
  OR 
   (( segid "    " and resid 1177 and name HE1 ))
 )
      6.000     6.000     0.000 peak  8454 weight  0.10000E+01 volume -0.37000E+00 ppm1      4.733 ppm2      6.578
 ASSI (
   (( segid "    " and resid 1177 and name HA  ))
 )(
   (( segid "    " and resid 1178 and name HD22))
  OR 
   (( segid "    " and resid 1177 and name HD2 ))
  OR 
   (( segid "    " and resid 1177 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7674 weight  0.10000E+01 volume -0.14550E+01 ppm1      4.732 ppm2      6.790
 ASSI (
   (( segid "    " and resid 1177 and name HB1 ))
 )(
   (( segid "    " and resid 1177 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6613 weight  0.10000E+01 volume  0.12320E+01 ppm1      3.712 ppm2      2.683
 ASSI (
   (( segid "    " and resid 1177 and name HD2 ))
  OR 
   (( segid "    " and resid 1177 and name HD1 ))
 )(
   (( segid "    " and resid 1227 and name HG23))
  OR 
   (( segid "    " and resid 1227 and name HG22))
  OR 
   (( segid "    " and resid 1227 and name HG21))
  OR 
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
 )
      6.000     6.000     0.000 peak  3034 weight  0.10000E+01 volume -0.14700E+00 ppm1      6.792 ppm2      0.655
 ASSI (
   (( segid "    " and resid 1177 and name HD2 ))
  OR 
   (( segid "    " and resid 1177 and name HD1 ))
 )(
   (( segid "    " and resid 1225 and name HB2 ))
  OR 
   (( segid "    " and resid 1225 and name HB1 ))
  OR 
   (( segid "    " and resid 1176 and name HB2 ))
 )
      6.000     6.000     0.000 peak  3203 weight  0.10000E+01 volume -0.26500E+00 ppm1      6.790 ppm2      2.550
 ASSI (
   (( segid "    " and resid 1177 and name HE2 ))
  OR 
   (( segid "    " and resid 1177 and name HE1 ))
 )(
   (( segid "    " and resid 1227 and name HG23))
  OR 
   (( segid "    " and resid 1227 and name HG22))
  OR 
   (( segid "    " and resid 1227 and name HG21))
  OR 
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
 )
      5.000     5.000     0.000 peak  8469 weight  0.10000E+01 volume -0.52600E+00 ppm1      6.581 ppm2      0.664
 ASSI (
   (( segid "    " and resid 1177 and name HE2 ))
  OR 
   (( segid "    " and resid 1177 and name HE1 ))
 )(
   (( segid "    " and resid 1225 and name HB2 ))
  OR 
   (( segid "    " and resid 1225 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7501 weight  0.10000E+01 volume -0.43300E+00 ppm1      6.582 ppm2      2.496
 ASSI (
   (( segid "    " and resid 1177 and name HE2 ))
  OR 
   (( segid "    " and resid 1177 and name HE1 ))
 )(
   (( segid "    " and resid 1225 and name HB2 ))
  OR 
   (( segid "    " and resid 1225 and name HB1 ))
  OR 
   (( segid "    " and resid 1176 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7502 weight  0.10000E+01 volume -0.56300E+00 ppm1      6.580 ppm2      2.534
 ASSI (
   (( segid "    " and resid 1177 and name HE2 ))
  OR 
   (( segid "    " and resid 1177 and name HE1 ))
 )(
   (( segid "    " and resid 1177 and name HB2 ))
  OR 
   (( segid "    " and resid 1176 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8473 weight  0.10000E+01 volume -0.29200E+00 ppm1      6.581 ppm2      2.662
 ASSI (
   (( segid "    " and resid 1178 and name HA  ))
 )(
   (( segid "    " and resid 1202 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
  OR 
   (( segid "    " and resid 1179 and name HG12))
 )
      5.000     5.000     0.000 peak  6879 weight  0.10000E+01 volume -0.54700E+00 ppm1      3.924 ppm2      1.051
 ASSI (
   (( segid "    " and resid 1178 and name HA  ))
 )(
   (( segid "    " and resid 1202 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6878 weight  0.10000E+01 volume -0.34400E+00 ppm1      3.924 ppm2      1.355
 ASSI (
   (( segid "    " and resid 1178 and name HA  ))
 )(
   (( segid "    " and resid 1202 and name HN  ))
  OR 
   (( segid "    " and resid 1179 and name HN  ))
  OR 
   (( segid "    " and resid 1177 and name HN  ))
 )
      5.000     5.000     0.000 peak  6872 weight  0.10000E+01 volume -0.13860E+01 ppm1      3.921 ppm2      7.883
 ASSI (
   (( segid "    " and resid 1178 and name HB1 ))
 )(
   (( segid "    " and resid 1178 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8426 weight  0.10000E+01 volume  0.12350E+01 ppm1      2.816 ppm2      1.207
 ASSI (
   (( segid "    " and resid 1178 and name HB1 ))
 )(
   (( segid "    " and resid 1178 and name HD21))
 )
      5.000     5.000     0.000 peak  8428 weight  0.10000E+01 volume  0.44400E+00 ppm1      2.816 ppm2      7.130
 ASSI (
   (( segid "    " and resid 1178 and name HB2 ))
 )(
   (( segid "    " and resid 1178 and name HD21))
 )
      5.000     5.000     0.000 peak  8430 weight  0.10000E+01 volume  0.46400E+00 ppm1      1.196 ppm2      7.125
 ASSI (
   (( segid "    " and resid 1178 and name HB2 ))
 )(
   (( segid "    " and resid 1178 and name HN  ))
 )
      6.000     6.000     0.000 peak  8432 weight  0.10000E+01 volume  0.25000E+00 ppm1      1.196 ppm2      7.605
 ASSI (
   (( segid "    " and resid 1179 and name HA  ))
 )(
   (( segid "    " and resid 1202 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
  OR 
   (( segid "    " and resid 1179 and name HG12))
 )
      5.000     5.000     0.000 peak  6322 weight  0.10000E+01 volume -0.53500E+00 ppm1      5.227 ppm2      1.042
 ASSI (
   (( segid "    " and resid 1179 and name HB  ))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
  OR 
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8040 weight  0.10000E+01 volume  0.17300E+00 ppm1      1.798 ppm2      7.171
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1179 and name HG12))
 )
      5.000     5.000     0.000 peak  7433 weight  0.10000E+01 volume  0.12220E+01 ppm1      0.374 ppm2      1.031
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1179 and name HG11))
 )
      5.000     5.000     0.000 peak  7432 weight  0.10000E+01 volume  0.82700E+00 ppm1      0.371 ppm2      1.135
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1226 and name HG2 ))
  OR 
   (( segid "    " and resid 1214 and name HG  ))
 )
      5.000     5.000     0.000 peak  7435 weight  0.10000E+01 volume  0.47800E+00 ppm1      0.369 ppm2      1.677
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
  OR 
   (( segid "    " and resid 1174 and name HG2 ))
 )
      5.000     5.000     0.000 peak  7437 weight  0.10000E+01 volume  0.61600E+00 ppm1      0.372 ppm2      2.014
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7436 weight  0.10000E+01 volume  0.56000E+00 ppm1      0.372 ppm2      2.082
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1226 and name HB1 ))
  OR 
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7438 weight  0.10000E+01 volume  0.47200E+00 ppm1      0.371 ppm2      2.232
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1228 and name HB2 ))
  OR 
   (( segid "    " and resid 1205 and name HB2 ))
  OR 
   (( segid "    " and resid 1201 and name HB2 ))
  OR 
   (( segid "    " and resid 1177 and name HB2 ))
  OR 
   (( segid "    " and resid 1176 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7440 weight  0.10000E+01 volume  0.33100E+00 ppm1      0.371 ppm2      2.686
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1226 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7300 weight  0.10000E+01 volume  0.10620E+01 ppm1      0.374 ppm2      2.860
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1228 and name HB1 ))
  OR 
   (( segid "    " and resid 1227 and name HB  ))
  OR 
   (( segid "    " and resid 1177 and name HB1 ))
  OR 
   (( segid "    " and resid 1170 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7441 weight  0.10000E+01 volume  0.32400E+00 ppm1      0.371 ppm2      3.710
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1179 and name HN  ))
  OR 
   (( segid "    " and resid 1177 and name HN  ))
 )
      5.000     5.000     0.000 peak  7445 weight  0.10000E+01 volume  0.60100E+00 ppm1      0.370 ppm2      7.877
 ASSI (
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )(
   (( segid "    " and resid 1226 and name HG2 ))
  OR 
   (( segid "    " and resid 1226 and name HB2 ))
  OR 
   (( segid "    " and resid 1214 and name HG  ))
  OR 
   (( segid "    " and resid 1202 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6375 weight  0.10000E+01 volume  0.81900E+00 ppm1      0.744 ppm2      1.665
 ASSI (
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1200 and name HB  ))
 )
      6.000     6.000     0.000 peak  6373 weight  0.10000E+01 volume  0.29400E+00 ppm1      0.741 ppm2      2.081
 ASSI (
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )(
   (( segid "    " and resid 1226 and name HB1 ))
  OR 
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6372 weight  0.10000E+01 volume  0.18000E+00 ppm1      0.741 ppm2      2.250
 ASSI (
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )(
   (( segid "    " and resid 1228 and name HB2 ))
  OR 
   (( segid "    " and resid 1205 and name HB2 ))
  OR 
   (( segid "    " and resid 1201 and name HB2 ))
  OR 
   (( segid "    " and resid 1177 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6371 weight  0.10000E+01 volume  0.38800E+00 ppm1      0.742 ppm2      2.688
 ASSI (
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
  OR 
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
  OR 
   (( segid "    " and resid 1178 and name HD21))
 )
      6.000     6.000     0.000 peak  6366 weight  0.10000E+01 volume  0.22600E+00 ppm1      0.742 ppm2      7.150
 ASSI (
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )(
   (( segid "    " and resid 1202 and name HN  ))
  OR 
   (( segid "    " and resid 1179 and name HN  ))
  OR 
   (( segid "    " and resid 1177 and name HN  ))
 )
      5.000     5.000     0.000 peak  6365 weight  0.10000E+01 volume  0.53200E+00 ppm1      0.740 ppm2      7.886
 ASSI (
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )(
   (( segid "    " and resid 1227 and name HN  ))
  OR 
   (( segid "    " and resid 1202 and name HN  ))
 )
      5.000     5.000     0.000 peak  6364 weight  0.10000E+01 volume  0.52100E+00 ppm1      0.739 ppm2      7.928
 ASSI (
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )(
   (( segid "    " and resid 1228 and name HN  ))
 )
      6.000     6.000     0.000 peak  6363 weight  0.10000E+01 volume  0.33400E+00 ppm1      0.740 ppm2      8.361
 ASSI (
   (( segid "    " and resid 1180 and name HA  ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1200 and name HB  ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6589 weight  0.10000E+01 volume -0.11420E+01 ppm1      4.717 ppm2      2.095
 ASSI (
   (( segid "    " and resid 1180 and name HA  ))
 )(
   (( segid "    " and resid 1181 and name HN  ))
 )
      3.300     3.300     0.000 peak  6588 weight  0.10000E+01 volume -0.16170E+01 ppm1      4.718 ppm2      8.341
 ASSI (
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1200 and name HB  ))
  OR 
   (( segid "    " and resid 1186 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8418 weight  0.10000E+01 volume  0.12010E+01 ppm1      1.222 ppm2      2.099
 ASSI (
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
 )(
   (( segid "    " and resid 1181 and name HN  ))
 )
      2.700     2.700     0.000 peak  8414 weight  0.10000E+01 volume  0.39340E+01 ppm1      1.223 ppm2      8.344
 ASSI (
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
 )(
   (( segid "    " and resid 1200 and name HN  ))
  OR 
   (( segid "    " and resid 1180 and name HN  ))
 )
      5.000     5.000     0.000 peak  8415 weight  0.10000E+01 volume  0.12160E+01 ppm1      1.223 ppm2      9.011
 ASSI (
   (( segid "    " and resid 1181 and name HB1 ))
 )(
   (( segid "    " and resid 1181 and name HA  ))
 )
      6.000     6.000     0.000 peak  8380 weight  0.10000E+01 volume  0.26900E+00 ppm1      1.523 ppm2      4.350
 ASSI (
   (( segid "    " and resid 1181 and name HB1 ))
 )(
   (( segid "    " and resid 1181 and name HN  ))
 )
      5.000     5.000     0.000 peak  8382 weight  0.10000E+01 volume  0.58800E+00 ppm1      1.522 ppm2      8.351
 ASSI (
   (( segid "    " and resid 1181 and name HB2 ))
 )(
   (( segid "    " and resid 1181 and name HN  ))
 )
      5.000     5.000     0.000 peak  8381 weight  0.10000E+01 volume  0.43000E+00 ppm1      1.356 ppm2      8.346
 ASSI (
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )(
   (( segid "    " and resid 1188 and name HB2 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
 )
      5.000     5.000     0.000 peak  8401 weight  0.10000E+01 volume  0.15260E+01 ppm1      0.800 ppm2      1.588
 ASSI (
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1200 and name HB  ))
  OR 
   (( segid "    " and resid 1198 and name HG2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8403 weight  0.10000E+01 volume  0.48900E+00 ppm1      0.798 ppm2      2.078
 ASSI (
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      2.700     2.700     0.000 peak  8386 weight  0.10000E+01 volume  0.50740E+01 ppm1      0.491 ppm2      0.799
 ASSI (
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )(
   (( segid "    " and resid 1223 and name HG  ))
  OR 
   (( segid "    " and resid 1179 and name HG12))
  OR 
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )
      5.000     5.000     0.000 peak  8387 weight  0.10000E+01 volume  0.10240E+01 ppm1      0.490 ppm2      1.041
 ASSI (
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1200 and name HB  ))
  OR 
   (( segid "    " and resid 1198 and name HG2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8391 weight  0.10000E+01 volume  0.77500E+00 ppm1      0.491 ppm2      2.080
 ASSI (
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )(
   (( segid "    " and resid 1189 and name HA  ))
  OR 
   (( segid "    " and resid 1188 and name HA  ))
  OR 
   (( segid "    " and resid 1181 and name HA  ))
 )
      3.300     3.300     0.000 peak  8393 weight  0.10000E+01 volume  0.23780E+01 ppm1      0.490 ppm2      4.352
 ASSI (
   (( segid "    " and resid 1182 and name HA  ))
 )(
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
  OR 
   (( segid "    " and resid 1182 and name HG2 ))
 )
      5.000     5.000     0.000 peak  6864 weight  0.10000E+01 volume -0.11660E+01 ppm1      3.795 ppm2      0.617
 ASSI (
   (( segid "    " and resid 1182 and name HA  ))
 )(
   (( segid "    " and resid 1182 and name HG1 ))
 )
      5.000     5.000     0.000 peak  6862 weight  0.10000E+01 volume -0.44300E+00 ppm1      3.795 ppm2      0.901
 ASSI (
   (( segid "    " and resid 1182 and name HA  ))
 )(
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6863 weight  0.10000E+01 volume -0.11560E+01 ppm1      3.793 ppm2      1.170
 ASSI (
   (( segid "    " and resid 1182 and name HA  ))
 )(
   (( segid "    " and resid 1181 and name HA  ))
 )
      6.000     6.000     0.000 peak  6865 weight  0.10000E+01 volume -0.17600E+00 ppm1      3.794 ppm2      4.349
 ASSI (
   (( segid "    " and resid 1182 and name HB1 ))
 )(
   (( segid "    " and resid 1182 and name HG2 ))
 )
      5.000     5.000     0.000 peak  8355 weight  0.10000E+01 volume  0.51100E+00 ppm1      1.177 ppm2      0.620
 ASSI (
   (( segid "    " and resid 1182 and name HB1 ))
 )(
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      5.000     5.000     0.000 peak  8356 weight  0.10000E+01 volume  0.61700E+00 ppm1      1.181 ppm2      0.783
 ASSI (
   (( segid "    " and resid 1182 and name HB1 ))
 )(
   (( segid "    " and resid 1182 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8358 weight  0.10000E+01 volume  0.40600E+00 ppm1      1.183 ppm2      0.911
 ASSI (
   (( segid "    " and resid 1182 and name HB1 ))
 )(
   (( segid "    " and resid 1182 and name HA  ))
 )
      5.000     5.000     0.000 peak  8353 weight  0.10000E+01 volume  0.41800E+00 ppm1      1.185 ppm2      3.804
 ASSI (
   (( segid "    " and resid 1182 and name HB2 ))
 )(
   (( segid "    " and resid 1182 and name HG2 ))
 )
      5.000     5.000     0.000 peak  8360 weight  0.10000E+01 volume  0.57400E+00 ppm1      1.154 ppm2      0.617
 ASSI (
   (( segid "    " and resid 1182 and name HB2 ))
 )(
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      5.000     5.000     0.000 peak  8359 weight  0.10000E+01 volume  0.55800E+00 ppm1      1.151 ppm2      0.786
 ASSI (
   (( segid "    " and resid 1182 and name HB2 ))
 )(
   (( segid "    " and resid 1182 and name HG1 ))
 )
      6.000     6.000     0.000 peak  8357 weight  0.10000E+01 volume  0.36600E+00 ppm1      1.157 ppm2      0.912
 ASSI (
   (( segid "    " and resid 1182 and name HB2 ))
 )(
   (( segid "    " and resid 1198 and name HG2 ))
 )
      6.000     6.000     0.000 peak  8362 weight  0.10000E+01 volume  0.18800E+00 ppm1      1.161 ppm2      2.061
 ASSI (
   (( segid "    " and resid 1182 and name HB2 ))
 )(
   (( segid "    " and resid 1182 and name HD2 ))
 )
      6.000     6.000     0.000 peak  8364 weight  0.10000E+01 volume  0.19600E+00 ppm1      1.152 ppm2      2.560
 ASSI (
   (( segid "    " and resid 1182 and name HB2 ))
 )(
   (( segid "    " and resid 1182 and name HA  ))
 )
      6.000     6.000     0.000 peak  8366 weight  0.10000E+01 volume  0.39400E+00 ppm1      1.149 ppm2      3.802
 ASSI (
   (( segid "    " and resid 1182 and name HD1 ))
 )(
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      5.000     5.000     0.000 peak  8066 weight  0.10000E+01 volume  0.14620E+01 ppm1      2.748 ppm2      0.795
 ASSI (
   (( segid "    " and resid 1182 and name HD1 ))
 )(
   (( segid "    " and resid 1198 and name HG2 ))
 )
      5.000     5.000     0.000 peak  8056 weight  0.10000E+01 volume  0.48900E+00 ppm1      2.749 ppm2      2.053
 ASSI (
   (( segid "    " and resid 1182 and name HD1 ))
 )(
   (( segid "    " and resid 1200 and name HB  ))
  OR 
   (( segid "    " and resid 1198 and name HG1 ))
 )
      6.000     6.000     0.000 peak  8058 weight  0.10000E+01 volume  0.24300E+00 ppm1      2.744 ppm2      2.161
 ASSI (
   (( segid "    " and resid 1182 and name HD2 ))
 )(
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      5.000     5.000     0.000 peak  8067 weight  0.10000E+01 volume  0.80500E+00 ppm1      2.557 ppm2      0.786
 ASSI (
   (( segid "    " and resid 1182 and name HD2 ))
 )(
   (( segid "    " and resid 1198 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8062 weight  0.10000E+01 volume  0.39000E+00 ppm1      2.549 ppm2      1.801
 ASSI (
   (( segid "    " and resid 1182 and name HD2 ))
 )(
   (( segid "    " and resid 1198 and name HG2 ))
 )
      6.000     6.000     0.000 peak  8057 weight  0.10000E+01 volume  0.38700E+00 ppm1      2.557 ppm2      2.059
 ASSI (
   (( segid "    " and resid 1183 and name HA  ))
 )(
   (( segid "    " and resid 1183 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6514 weight  0.10000E+01 volume -0.22700E+00 ppm1      4.864 ppm2      7.297
 ASSI (
   (( segid "    " and resid 1183 and name HA  ))
 )(
   (( segid "    " and resid 1183 and name HE3 ))
 )
      5.000     5.000     0.000 peak  6512 weight  0.10000E+01 volume -0.55800E+00 ppm1      4.862 ppm2      7.669
 ASSI (
   (( segid "    " and resid 1183 and name HB2 ))
  OR 
   (( segid "    " and resid 1183 and name HB1 ))
 )(
   (( segid "    " and resid 1183 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8347 weight  0.10000E+01 volume  0.35400E+00 ppm1      3.273 ppm2      7.309
 ASSI (
   (( segid "    " and resid 1183 and name HB2 ))
  OR 
   (( segid "    " and resid 1183 and name HB1 ))
 )(
   (( segid "    " and resid 1184 and name HN  ))
  OR 
   (( segid "    " and resid 1183 and name HE3 ))
 )
      6.000     6.000     0.000 peak  8349 weight  0.10000E+01 volume  0.32900E+00 ppm1      3.273 ppm2      7.602
 ASSI (
   (( segid "    " and resid 1183 and name HB2 ))
  OR 
   (( segid "    " and resid 1183 and name HB1 ))
 )(
   (( segid "    " and resid 1183 and name HE3 ))
 )
      5.000     5.000     0.000 peak  8348 weight  0.10000E+01 volume  0.45500E+00 ppm1      3.279 ppm2      7.664
 ASSI (
   (( segid "    " and resid 1183 and name HE3 ))
 )(
   (( segid "    " and resid 1183 and name HZ3 ))
 )
      5.000     5.000     0.000 peak  8340 weight  0.10000E+01 volume -0.95000E+00 ppm1      7.649 ppm2      7.119
 ASSI (
   (( segid "    " and resid 1183 and name HH2 ))
 )(
   (( segid "    " and resid 1183 and name HZ2 ))
 )
      3.300     3.300     0.000 peak  8343 weight  0.10000E+01 volume -0.16290E+01 ppm1      7.180 ppm2      7.431
 ASSI (
   (( segid "    " and resid 1184 and name HA  ))
 )(
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      6.000     6.000     0.000 peak  6854 weight  0.10000E+01 volume -0.38500E+00 ppm1      3.973 ppm2      0.812
 ASSI (
   (( segid "    " and resid 1184 and name HA  ))
 )(
   (( segid "    " and resid 1186 and name HG2 ))
  OR 
   (( segid "    " and resid 1185 and name HB3 ))
  OR 
   (( segid "    " and resid 1185 and name HB2 ))
  OR 
   (( segid "    " and resid 1185 and name HB1 ))
  OR 
   (( segid "    " and resid 1181 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6852 weight  0.10000E+01 volume -0.24000E+00 ppm1      3.976 ppm2      1.402
 ASSI (
   (( segid "    " and resid 1184 and name HA  ))
 )(
   (( segid "    " and resid 1184 and name HN  ))
 )
      5.000     5.000     0.000 peak  6840 weight  0.10000E+01 volume -0.76800E+00 ppm1      3.974 ppm2      7.583
 ASSI (
   (( segid "    " and resid 1184 and name HB  ))
 )(
   (( segid "    " and resid 1184 and name HG23))
  OR 
   (( segid "    " and resid 1184 and name HG22))
  OR 
   (( segid "    " and resid 1184 and name HG21))
 )
      3.300     3.300     0.000 peak  8334 weight  0.10000E+01 volume -0.26920E+01 ppm1      4.194 ppm2      1.123
 ASSI (
   (( segid "    " and resid 1184 and name HB  ))
 )(
   (( segid "    " and resid 1203 and name HN  ))
  OR 
   (( segid "    " and resid 1185 and name HN  ))
 )
      6.000     6.000     0.000 peak  8331 weight  0.10000E+01 volume -0.31300E+00 ppm1      4.189 ppm2      8.259
 ASSI (
   (( segid "    " and resid 1184 and name HG23))
  OR 
   (( segid "    " and resid 1184 and name HG22))
  OR 
   (( segid "    " and resid 1184 and name HG21))
 )(
   (( segid "    " and resid 1203 and name HG1 ))
  OR 
   (( segid "    " and resid 1203 and name HB2 ))
  OR 
   (( segid "    " and resid 1186 and name HB1 ))
  OR 
   (( segid "    " and resid 1179 and name HB  ))
 )
      6.000     6.000     0.000 peak  6868 weight  0.10000E+01 volume  0.34500E+00 ppm1      1.114 ppm2      1.796
 ASSI (
   (( segid "    " and resid 1185 and name HA  ))
 )(
   (( segid "    " and resid 1186 and name HN  ))
 )
      5.000     5.000     0.000 peak  6838 weight  0.10000E+01 volume -0.15910E+01 ppm1      4.248 ppm2      7.739
 ASSI (
   (( segid "    " and resid 1185 and name HA  ))
 )(
   (( segid "    " and resid 1185 and name HN  ))
 )
      5.000     5.000     0.000 peak  6837 weight  0.10000E+01 volume -0.12600E+01 ppm1      4.247 ppm2      8.257
 ASSI (
   (( segid "    " and resid 1185 and name HB3 ))
  OR 
   (( segid "    " and resid 1185 and name HB2 ))
  OR 
   (( segid "    " and resid 1185 and name HB1 ))
 )(
   (( segid "    " and resid 1185 and name HA  ))
 )
      2.700     2.700     0.000 peak  8328 weight  0.10000E+01 volume  0.58110E+01 ppm1      1.415 ppm2      4.246
 ASSI (
   (( segid "    " and resid 1187 and name HA  ))
 )(
   (( segid "    " and resid 1189 and name HB2 ))
  OR 
   (( segid "    " and resid 1188 and name HD2 ))
  OR 
   (( segid "    " and resid 1188 and name HD1 ))
  OR 
   (( segid "    " and resid 1188 and name HB2 ))
  OR 
   (( segid "    " and resid 1186 and name HG1 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
 )
      5.000     5.000     0.000 peak  8283 weight  0.10000E+01 volume -0.87100E+00 ppm1      4.146 ppm2      1.601
 ASSI (
   (( segid "    " and resid 1187 and name HA  ))
 )(
   (( segid "    " and resid 1187 and name HB2 ))
  OR 
   (( segid "    " and resid 1187 and name HB1 ))
  OR 
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )
      3.300     3.300     0.000 peak  3134 weight  0.10000E+01 volume -0.26180E+01 ppm1      4.144 ppm2      2.022
 ASSI (
   (( segid "    " and resid 1187 and name HA  ))
 )(
   (( segid "    " and resid 1188 and name HN  ))
  OR 
   (( segid "    " and resid 1187 and name HN  ))
 )
      2.700     2.700     0.000 peak  2542 weight  0.10000E+01 volume -0.48770E+01 ppm1      4.145 ppm2      8.050
 ASSI (
   (( segid "    " and resid 1187 and name HG1 ))
 )(
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )
      6.000     6.000     0.000 peak  9210 weight  0.10000E+01 volume  0.38200E+00 ppm1      2.311 ppm2      0.492
 ASSI (
   (( segid "    " and resid 1187 and name HG1 ))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
 )
      5.000     5.000     0.000 peak  9372 weight  0.10000E+01 volume  0.54000E+00 ppm1      2.320 ppm2      0.797
 ASSI (
   (( segid "    " and resid 1187 and name HG1 ))
 )(
   (( segid "    " and resid 1188 and name HN  ))
  OR 
   (( segid "    " and resid 1187 and name HN  ))
 )
      6.000     6.000     0.000 peak  9380 weight  0.10000E+01 volume  0.36000E+00 ppm1      2.316 ppm2      8.051
 ASSI (
   (( segid "    " and resid 1187 and name HG2 ))
 )(
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )
      5.000     5.000     0.000 peak  9209 weight  0.10000E+01 volume  0.41400E+00 ppm1      2.231 ppm2      0.492
 ASSI (
   (( segid "    " and resid 1187 and name HG2 ))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
 )
      5.000     5.000     0.000 peak  9373 weight  0.10000E+01 volume  0.47600E+00 ppm1      2.227 ppm2      0.797
 ASSI (
   (( segid "    " and resid 1187 and name HG2 ))
 )(
   (( segid "    " and resid 1188 and name HN  ))
  OR 
   (( segid "    " and resid 1187 and name HN  ))
 )
      5.000     5.000     0.000 peak  9381 weight  0.10000E+01 volume  0.41200E+00 ppm1      2.229 ppm2      8.051
 ASSI (
   (( segid "    " and resid 1188 and name HB2 ))
 )(
   (( segid "    " and resid 1188 and name HA  ))
 )
      5.000     5.000     0.000 peak  8905 weight  0.10000E+01 volume  0.64200E+00 ppm1      1.618 ppm2      4.397
 ASSI (
   (( segid "    " and resid 1189 and name HD13))
  OR 
   (( segid "    " and resid 1189 and name HD12))
  OR 
   (( segid "    " and resid 1189 and name HD11))
 )(
   (( segid "    " and resid 1171 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9616 weight  0.10000E+01 volume  0.60600E+00 ppm1      0.909 ppm2      1.895
 ASSI (
   (( segid "    " and resid 1189 and name HD13))
  OR 
   (( segid "    " and resid 1189 and name HD12))
  OR 
   (( segid "    " and resid 1189 and name HD11))
 )(
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9610 weight  0.10000E+01 volume  0.24900E+00 ppm1      0.912 ppm2      6.864
 ASSI (
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
 )(
   (( segid "    " and resid 1189 and name HG  ))
  OR 
   (( segid "    " and resid 1189 and name HB2 ))
 )
      3.300     3.300     0.000 peak  9300 weight  0.10000E+01 volume  0.29480E+01 ppm1      0.764 ppm2      1.528
 ASSI (
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
 )(
   (( segid "    " and resid 1175 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9298 weight  0.10000E+01 volume  0.59100E+00 ppm1      0.765 ppm2      2.086
 ASSI (
   (( segid "    " and resid 1189 and name HG  ))
 )(
   (( segid "    " and resid 1189 and name HA  ))
 )
      5.000     5.000     0.000 peak  9368 weight  0.10000E+01 volume  0.43400E+00 ppm1      1.512 ppm2      4.345
 ASSI (
   (( segid "    " and resid 1190 and name HA  ))
 )(
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
  OR 
   (( segid "    " and resid 1168 and name HG23))
  OR 
   (( segid "    " and resid 1168 and name HG22))
  OR 
   (( segid "    " and resid 1168 and name HG21))
  OR 
   (( segid "    " and resid 1168 and name HG13))
  OR 
   (( segid "    " and resid 1168 and name HG12))
  OR 
   (( segid "    " and resid 1168 and name HG11))
 )
      6.000     6.000     0.000 peak  6292 weight  0.10000E+01 volume -0.30200E+00 ppm1      5.359 ppm2      0.827
 ASSI (
   (( segid "    " and resid 1190 and name HD1 ))
 )(
   (( segid "    " and resid 1189 and name HG  ))
  OR 
   (( segid "    " and resid 1189 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7678 weight  0.10000E+01 volume -0.29100E+00 ppm1      6.847 ppm2      1.555
 ASSI (
   (( segid "    " and resid 1190 and name HE2 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )(
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )
      6.000     6.000     0.000 peak  9606 weight  0.10000E+01 volume -0.28400E+00 ppm1      6.735 ppm2      0.635
 ASSI (
   (( segid "    " and resid 1190 and name HE2 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )(
   (( segid "    " and resid 1189 and name HB2 ))
 )
      6.000     6.000     0.000 peak  9605 weight  0.10000E+01 volume -0.35200E+00 ppm1      6.740 ppm2      1.600
 ASSI (
   (( segid "    " and resid 1191 and name HB1 ))
 )(
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )
      6.000     6.000     0.000 peak  7797 weight  0.10000E+01 volume -0.20400E+00 ppm1      3.544 ppm2      0.147
 ASSI (
   (( segid "    " and resid 1191 and name HB1 ))
 )(
   (( segid "    " and resid 1192 and name HB1 ))
  OR 
   (( segid "    " and resid 1188 and name HD2 ))
  OR 
   (( segid "    " and resid 1188 and name HD1 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
 )
      6.000     6.000     0.000 peak  7803 weight  0.10000E+01 volume -0.17600E+00 ppm1      3.545 ppm2      1.640
 ASSI (
   (( segid "    " and resid 1191 and name HB1 ))
 )(
   (( segid "    " and resid 1167 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7804 weight  0.10000E+01 volume -0.35500E+00 ppm1      3.547 ppm2      2.709
 ASSI (
   (( segid "    " and resid 1191 and name HB1 ))
 )(
   (( segid "    " and resid 1218 and name HB2 ))
  OR 
   (( segid "    " and resid 1190 and name HB1 ))
  OR 
   (( segid "    " and resid 1167 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7805 weight  0.10000E+01 volume -0.52500E+00 ppm1      3.546 ppm2      2.797
 ASSI (
   (( segid "    " and resid 1191 and name HB1 ))
 )(
   (( segid "    " and resid 1191 and name HB2 ))
 )
      2.700     2.700     0.000 peak  7808 weight  0.10000E+01 volume -0.52230E+01 ppm1      3.546 ppm2      3.438
 ASSI (
   (( segid "    " and resid 1191 and name HB1 ))
 )(
   (( segid "    " and resid 1221 and name HA2 ))
  OR 
   (( segid "    " and resid 1193 and name HA  ))
 )
      5.000     5.000     0.000 peak  7810 weight  0.10000E+01 volume -0.43200E+00 ppm1      3.544 ppm2      3.711
 ASSI (
   (( segid "    " and resid 1191 and name HB1 ))
 )(
   (( segid "    " and resid 1191 and name HA  ))
 )
      3.300     3.300     0.000 peak  3156 weight  0.10000E+01 volume -0.29890E+01 ppm1      3.547 ppm2      4.639
 ASSI (
   (( segid "    " and resid 1191 and name HB1 ))
 )(
   (( segid "    " and resid 1192 and name HN  ))
  OR 
   (( segid "    " and resid 1191 and name HN  ))
 )
      5.000     5.000     0.000 peak  7796 weight  0.10000E+01 volume -0.97200E+00 ppm1      3.545 ppm2      8.814
 ASSI (
   (( segid "    " and resid 1191 and name HB1 ))
 )(
   (( segid "    " and resid 1191 and name HN  ))
 )
      5.000     5.000     0.000 peak  7816 weight  0.10000E+01 volume -0.55600E+00 ppm1      3.547 ppm2      8.875
 ASSI (
   (( segid "    " and resid 1191 and name HB2 ))
 )(
   (( segid "    " and resid 1192 and name HB1 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
 )
      6.000     6.000     0.000 peak  7802 weight  0.10000E+01 volume -0.20200E+00 ppm1      3.441 ppm2      1.640
 ASSI (
   (( segid "    " and resid 1191 and name HB2 ))
 )(
   (( segid "    " and resid 1167 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7807 weight  0.10000E+01 volume -0.41100E+00 ppm1      3.439 ppm2      2.696
 ASSI (
   (( segid "    " and resid 1191 and name HB2 ))
 )(
   (( segid "    " and resid 1218 and name HB2 ))
  OR 
   (( segid "    " and resid 1190 and name HB2 ))
  OR 
   (( segid "    " and resid 1190 and name HB1 ))
  OR 
   (( segid "    " and resid 1167 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7806 weight  0.10000E+01 volume -0.49600E+00 ppm1      3.433 ppm2      2.792
 ASSI (
   (( segid "    " and resid 1191 and name HB2 ))
 )(
   (( segid "    " and resid 1221 and name HA2 ))
  OR 
   (( segid "    " and resid 1196 and name HB2 ))
  OR 
   (( segid "    " and resid 1196 and name HB1 ))
  OR 
   (( segid "    " and resid 1193 and name HA  ))
 )
      5.000     5.000     0.000 peak  7811 weight  0.10000E+01 volume -0.48200E+00 ppm1      3.439 ppm2      3.702
 ASSI (
   (( segid "    " and resid 1191 and name HB2 ))
 )(
   (( segid "    " and resid 1192 and name HA  ))
  OR 
   (( segid "    " and resid 1168 and name HA  ))
 )
      6.000     6.000     0.000 peak  7812 weight  0.10000E+01 volume -0.21500E+00 ppm1      3.440 ppm2      4.239
 ASSI (
   (( segid "    " and resid 1191 and name HB2 ))
 )(
   (( segid "    " and resid 1191 and name HA  ))
 )
      2.700     2.700     0.000 peak  8249 weight  0.10000E+01 volume -0.31260E+01 ppm1      3.437 ppm2      4.637
 ASSI (
   (( segid "    " and resid 1191 and name HB2 ))
 )(
   (( segid "    " and resid 1192 and name HN  ))
  OR 
   (( segid "    " and resid 1191 and name HN  ))
 )
      5.000     5.000     0.000 peak  7814 weight  0.10000E+01 volume -0.12670E+01 ppm1      3.439 ppm2      8.810
 ASSI (
   (( segid "    " and resid 1191 and name HB2 ))
 )(
   (( segid "    " and resid 1191 and name HN  ))
 )
      5.000     5.000     0.000 peak  7815 weight  0.10000E+01 volume -0.90800E+00 ppm1      3.437 ppm2      8.860
 ASSI (
   (( segid "    " and resid 1192 and name HA  ))
 )(
   (( segid "    " and resid 1195 and name HG2 ))
  OR 
   (( segid "    " and resid 1195 and name HG1 ))
  OR 
   (( segid "    " and resid 1166 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8245 weight  0.10000E+01 volume -0.55900E+00 ppm1      4.245 ppm2      2.197
 ASSI (
   (( segid "    " and resid 1192 and name HA  ))
 )(
   (( segid "    " and resid 1218 and name HB1 ))
  OR 
   (( segid "    " and resid 1192 and name HD2 ))
  OR 
   (( segid "    " and resid 1192 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6835 weight  0.10000E+01 volume -0.30900E+00 ppm1      4.242 ppm2      3.134
 ASSI (
   (( segid "    " and resid 1192 and name HB2 ))
 )(
   (( segid "    " and resid 1192 and name HD2 ))
  OR 
   (( segid "    " and resid 1192 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9715 weight  0.10000E+01 volume  0.65100E+00 ppm1      1.466 ppm2      3.125
 ASSI (
   (( segid "    " and resid 1193 and name HA  ))
 )(
   (( segid "    " and resid 1218 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8236 weight  0.10000E+01 volume -0.18700E+00 ppm1      3.670 ppm2      2.840
 ASSI (
   (( segid "    " and resid 1193 and name HA  ))
 )(
   (( segid "    " and resid 1218 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8235 weight  0.10000E+01 volume -0.30100E+00 ppm1      3.663 ppm2      3.096
 ASSI (
   (( segid "    " and resid 1193 and name HA  ))
 )(
   (( segid "    " and resid 1194 and name HA2 ))
  OR 
   (( segid "    " and resid 1193 and name HB  ))
  OR 
   (( segid "    " and resid 1191 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8237 weight  0.10000E+01 volume -0.60800E+00 ppm1      3.664 ppm2      3.560
 ASSI (
   (( segid "    " and resid 1193 and name HA  ))
 )(
   (( segid "    " and resid 1195 and name HA  ))
  OR 
   (( segid "    " and resid 1194 and name HA1 ))
  OR 
   (( segid "    " and resid 1164 and name HA  ))
  OR 
   (( segid "    " and resid 1142 and name HA  ))
 )
      6.000     6.000     0.000 peak  9305 weight  0.10000E+01 volume -0.15400E+00 ppm1      3.663 ppm2      4.390
 ASSI (
   (( segid "    " and resid 1193 and name HA  ))
 )(
   (( segid "    " and resid 1219 and name HA  ))
  OR 
   (( segid "    " and resid 1218 and name HA  ))
 )
      5.000     5.000     0.000 peak  8234 weight  0.10000E+01 volume -0.69800E+00 ppm1      3.665 ppm2      4.641
 ASSI (
   (( segid "    " and resid 1193 and name HB  ))
 )(
   (( segid "    " and resid 1164 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8242 weight  0.10000E+01 volume -0.78300E+00 ppm1      3.565 ppm2      1.669
 ASSI (
   (( segid "    " and resid 1193 and name HB  ))
 )(
   (( segid "    " and resid 1143 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8241 weight  0.10000E+01 volume -0.47800E+00 ppm1      3.563 ppm2      1.812
 ASSI (
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )(
   (( segid "    " and resid 1220 and name HB2 ))
  OR 
   (( segid "    " and resid 1145 and name HB2 ))
  OR 
   (( segid "    " and resid 1143 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9308 weight  0.10000E+01 volume  0.35900E+00 ppm1      0.412 ppm2      1.799
 ASSI (
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )(
   (( segid "    " and resid 1194 and name HA2 ))
  OR 
   (( segid "    " and resid 1193 and name HB  ))
 )
      5.000     5.000     0.000 peak  8244 weight  0.10000E+01 volume  0.14430E+01 ppm1      0.417 ppm2      3.570
 ASSI (
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )(
   (( segid "    " and resid 1219 and name HA  ))
 )
      3.300     3.300     0.000 peak  7599 weight  0.10000E+01 volume  0.22460E+01 ppm1      0.416 ppm2      4.643
 ASSI (
   (( segid "    " and resid 1194 and name HA1 ))
 )(
   (( segid "    " and resid 1195 and name HN  ))
 )
      6.000     6.000     0.000 peak  6817 weight  0.10000E+01 volume -0.30900E+00 ppm1      4.411 ppm2      8.041
 ASSI (
   (( segid "    " and resid 1194 and name HA2 ))
 )(
   (( segid "    " and resid 1195 and name HN  ))
 )
      6.000     6.000     0.000 peak  6818 weight  0.10000E+01 volume -0.28000E+00 ppm1      3.588 ppm2      8.041
 ASSI (
   (( segid "    " and resid 1195 and name HA  ))
 )(
   (( segid "    " and resid 1195 and name HG2 ))
  OR 
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6810 weight  0.10000E+01 volume -0.20400E+01 ppm1      4.431 ppm2      2.141
 ASSI (
   (( segid "    " and resid 1195 and name HA  ))
 )(
   (( segid "    " and resid 1195 and name HG1 ))
 )
      5.000     5.000     0.000 peak  6811 weight  0.10000E+01 volume -0.10350E+01 ppm1      4.429 ppm2      2.231
 ASSI (
   (( segid "    " and resid 1195 and name HA  ))
 )(
   (( segid "    " and resid 1196 and name HB2 ))
  OR 
   (( segid "    " and resid 1196 and name HB1 ))
  OR 
   (( segid "    " and resid 1193 and name HA  ))
 )
      5.000     5.000     0.000 peak  6812 weight  0.10000E+01 volume -0.41400E+00 ppm1      4.426 ppm2      3.671
 ASSI (
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
 )(
   (( segid "    " and resid 1195 and name HA  ))
 )
      3.300     3.300     0.000 peak  9710 weight  0.10000E+01 volume  0.17640E+01 ppm1      2.135 ppm2      4.427
 ASSI (
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
 )(
   (( segid "    " and resid 1219 and name HA  ))
  OR 
   (( segid "    " and resid 1218 and name HA  ))
  OR 
   (( segid "    " and resid 1191 and name HA  ))
 )
      5.000     5.000     0.000 peak  9709 weight  0.10000E+01 volume  0.56300E+00 ppm1      2.137 ppm2      4.626
 ASSI (
   (( segid "    " and resid 1195 and name HG1 ))
 )(
   (( segid "    " and resid 1195 and name HA  ))
  OR 
   (( segid "    " and resid 1194 and name HA1 ))
 )
      5.000     5.000     0.000 peak  7507 weight  0.10000E+01 volume  0.10570E+01 ppm1      2.244 ppm2      4.428
 ASSI (
   (( segid "    " and resid 1195 and name HG2 ))
 )(
   (( segid "    " and resid 1195 and name HA  ))
  OR 
   (( segid "    " and resid 1194 and name HA1 ))
 )
      5.000     5.000     0.000 peak  7508 weight  0.10000E+01 volume  0.93200E+00 ppm1      2.204 ppm2      4.428
 ASSI (
   (( segid "    " and resid 1196 and name HA  ))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
 )
      5.000     5.000     0.000 peak  6340 weight  0.10000E+01 volume -0.47200E+00 ppm1      5.146 ppm2      0.623
 ASSI (
   (( segid "    " and resid 1196 and name HA  ))
 )(
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
 )
      5.000     5.000     0.000 peak  6338 weight  0.10000E+01 volume -0.52400E+00 ppm1      5.148 ppm2      1.044
 ASSI (
   (( segid "    " and resid 1196 and name HA  ))
 )(
   (( segid "    " and resid 1197 and name HB  ))
 )
      6.000     6.000     0.000 peak  6438 weight  0.10000E+01 volume -0.17600E+00 ppm1      5.148 ppm2      1.560
 ASSI (
   (( segid "    " and resid 1196 and name HA  ))
 )(
   (( segid "    " and resid 1195 and name HA  ))
  OR 
   (( segid "    " and resid 1194 and name HA1 ))
 )
      6.000     6.000     0.000 peak  6437 weight  0.10000E+01 volume -0.27900E+00 ppm1      5.148 ppm2      4.430
 ASSI (
   (( segid "    " and resid 1196 and name HB2 ))
  OR 
   (( segid "    " and resid 1196 and name HB1 ))
 )(
   (( segid "    " and resid 1198 and name HG1 ))
  OR 
   (( segid "    " and resid 1195 and name HG2 ))
  OR 
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7980 weight  0.10000E+01 volume -0.33300E+00 ppm1      3.655 ppm2      2.169
 ASSI (
   (( segid "    " and resid 1196 and name HB2 ))
  OR 
   (( segid "    " and resid 1196 and name HB1 ))
 )(
   (( segid "    " and resid 1195 and name HA  ))
  OR 
   (( segid "    " and resid 1194 and name HA1 ))
 )
      5.000     5.000     0.000 peak  7987 weight  0.10000E+01 volume -0.98400E+00 ppm1      3.654 ppm2      4.429
 ASSI (
   (( segid "    " and resid 1197 and name HA  ))
 )(
   (( segid "    " and resid 1215 and name HB1 ))
  OR 
   (( segid "    " and resid 1198 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6803 weight  0.10000E+01 volume -0.29700E+00 ppm1      4.035 ppm2      1.794
 ASSI (
   (( segid "    " and resid 1197 and name HA  ))
 )(
   (( segid "    " and resid 1198 and name HG1 ))
  OR 
   (( segid "    " and resid 1195 and name HG2 ))
  OR 
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6802 weight  0.10000E+01 volume -0.17100E+00 ppm1      4.037 ppm2      2.183
 ASSI (
   (( segid "    " and resid 1197 and name HA  ))
 )(
   (( segid "    " and resid 1217 and name HA  ))
  OR 
   (( segid "    " and resid 1198 and name HA  ))
 )
      6.000     6.000     0.000 peak  6801 weight  0.10000E+01 volume -0.22800E+00 ppm1      4.038 ppm2      4.796
 ASSI (
   (( segid "    " and resid 1197 and name HB  ))
 )(
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
  OR 
   (( segid "    " and resid 1181 and name HD23))
 )
      6.000     6.000     0.000 peak  8218 weight  0.10000E+01 volume  0.37200E+00 ppm1      1.540 ppm2      0.511
 ASSI (
   (( segid "    " and resid 1197 and name HB  ))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HD2 ))
 )
      6.000     6.000     0.000 peak  8222 weight  0.10000E+01 volume  0.28000E+00 ppm1      1.544 ppm2      7.160
 ASSI (
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
 )(
   (( segid "    " and resid 1223 and name HB2 ))
  OR 
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )
      5.000     5.000     0.000 peak  8227 weight  0.10000E+01 volume  0.77000E+00 ppm1      0.622 ppm2      1.142
 ASSI (
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )(
   (( segid "    " and resid 1182 and name HE  ))
 )
      6.000     6.000     0.000 peak  7777 weight  0.10000E+01 volume  0.21800E+00 ppm1      0.145 ppm2      6.805
 ASSI (
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
  OR 
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7776 weight  0.10000E+01 volume  0.56900E+00 ppm1      0.145 ppm2      7.166
 ASSI (
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )(
   (( segid "    " and resid 1197 and name HN  ))
 )
      6.000     6.000     0.000 peak  7774 weight  0.10000E+01 volume  0.20000E+00 ppm1      0.145 ppm2      8.987
 ASSI (
   (( segid "    " and resid 1198 and name HA  ))
 )(
   (( segid "    " and resid 1215 and name HG2 ))
  OR 
   (( segid "    " and resid 1215 and name HG1 ))
 )
      6.000     6.000     0.000 peak  6550 weight  0.10000E+01 volume -0.25500E+00 ppm1      4.790 ppm2      1.460
 ASSI (
   (( segid "    " and resid 1198 and name HA  ))
 )(
   (( segid "    " and resid 1215 and name HB2 ))
  OR 
   (( segid "    " and resid 1214 and name HG  ))
  OR 
   (( segid "    " and resid 1214 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6549 weight  0.10000E+01 volume -0.28000E+00 ppm1      4.791 ppm2      1.647
 ASSI (
   (( segid "    " and resid 1198 and name HA  ))
 )(
   (( segid "    " and resid 1215 and name HB1 ))
  OR 
   (( segid "    " and resid 1198 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6548 weight  0.10000E+01 volume -0.59600E+00 ppm1      4.793 ppm2      1.788
 ASSI (
   (( segid "    " and resid 1198 and name HA  ))
 )(
   (( segid "    " and resid 1198 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6547 weight  0.10000E+01 volume -0.48600E+00 ppm1      4.792 ppm2      1.883
 ASSI (
   (( segid "    " and resid 1198 and name HA  ))
 )(
   (( segid "    " and resid 1199 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8205 weight  0.10000E+01 volume -0.13400E+00 ppm1      4.795 ppm2      2.907
 ASSI (
   (( segid "    " and resid 1198 and name HA  ))
 )(
   (( segid "    " and resid 1215 and name HA  ))
 )
      5.000     5.000     0.000 peak  6297 weight  0.10000E+01 volume -0.15730E+01 ppm1      4.791 ppm2      5.282
 ASSI (
   (( segid "    " and resid 1198 and name HA  ))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HD2 ))
 )
      6.000     6.000     0.000 peak  6544 weight  0.10000E+01 volume -0.18600E+00 ppm1      4.790 ppm2      7.158
 ASSI (
   (( segid "    " and resid 1198 and name HA  ))
 )(
   (( segid "    " and resid 1199 and name HN  ))
 )
      3.300     3.300     0.000 peak  6542 weight  0.10000E+01 volume -0.18360E+01 ppm1      4.790 ppm2      8.463
 ASSI (
   (( segid "    " and resid 1198 and name HB1 ))
 )(
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8206 weight  0.10000E+01 volume  0.58800E+00 ppm1      1.888 ppm2      1.177
 ASSI (
   (( segid "    " and resid 1198 and name HB2 ))
 )(
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8207 weight  0.10000E+01 volume  0.80100E+00 ppm1      1.794 ppm2      1.177
 ASSI (
   (( segid "    " and resid 1199 and name HA  ))
 )(
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
  OR 
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
  OR 
   (( segid "    " and resid 1182 and name HG2 ))
 )
      5.000     5.000     0.000 peak  6316 weight  0.10000E+01 volume -0.57200E+00 ppm1      5.274 ppm2      0.632
 ASSI (
   (( segid "    " and resid 1199 and name HA  ))
 )(
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )
      6.000     6.000     0.000 peak  6317 weight  0.10000E+01 volume -0.32200E+00 ppm1      5.272 ppm2      0.778
 ASSI (
   (( segid "    " and resid 1199 and name HA  ))
 )(
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
  OR 
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
  OR 
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6319 weight  0.10000E+01 volume -0.21400E+00 ppm1      5.275 ppm2      1.187
 ASSI (
   (( segid "    " and resid 1199 and name HA  ))
 )(
   (( segid "    " and resid 1199 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6315 weight  0.10000E+01 volume -0.45200E+00 ppm1      5.273 ppm2      2.910
 ASSI (
   (( segid "    " and resid 1199 and name HA  ))
 )(
   (( segid "    " and resid 1199 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6314 weight  0.10000E+01 volume -0.60000E+00 ppm1      5.273 ppm2      3.140
 ASSI (
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1224 and name HG2 ))
  OR 
   (( segid "    " and resid 1200 and name HB  ))
  OR 
   (( segid "    " and resid 1198 and name HG2 ))
 )
      6.000     6.000     0.000 peak  8196 weight  0.10000E+01 volume -0.20700E+00 ppm1      7.159 ppm2      2.078
 ASSI (
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )(
   (( segid "    " and resid 1198 and name HA  ))
  OR 
   (( segid "    " and resid 1180 and name HA  ))
 )
      6.000     6.000     0.000 peak  9596 weight  0.10000E+01 volume -0.15300E+00 ppm1      7.147 ppm2      4.760
 ASSI (
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
  OR 
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )
      5.000     5.000     0.000 peak  7788 weight  0.10000E+01 volume -0.43700E+00 ppm1      7.173 ppm2      0.397
 ASSI (
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1224 and name HG2 ))
  OR 
   (( segid "    " and resid 1198 and name HG2 ))
 )
      6.000     6.000     0.000 peak  7792 weight  0.10000E+01 volume -0.24800E+00 ppm1      7.173 ppm2      2.095
 ASSI (
   (( segid "    " and resid 1200 and name HA  ))
 )(
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
  OR 
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )
      3.300     3.300     0.000 peak  6796 weight  0.10000E+01 volume -0.17050E+01 ppm1      4.586 ppm2      0.644
 ASSI (
   (( segid "    " and resid 1200 and name HB  ))
 )(
   (( segid "    " and resid 1214 and name HA  ))
  OR 
   (( segid "    " and resid 1204 and name HA1 ))
  OR 
   (( segid "    " and resid 1184 and name HB  ))
 )
      6.000     6.000     0.000 peak  8170 weight  0.10000E+01 volume  0.30300E+00 ppm1      2.120 ppm2      4.196
 ASSI (
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
 )(
   (( segid "    " and resid 1201 and name HN  ))
  OR 
   (( segid "    " and resid 1199 and name HN  ))
  OR 
   (( segid "    " and resid 1183 and name HN  ))
 )
      5.000     5.000     0.000 peak  8177 weight  0.10000E+01 volume  0.40200E+00 ppm1      0.779 ppm2      8.461
 ASSI (
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )(
   (( segid "    " and resid 1181 and name HA  ))
 )
      6.000     6.000     0.000 peak  8190 weight  0.10000E+01 volume  0.18900E+00 ppm1      0.610 ppm2      4.353
 ASSI (
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )(
   (( segid "    " and resid 1180 and name HA  ))
 )
      6.000     6.000     0.000 peak  8189 weight  0.10000E+01 volume  0.16000E+00 ppm1      0.610 ppm2      4.735
 ASSI (
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )(
   (( segid "    " and resid 1187 and name HN  ))
  OR 
   (( segid "    " and resid 1182 and name HN  ))
 )
      6.000     6.000     0.000 peak  8186 weight  0.10000E+01 volume  0.18500E+00 ppm1      0.611 ppm2      8.087
 ASSI (
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )(
   (( segid "    " and resid 1203 and name HN  ))
  OR 
   (( segid "    " and resid 1181 and name HN  ))
 )
      6.000     6.000     0.000 peak  8185 weight  0.10000E+01 volume  0.16400E+00 ppm1      0.610 ppm2      8.306
 ASSI (
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )(
   (( segid "    " and resid 1201 and name HN  ))
  OR 
   (( segid "    " and resid 1199 and name HN  ))
  OR 
   (( segid "    " and resid 1183 and name HN  ))
 )
      5.000     5.000     0.000 peak  8184 weight  0.10000E+01 volume  0.80800E+00 ppm1      0.609 ppm2      8.461
 ASSI (
   (( segid "    " and resid 1201 and name HA  ))
 )(
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
  OR 
   (( segid "    " and resid 1202 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
  OR 
   (( segid "    " and resid 1179 and name HG12))
 )
      5.000     5.000     0.000 peak  6378 weight  0.10000E+01 volume -0.51800E+00 ppm1      5.102 ppm2      1.040
 ASSI (
   (( segid "    " and resid 1201 and name HA  ))
 )(
   (( segid "    " and resid 1179 and name HB  ))
 )
      6.000     6.000     0.000 peak  6377 weight  0.10000E+01 volume -0.25700E+00 ppm1      5.102 ppm2      1.799
 ASSI (
   (( segid "    " and resid 1201 and name HA  ))
 )(
   (( segid "    " and resid 1205 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8147 weight  0.10000E+01 volume -0.27800E+00 ppm1      5.097 ppm2      3.199
 ASSI (
   (( segid "    " and resid 1201 and name HA  ))
 )(
   (( segid "    " and resid 1231 and name HA  ))
  OR 
   (( segid "    " and resid 1202 and name HA  ))
  OR 
   (( segid "    " and resid 1184 and name HA  ))
  OR 
   (( segid "    " and resid 1178 and name HA  ))
  OR 
   (( segid "    " and resid 1175 and name HA  ))
 )
      6.000     6.000     0.000 peak  6354 weight  0.10000E+01 volume -0.25800E+00 ppm1      5.103 ppm2      3.967
 ASSI (
   (( segid "    " and resid 1202 and name HA  ))
 )(
   (( segid "    " and resid 1202 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6761 weight  0.10000E+01 volume -0.10770E+01 ppm1      3.960 ppm2      1.048
 ASSI (
   (( segid "    " and resid 1202 and name HA  ))
 )(
   (( segid "    " and resid 1202 and name HG1 ))
  OR 
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6760 weight  0.10000E+01 volume -0.10990E+01 ppm1      3.960 ppm2      1.207
 ASSI (
   (( segid "    " and resid 1202 and name HA  ))
 )(
   (( segid "    " and resid 1202 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6762 weight  0.10000E+01 volume -0.25500E+00 ppm1      3.960 ppm2      1.365
 ASSI (
   (( segid "    " and resid 1202 and name HA  ))
 )(
   (( segid "    " and resid 1202 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6759 weight  0.10000E+01 volume -0.14290E+01 ppm1      3.962 ppm2      1.641
 ASSI (
   (( segid "    " and resid 1202 and name HA  ))
 )(
   (( segid "    " and resid 1231 and name HB1 ))
  OR 
   (( segid "    " and resid 1203 and name HG1 ))
  OR 
   (( segid "    " and resid 1203 and name HB2 ))
  OR 
   (( segid "    " and resid 1179 and name HB  ))
 )
      5.000     5.000     0.000 peak  6758 weight  0.10000E+01 volume -0.60700E+00 ppm1      3.963 ppm2      1.759
 ASSI (
   (( segid "    " and resid 1202 and name HA  ))
 )(
   (( segid "    " and resid 1203 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6757 weight  0.10000E+01 volume -0.52000E+00 ppm1      3.962 ppm2      1.869
 ASSI (
   (( segid "    " and resid 1202 and name HA  ))
 )(
   (( segid "    " and resid 1202 and name HE2 ))
  OR 
   (( segid "    " and resid 1202 and name HE1 ))
  OR 
   (( segid "    " and resid 1178 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6756 weight  0.10000E+01 volume -0.17700E+00 ppm1      3.963 ppm2      2.851
 ASSI (
   (( segid "    " and resid 1202 and name HA  ))
 )(
   (( segid "    " and resid 1203 and name HN  ))
 )
      2.700     2.700     0.000 peak  6754 weight  0.10000E+01 volume -0.38690E+01 ppm1      3.957 ppm2      8.298
 ASSI (
   (( segid "    " and resid 1202 and name HB1 ))
 )(
   (( segid "    " and resid 1202 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
 )
      3.300     3.300     0.000 peak  8135 weight  0.10000E+01 volume  0.27160E+01 ppm1      1.654 ppm2      1.057
 ASSI (
   (( segid "    " and resid 1202 and name HB1 ))
 )(
   (( segid "    " and resid 1202 and name HE2 ))
  OR 
   (( segid "    " and resid 1202 and name HE1 ))
 )
      6.000     6.000     0.000 peak  8142 weight  0.10000E+01 volume  0.37300E+00 ppm1      1.651 ppm2      2.885
 ASSI (
   (( segid "    " and resid 1202 and name HB1 ))
 )(
   (( segid "    " and resid 1205 and name HN  ))
  OR 
   (( segid "    " and resid 1203 and name HN  ))
 )
      5.000     5.000     0.000 peak  8141 weight  0.10000E+01 volume  0.54000E+00 ppm1      1.652 ppm2      8.301
 ASSI (
   (( segid "    " and resid 1202 and name HB2 ))
 )(
   (( segid "    " and resid 1202 and name HG1 ))
  OR 
   (( segid "    " and resid 1178 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8144 weight  0.10000E+01 volume  0.81200E+00 ppm1      1.058 ppm2      1.188
 ASSI (
   (( segid "    " and resid 1202 and name HB2 ))
 )(
   (( segid "    " and resid 1202 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8146 weight  0.10000E+01 volume  0.33000E+00 ppm1      1.063 ppm2      1.361
 ASSI (
   (( segid "    " and resid 1202 and name HB2 ))
 )(
   (( segid "    " and resid 1202 and name HB1 ))
 )
      3.300     3.300     0.000 peak  8134 weight  0.10000E+01 volume  0.18880E+01 ppm1      1.063 ppm2      1.651
 ASSI (
   (( segid "    " and resid 1202 and name HB2 ))
 )(
   (( segid "    " and resid 1202 and name HE2 ))
  OR 
   (( segid "    " and resid 1202 and name HE1 ))
  OR 
   (( segid "    " and resid 1178 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8143 weight  0.10000E+01 volume  0.18600E+00 ppm1      1.057 ppm2      2.843
 ASSI (
   (( segid "    " and resid 1202 and name HB2 ))
 )(
   (( segid "    " and resid 1205 and name HN  ))
  OR 
   (( segid "    " and resid 1203 and name HN  ))
 )
      6.000     6.000     0.000 peak  8140 weight  0.10000E+01 volume  0.29500E+00 ppm1      1.064 ppm2      8.297
 ASSI (
   (( segid "    " and resid 1202 and name HD1 ))
 )(
   (( segid "    " and resid 1202 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9588 weight  0.10000E+01 volume  0.12800E+01 ppm1      1.396 ppm2      1.038
 ASSI (
   (( segid "    " and resid 1202 and name HD1 ))
 )(
   (( segid "    " and resid 1202 and name HA  ))
  OR 
   (( segid "    " and resid 1178 and name HA  ))
 )
      5.000     5.000     0.000 peak  9594 weight  0.10000E+01 volume  0.43600E+00 ppm1      1.391 ppm2      3.938
 ASSI (
   (( segid "    " and resid 1202 and name HD2 ))
 )(
   (( segid "    " and resid 1202 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9589 weight  0.10000E+01 volume  0.10040E+01 ppm1      1.297 ppm2      1.037
 ASSI (
   (( segid "    " and resid 1202 and name HD2 ))
 )(
   (( segid "    " and resid 1202 and name HA  ))
  OR 
   (( segid "    " and resid 1178 and name HA  ))
 )
      6.000     6.000     0.000 peak  9595 weight  0.10000E+01 volume  0.28600E+00 ppm1      1.300 ppm2      3.938
 ASSI (
   (( segid "    " and resid 1202 and name HG1 ))
 )(
   (( segid "    " and resid 1202 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9360 weight  0.10000E+01 volume  0.11330E+01 ppm1      1.181 ppm2      1.660
 ASSI (
   (( segid "    " and resid 1202 and name HG2 ))
 )(
   (( segid "    " and resid 1202 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9359 weight  0.10000E+01 volume  0.13190E+01 ppm1      1.019 ppm2      1.655
 ASSI (
   (( segid "    " and resid 1203 and name HA  ))
 )(
   (( segid "    " and resid 1203 and name HG2 ))
 )
      5.000     5.000     0.000 peak  6753 weight  0.10000E+01 volume -0.76900E+00 ppm1      4.097 ppm2      1.617
 ASSI (
   (( segid "    " and resid 1203 and name HA  ))
 )(
   (( segid "    " and resid 1203 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6751 weight  0.10000E+01 volume -0.12820E+01 ppm1      4.096 ppm2      1.862
 ASSI (
   (( segid "    " and resid 1204 and name HA1 ))
 )(
   (( segid "    " and resid 1231 and name HB1 ))
  OR 
   (( segid "    " and resid 1203 and name HG1 ))
  OR 
   (( segid "    " and resid 1203 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6739 weight  0.10000E+01 volume -0.30600E+00 ppm1      4.231 ppm2      1.760
 ASSI (
   (( segid "    " and resid 1204 and name HA1 ))
 )(
   (( segid "    " and resid 1205 and name HE2 ))
  OR 
   (( segid "    " and resid 1205 and name HE1 ))
  OR 
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6735 weight  0.10000E+01 volume -0.32500E+00 ppm1      4.232 ppm2      6.668
 ASSI (
   (( segid "    " and resid 1204 and name HA2 ))
 )(
   (( segid "    " and resid 1205 and name HE2 ))
  OR 
   (( segid "    " and resid 1205 and name HE1 ))
  OR 
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6736 weight  0.10000E+01 volume -0.27100E+00 ppm1      3.611 ppm2      6.666
 ASSI (
   (( segid "    " and resid 1205 and name HB1 ))
 )(
   (( segid "    " and resid 1205 and name HN  ))
 )
      6.000     6.000     0.000 peak  8080 weight  0.10000E+01 volume  0.30800E+00 ppm1      3.203 ppm2      8.314
 ASSI (
   (( segid "    " and resid 1205 and name HB2 ))
 )(
   (( segid "    " and resid 1228 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7342 weight  0.10000E+01 volume  0.40400E+00 ppm1      2.676 ppm2      3.724
 ASSI (
   (( segid "    " and resid 1205 and name HB2 ))
 )(
   (( segid "    " and resid 1205 and name HA  ))
 )
      5.000     5.000     0.000 peak  8074 weight  0.10000E+01 volume  0.58700E+00 ppm1      2.668 ppm2      4.805
 ASSI (
   (( segid "    " and resid 1205 and name HB2 ))
 )(
   (( segid "    " and resid 1205 and name HN  ))
 )
      6.000     6.000     0.000 peak  8081 weight  0.10000E+01 volume  0.33400E+00 ppm1      2.678 ppm2      8.314
 ASSI (
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )(
   (( segid "    " and resid 1230 and name HB1 ))
  OR 
   (( segid "    " and resid 1206 and name HG1 ))
  OR 
   (( segid "    " and resid 1202 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8098 weight  0.10000E+01 volume -0.59600E+00 ppm1      6.656 ppm2      1.622
 ASSI (
   (( segid "    " and resid 1205 and name HE2 ))
  OR 
   (( segid "    " and resid 1205 and name HE1 ))
 )(
   (( segid "    " and resid 1230 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8105 weight  0.10000E+01 volume -0.77200E+00 ppm1      6.696 ppm2      1.060
 ASSI (
   (( segid "    " and resid 1205 and name HE2 ))
  OR 
   (( segid "    " and resid 1205 and name HE1 ))
 )(
   (( segid "    " and resid 1202 and name HG1 ))
  OR 
   (( segid "    " and resid 1178 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8104 weight  0.10000E+01 volume -0.53300E+00 ppm1      6.696 ppm2      1.191
 ASSI (
   (( segid "    " and resid 1205 and name HE2 ))
  OR 
   (( segid "    " and resid 1205 and name HE1 ))
 )(
   (( segid "    " and resid 1231 and name HG2 ))
  OR 
   (( segid "    " and resid 1231 and name HG1 ))
  OR 
   (( segid "    " and resid 1230 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
  OR 
   (( segid "    " and resid 1202 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7355 weight  0.10000E+01 volume -0.69900E+00 ppm1      6.695 ppm2      1.419
 ASSI (
   (( segid "    " and resid 1205 and name HE2 ))
  OR 
   (( segid "    " and resid 1205 and name HE1 ))
 )(
   (( segid "    " and resid 1230 and name HB1 ))
  OR 
   (( segid "    " and resid 1206 and name HG1 ))
  OR 
   (( segid "    " and resid 1202 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8103 weight  0.10000E+01 volume -0.53900E+00 ppm1      6.696 ppm2      1.627
 ASSI (
   (( segid "    " and resid 1205 and name HE2 ))
  OR 
   (( segid "    " and resid 1205 and name HE1 ))
 )(
   (( segid "    " and resid 1202 and name HE2 ))
  OR 
   (( segid "    " and resid 1202 and name HE1 ))
  OR 
   (( segid "    " and resid 1178 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8106 weight  0.10000E+01 volume -0.71000E+00 ppm1      6.695 ppm2      2.824
 ASSI (
   (( segid "    " and resid 1205 and name HE2 ))
  OR 
   (( segid "    " and resid 1205 and name HE1 ))
 )(
   (( segid "    " and resid 1229 and name HA  ))
  OR 
   (( segid "    " and resid 1206 and name HA  ))
 )
      6.000     6.000     0.000 peak  8107 weight  0.10000E+01 volume -0.14800E+00 ppm1      6.695 ppm2      4.969
 ASSI (
   (( segid "    " and resid 1205 and name HE2 ))
  OR 
   (( segid "    " and resid 1205 and name HE1 ))
 )(
   (( segid "    " and resid 1205 and name HN  ))
  OR 
   (( segid "    " and resid 1203 and name HN  ))
 )
      6.000     6.000     0.000 peak  8111 weight  0.10000E+01 volume -0.16100E+00 ppm1      6.698 ppm2      8.297
 ASSI (
   (( segid "    " and resid 1206 and name HA  ))
 )(
   (( segid "    " and resid 1206 and name HG2 ))
  OR 
   (( segid "    " and resid 1206 and name HG1 ))
 )
      5.000     5.000     0.000 peak  6474 weight  0.10000E+01 volume -0.79900E+00 ppm1      4.964 ppm2      1.596
 ASSI (
   (( segid "    " and resid 1206 and name HA  ))
 )(
   (( segid "    " and resid 1228 and name HB2 ))
  OR 
   (( segid "    " and resid 1205 and name HB2 ))
  OR 
   (( segid "    " and resid 1201 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6472 weight  0.10000E+01 volume -0.18800E+00 ppm1      4.964 ppm2      2.681
 ASSI (
   (( segid "    " and resid 1206 and name HA  ))
 )(
   (( segid "    " and resid 1206 and name HD2 ))
  OR 
   (( segid "    " and resid 1206 and name HD1 ))
  OR 
   (( segid "    " and resid 1205 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6471 weight  0.10000E+01 volume -0.38200E+00 ppm1      4.966 ppm2      3.171
 ASSI (
   (( segid "    " and resid 1206 and name HA  ))
 )(
   (( segid "    " and resid 1205 and name HA  ))
 )
      6.000     6.000     0.000 peak  6469 weight  0.10000E+01 volume -0.31200E+00 ppm1      4.963 ppm2      4.790
 ASSI (
   (( segid "    " and resid 1206 and name HB2 ))
  OR 
   (( segid "    " and resid 1206 and name HB1 ))
 )(
   (( segid "    " and resid 1206 and name HD2 ))
  OR 
   (( segid "    " and resid 1206 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8072 weight  0.10000E+01 volume  0.11080E+01 ppm1      1.828 ppm2      3.160
 ASSI (
   (( segid "    " and resid 1206 and name HG1 ))
 )(
   (( segid "    " and resid 1206 and name HB2 ))
  OR 
   (( segid "    " and resid 1206 and name HB1 ))
 )
      3.300     3.300     0.000 peak  9342 weight  0.10000E+01 volume  0.27100E+01 ppm1      1.615 ppm2      1.819
 ASSI (
   (( segid "    " and resid 1206 and name HG1 ))
 )(
   (( segid "    " and resid 1206 and name HD2 ))
  OR 
   (( segid "    " and resid 1206 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9338 weight  0.10000E+01 volume  0.15250E+01 ppm1      1.610 ppm2      3.162
 ASSI (
   (( segid "    " and resid 1206 and name HG1 ))
 )(
   (( segid "    " and resid 1229 and name HA  ))
  OR 
   (( segid "    " and resid 1206 and name HA  ))
 )
      5.000     5.000     0.000 peak  6476 weight  0.10000E+01 volume  0.44200E+00 ppm1      1.616 ppm2      4.965
 ASSI (
   (( segid "    " and resid 1206 and name HG2 ))
 )(
   (( segid "    " and resid 1206 and name HB2 ))
  OR 
   (( segid "    " and resid 1206 and name HB1 ))
 )
      3.300     3.300     0.000 peak  9343 weight  0.10000E+01 volume  0.25260E+01 ppm1      1.566 ppm2      1.818
 ASSI (
   (( segid "    " and resid 1206 and name HG2 ))
 )(
   (( segid "    " and resid 1206 and name HD2 ))
  OR 
   (( segid "    " and resid 1206 and name HD1 ))
 )
      3.300     3.300     0.000 peak  8024 weight  0.10000E+01 volume  0.17140E+01 ppm1      1.564 ppm2      3.162
 ASSI (
   (( segid "    " and resid 1206 and name HG2 ))
 )(
   (( segid "    " and resid 1229 and name HA  ))
  OR 
   (( segid "    " and resid 1206 and name HA  ))
 )
      5.000     5.000     0.000 peak  9339 weight  0.10000E+01 volume  0.54000E+00 ppm1      1.574 ppm2      4.965
 ASSI (
   (( segid "    " and resid 1207 and name HA  ))
 )(
   (( segid "    " and resid 1227 and name HG23))
  OR 
   (( segid "    " and resid 1227 and name HG22))
  OR 
   (( segid "    " and resid 1227 and name HG21))
  OR 
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
  OR 
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )
      6.000     6.000     0.000 peak  6730 weight  0.10000E+01 volume -0.17600E+00 ppm1      4.415 ppm2      0.699
 ASSI (
   (( segid "    " and resid 1207 and name HB1 ))
 )(
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
 )
      5.000     5.000     0.000 peak  8035 weight  0.10000E+01 volume  0.42100E+00 ppm1      1.797 ppm2      1.113
 ASSI (
   (( segid "    " and resid 1207 and name HB1 ))
 )(
   (( segid "    " and resid 1207 and name HB2 ))
 )
      3.300     3.300     0.000 peak  8029 weight  0.10000E+01 volume  0.29700E+01 ppm1      1.791 ppm2      1.466
 ASSI (
   (( segid "    " and resid 1207 and name HB1 ))
 )(
   (( segid "    " and resid 1207 and name HA  ))
 )
      5.000     5.000     0.000 peak  8027 weight  0.10000E+01 volume  0.55800E+00 ppm1      1.795 ppm2      4.415
 ASSI (
   (( segid "    " and resid 1207 and name HB1 ))
 )(
   (( segid "    " and resid 1207 and name HN  ))
 )
      5.000     5.000     0.000 peak  8030 weight  0.10000E+01 volume  0.12000E+01 ppm1      1.791 ppm2      8.765
 ASSI (
   (( segid "    " and resid 1207 and name HB2 ))
 )(
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
 )
      6.000     6.000     0.000 peak  8034 weight  0.10000E+01 volume  0.28100E+00 ppm1      1.462 ppm2      1.090
 ASSI (
   (( segid "    " and resid 1207 and name HB2 ))
 )(
   (( segid "    " and resid 1207 and name HG  ))
  OR 
   (( segid "    " and resid 1207 and name HB1 ))
 )
      2.700     2.700     0.000 peak  8028 weight  0.10000E+01 volume  0.48640E+01 ppm1      1.464 ppm2      1.790
 ASSI (
   (( segid "    " and resid 1207 and name HB2 ))
 )(
   (( segid "    " and resid 1207 and name HA  ))
 )
      5.000     5.000     0.000 peak  8026 weight  0.10000E+01 volume  0.59300E+00 ppm1      1.463 ppm2      4.413
 ASSI (
   (( segid "    " and resid 1207 and name HD13))
  OR 
   (( segid "    " and resid 1207 and name HD12))
  OR 
   (( segid "    " and resid 1207 and name HD11))
 )(
   (( segid "    " and resid 1213 and name HA  ))
  OR 
   (( segid "    " and resid 1207 and name HA  ))
 )
      5.000     5.000     0.000 peak  6690 weight  0.10000E+01 volume  0.43300E+00 ppm1      0.858 ppm2      4.415
 ASSI (
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1200 and name HB  ))
 )
      6.000     6.000     0.000 peak  7426 weight  0.10000E+01 volume  0.34000E+00 ppm1      0.948 ppm2      2.082
 ASSI (
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )(
   (( segid "    " and resid 1225 and name HA  ))
  OR 
   (( segid "    " and resid 1214 and name HA  ))
 )
      6.000     6.000     0.000 peak  7428 weight  0.10000E+01 volume  0.24900E+00 ppm1      0.947 ppm2      4.172
 ASSI (
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )(
   (( segid "    " and resid 1213 and name HA  ))
  OR 
   (( segid "    " and resid 1207 and name HA  ))
 )
      3.300     3.300     0.000 peak  6692 weight  0.10000E+01 volume  0.23970E+01 ppm1      0.944 ppm2      4.413
 ASSI (
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )(
   (( segid "    " and resid 1228 and name HA  ))
 )
      6.000     6.000     0.000 peak  7425 weight  0.10000E+01 volume  0.14900E+00 ppm1      0.948 ppm2      5.540
 ASSI (
   (( segid "    " and resid 1208 and name HA  ))
 )(
   (( segid "    " and resid 1211 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8006 weight  0.10000E+01 volume -0.33200E+00 ppm1      4.466 ppm2      3.809
 ASSI (
   (( segid "    " and resid 1208 and name HA  ))
 )(
   (( segid "    " and resid 1209 and name HB2 ))
  OR 
   (( segid "    " and resid 1208 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6979 weight  0.10000E+01 volume -0.20050E+01 ppm1      4.474 ppm2      3.924
 ASSI (
   (( segid "    " and resid 1208 and name HA  ))
 )(
   (( segid "    " and resid 1208 and name HN  ))
 )
      5.000     5.000     0.000 peak  6981 weight  0.10000E+01 volume -0.48500E+00 ppm1      4.473 ppm2      8.921
 ASSI (
   (( segid "    " and resid 1208 and name HB1 ))
 )(
   (( segid "    " and resid 1208 and name HN  ))
 )
      5.000     5.000     0.000 peak  8008 weight  0.10000E+01 volume -0.69900E+00 ppm1      3.920 ppm2      8.925
 ASSI (
   (( segid "    " and resid 1208 and name HB2 ))
 )(
   (( segid "    " and resid 1208 and name HN  ))
 )
      5.000     5.000     0.000 peak  8009 weight  0.10000E+01 volume -0.83700E+00 ppm1      3.677 ppm2      8.916
 ASSI (
   (( segid "    " and resid 1209 and name HA  ))
 )(
   (( segid "    " and resid 1209 and name HB2 ))
  OR 
   (( segid "    " and resid 1209 and name HB1 ))
 )
      2.700     2.700     0.000 peak  6722 weight  0.10000E+01 volume -0.44480E+01 ppm1      4.272 ppm2      3.934
 ASSI (
   (( segid "    " and resid 1209 and name HA  ))
 )(
   (( segid "    " and resid 1211 and name HN  ))
 )
      6.000     6.000     0.000 peak  6719 weight  0.10000E+01 volume -0.18100E+00 ppm1      4.274 ppm2      7.590
 ASSI (
   (( segid "    " and resid 1209 and name HB1 ))
 )(
   (( segid "    " and resid 1208 and name HA  ))
 )
      5.000     5.000     0.000 peak  7999 weight  0.10000E+01 volume -0.51300E+00 ppm1      3.980 ppm2      4.493
 ASSI (
   (( segid "    " and resid 1209 and name HB2 ))
 )(
   (( segid "    " and resid 1208 and name HA  ))
 )
      5.000     5.000     0.000 peak  8000 weight  0.10000E+01 volume -0.50600E+00 ppm1      3.938 ppm2      4.488
 ASSI (
   (( segid "    " and resid 1210 and name HA  ))
 )(
   (( segid "    " and resid 1210 and name HB1 ))
 )
      3.300     3.300     0.000 peak  7969 weight  0.10000E+01 volume -0.23870E+01 ppm1      4.285 ppm2      1.937
 ASSI (
   (( segid "    " and resid 1210 and name HB1 ))
 )(
   (( segid "    " and resid 1210 and name HB2 ))
 )
      2.700     2.700     0.000 peak  7991 weight  0.10000E+01 volume  0.56800E+01 ppm1      1.934 ppm2      1.703
 ASSI (
   (( segid "    " and resid 1211 and name HA  ))
 )(
   (( segid "    " and resid 1211 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7951 weight  0.10000E+01 volume -0.10030E+01 ppm1      4.350 ppm2      3.783
 ASSI (
   (( segid "    " and resid 1211 and name HA  ))
 )(
   (( segid "    " and resid 1211 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7952 weight  0.10000E+01 volume -0.12360E+01 ppm1      4.350 ppm2      3.952
 ASSI (
   (( segid "    " and resid 1211 and name HA  ))
 )(
   (( segid "    " and resid 1211 and name HN  ))
 )
      5.000     5.000     0.000 peak  7950 weight  0.10000E+01 volume -0.60500E+00 ppm1      4.351 ppm2      7.590
 ASSI (
   (( segid "    " and resid 1211 and name HB1 ))
 )(
   (( segid "    " and resid 1207 and name HD13))
  OR 
   (( segid "    " and resid 1207 and name HD12))
  OR 
   (( segid "    " and resid 1207 and name HD11))
 )
      5.000     5.000     0.000 peak  7962 weight  0.10000E+01 volume -0.67200E+00 ppm1      3.943 ppm2      0.850
 ASSI (
   (( segid "    " and resid 1211 and name HB1 ))
 )(
   (( segid "    " and resid 1207 and name HG  ))
  OR 
   (( segid "    " and resid 1207 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7957 weight  0.10000E+01 volume -0.48900E+00 ppm1      3.940 ppm2      1.791
 ASSI (
   (( segid "    " and resid 1211 and name HB1 ))
 )(
   (( segid "    " and resid 1211 and name HN  ))
 )
      6.000     6.000     0.000 peak  7965 weight  0.10000E+01 volume -0.35600E+00 ppm1      3.943 ppm2      7.589
 ASSI (
   (( segid "    " and resid 1211 and name HB2 ))
 )(
   (( segid "    " and resid 1207 and name HD13))
  OR 
   (( segid "    " and resid 1207 and name HD12))
  OR 
   (( segid "    " and resid 1207 and name HD11))
 )
      5.000     5.000     0.000 peak  7964 weight  0.10000E+01 volume -0.46400E+00 ppm1      3.782 ppm2      0.850
 ASSI (
   (( segid "    " and resid 1211 and name HB2 ))
 )(
   (( segid "    " and resid 1207 and name HG  ))
  OR 
   (( segid "    " and resid 1207 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7956 weight  0.10000E+01 volume -0.61200E+00 ppm1      3.784 ppm2      1.792
 ASSI (
   (( segid "    " and resid 1211 and name HB2 ))
 )(
   (( segid "    " and resid 1226 and name HA  ))
  OR 
   (( segid "    " and resid 1208 and name HA  ))
 )
      5.000     5.000     0.000 peak  7961 weight  0.10000E+01 volume -0.69400E+00 ppm1      3.785 ppm2      4.475
 ASSI (
   (( segid "    " and resid 1211 and name HB2 ))
 )(
   (( segid "    " and resid 1211 and name HN  ))
 )
      5.000     5.000     0.000 peak  7966 weight  0.10000E+01 volume -0.61200E+00 ppm1      3.786 ppm2      7.594
 ASSI (
   (( segid "    " and resid 1211 and name HB2 ))
 )(
   (( segid "    " and resid 1227 and name HN  ))
 )
      6.000     6.000     0.000 peak  7967 weight  0.10000E+01 volume -0.28500E+00 ppm1      3.784 ppm2      7.923
 ASSI (
   (( segid "    " and resid 1212 and name HB1 ))
 )(
   (( segid "    " and resid 1212 and name HB2 ))
 )
      3.300     3.300     0.000 peak  7944 weight  0.10000E+01 volume  0.26640E+01 ppm1      3.207 ppm2      3.071
 ASSI (
   (( segid "    " and resid 1212 and name HB1 ))
 )(
   (( segid "    " and resid 1212 and name HA  ))
 )
      5.000     5.000     0.000 peak  2434 weight  0.10000E+01 volume  0.76400E+00 ppm1      3.207 ppm2      4.624
 ASSI (
   (( segid "    " and resid 1212 and name HB2 ))
 )(
   (( segid "    " and resid 1212 and name HA  ))
 )
      5.000     5.000     0.000 peak  6625 weight  0.10000E+01 volume  0.74600E+00 ppm1      3.076 ppm2      4.628
 ASSI (
   (( segid "    " and resid 1212 and name HD2 ))
 )(
   (( segid "    " and resid 1226 and name HB2 ))
  OR 
   (( segid "    " and resid 1224 and name HB2 ))
  OR 
   (( segid "    " and resid 1224 and name HB1 ))
  OR 
   (( segid "    " and resid 1210 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7514 weight  0.10000E+01 volume -0.48100E+00 ppm1      7.350 ppm2      1.675
 ASSI (
   (( segid "    " and resid 1212 and name HD2 ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1224 and name HG2 ))
 )
      6.000     6.000     0.000 peak  7625 weight  0.10000E+01 volume -0.18000E+00 ppm1      7.351 ppm2      2.061
 ASSI (
   (( segid "    " and resid 1212 and name HD2 ))
 )(
   (( segid "    " and resid 1212 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7622 weight  0.10000E+01 volume -0.21400E+00 ppm1      7.355 ppm2      3.076
 ASSI (
   (( segid "    " and resid 1212 and name HD2 ))
 )(
   (( segid "    " and resid 1212 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7623 weight  0.10000E+01 volume -0.50700E+00 ppm1      7.355 ppm2      3.211
 ASSI (
   (( segid "    " and resid 1213 and name HA  ))
 )(
   (( segid "    " and resid 1225 and name HA  ))
  OR 
   (( segid "    " and resid 1214 and name HA  ))
 )
      5.000     5.000     0.000 peak  7927 weight  0.10000E+01 volume -0.40300E+00 ppm1      4.419 ppm2      4.159
 ASSI (
   (( segid "    " and resid 1213 and name HB  ))
 )(
   (( segid "    " and resid 1207 and name HD13))
  OR 
   (( segid "    " and resid 1207 and name HD12))
  OR 
   (( segid "    " and resid 1207 and name HD11))
 )
      6.000     6.000     0.000 peak  7929 weight  0.10000E+01 volume -0.22300E+00 ppm1      4.483 ppm2      0.871
 ASSI (
   (( segid "    " and resid 1213 and name HB  ))
 )(
   (( segid "    " and resid 1226 and name HG2 ))
  OR 
   (( segid "    " and resid 1226 and name HB2 ))
  OR 
   (( segid "    " and resid 1224 and name HB2 ))
  OR 
   (( segid "    " and resid 1224 and name HB1 ))
  OR 
   (( segid "    " and resid 1215 and name HB2 ))
  OR 
   (( segid "    " and resid 1214 and name HG  ))
  OR 
   (( segid "    " and resid 1214 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7931 weight  0.10000E+01 volume -0.25600E+00 ppm1      4.484 ppm2      1.652
 ASSI (
   (( segid "    " and resid 1213 and name HG23))
  OR 
   (( segid "    " and resid 1213 and name HG22))
  OR 
   (( segid "    " and resid 1213 and name HG21))
 )(
   (( segid "    " and resid 1213 and name HB  ))
 )
      2.700     2.700     0.000 peak  6683 weight  0.10000E+01 volume  0.45220E+01 ppm1      1.236 ppm2      4.478
 ASSI (
   (( segid "    " and resid 1214 and name HA  ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7891 weight  0.10000E+01 volume -0.53000E+00 ppm1      4.196 ppm2      2.100
 ASSI (
   (( segid "    " and resid 1214 and name HA  ))
 )(
   (( segid "    " and resid 1224 and name HG1 ))
  OR 
   (( segid "    " and resid 1198 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7892 weight  0.10000E+01 volume -0.47100E+00 ppm1      4.197 ppm2      2.166
 ASSI (
   (( segid "    " and resid 1214 and name HA  ))
 )(
   (( segid "    " and resid 1214 and name HN  ))
 )
      5.000     5.000     0.000 peak  7504 weight  0.10000E+01 volume -0.58800E+00 ppm1      4.201 ppm2      8.366
 ASSI (
   (( segid "    " and resid 1214 and name HB1 ))
 )(
   (( segid "    " and resid 1214 and name HG  ))
  OR 
   (( segid "    " and resid 1214 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7896 weight  0.10000E+01 volume  0.14020E+01 ppm1      2.251 ppm2      1.673
 ASSI (
   (( segid "    " and resid 1214 and name HB1 ))
 )(
   (( segid "    " and resid 1214 and name HA  ))
 )
      6.000     6.000     0.000 peak  7901 weight  0.10000E+01 volume  0.23100E+00 ppm1      2.239 ppm2      4.170
 ASSI (
   (( segid "    " and resid 1214 and name HB1 ))
 )(
   (( segid "    " and resid 1201 and name HN  ))
  OR 
   (( segid "    " and resid 1199 and name HN  ))
 )
      6.000     6.000     0.000 peak  7900 weight  0.10000E+01 volume  0.25300E+00 ppm1      2.242 ppm2      8.459
 ASSI (
   (( segid "    " and resid 1214 and name HB2 ))
 )(
   (( segid "    " and resid 1214 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7895 weight  0.10000E+01 volume  0.11250E+01 ppm1      1.664 ppm2      2.248
 ASSI (
   (( segid "    " and resid 1214 and name HB2 ))
 )(
   (( segid "    " and resid 1214 and name HA  ))
 )
      6.000     6.000     0.000 peak  7904 weight  0.10000E+01 volume  0.20700E+00 ppm1      1.673 ppm2      4.176
 ASSI (
   (( segid "    " and resid 1214 and name HB2 ))
 )(
   (( segid "    " and resid 1214 and name HN  ))
  OR 
   (( segid "    " and resid 1199 and name HN  ))
 )
      5.000     5.000     0.000 peak  7905 weight  0.10000E+01 volume  0.43500E+00 ppm1      1.667 ppm2      8.392
 ASSI (
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
 )(
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )
      2.700     2.700     0.000 peak  7919 weight  0.10000E+01 volume  0.41980E+01 ppm1      1.084 ppm2      0.683
 ASSI (
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
 )(
   (( segid "    " and resid 1214 and name HG  ))
  OR 
   (( segid "    " and resid 1214 and name HB2 ))
 )
      2.700     2.700     0.000 peak  7918 weight  0.10000E+01 volume  0.58170E+01 ppm1      1.083 ppm2      1.686
 ASSI (
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1200 and name HB  ))
 )
      5.000     5.000     0.000 peak  7917 weight  0.10000E+01 volume  0.74800E+00 ppm1      1.083 ppm2      2.108
 ASSI (
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
 )(
   (( segid "    " and resid 1226 and name HB1 ))
  OR 
   (( segid "    " and resid 1214 and name HB1 ))
 )
      3.300     3.300     0.000 peak  7916 weight  0.10000E+01 volume  0.24040E+01 ppm1      1.081 ppm2      2.250
 ASSI (
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
 )(
   (( segid "    " and resid 1214 and name HA  ))
 )
      6.000     6.000     0.000 peak  7920 weight  0.10000E+01 volume  0.37100E+00 ppm1      1.081 ppm2      4.167
 ASSI (
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
 )(
   (( segid "    " and resid 1227 and name HA  ))
  OR 
   (( segid "    " and resid 1212 and name HA  ))
  OR 
   (( segid "    " and resid 1200 and name HA  ))
 )
      5.000     5.000     0.000 peak  6797 weight  0.10000E+01 volume  0.11050E+01 ppm1      1.079 ppm2      4.583
 ASSI (
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
 )(
   (( segid "    " and resid 1201 and name HN  ))
  OR 
   (( segid "    " and resid 1199 and name HN  ))
 )
      5.000     5.000     0.000 peak  7921 weight  0.10000E+01 volume  0.85100E+00 ppm1      1.082 ppm2      8.457
 ASSI (
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )(
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )
      3.300     3.300     0.000 peak  7909 weight  0.10000E+01 volume  0.17730E+01 ppm1      0.682 ppm2      0.955
 ASSI (
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )(
   (( segid "    " and resid 1226 and name HG2 ))
  OR 
   (( segid "    " and resid 1214 and name HG  ))
  OR 
   (( segid "    " and resid 1214 and name HB2 ))
 )
      2.700     2.700     0.000 peak  7907 weight  0.10000E+01 volume  0.42740E+01 ppm1      0.683 ppm2      1.686
 ASSI (
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1200 and name HB  ))
 )
      5.000     5.000     0.000 peak  7906 weight  0.10000E+01 volume  0.11060E+01 ppm1      0.682 ppm2      2.090
 ASSI (
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )(
   (( segid "    " and resid 1226 and name HB1 ))
  OR 
   (( segid "    " and resid 1214 and name HB1 ))
 )
      3.300     3.300     0.000 peak  7429 weight  0.10000E+01 volume  0.20000E+01 ppm1      0.683 ppm2      2.253
 ASSI (
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )(
   (( segid "    " and resid 1199 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7910 weight  0.10000E+01 volume  0.44100E+00 ppm1      0.683 ppm2      2.912
 ASSI (
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )(
   (( segid "    " and resid 1214 and name HA  ))
 )
      3.300     3.300     0.000 peak  7446 weight  0.10000E+01 volume  0.18930E+01 ppm1      0.681 ppm2      4.167
 ASSI (
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )(
   (( segid "    " and resid 1200 and name HA  ))
 )
      5.000     5.000     0.000 peak  7912 weight  0.10000E+01 volume  0.82500E+00 ppm1      0.687 ppm2      4.585
 ASSI (
   (( segid "    " and resid 1215 and name HA  ))
 )(
   (( segid "    " and resid 1198 and name HG1 ))
 )
      6.000     6.000     0.000 peak  3176 weight  0.10000E+01 volume -0.17200E+00 ppm1      5.268 ppm2      2.182
 ASSI (
   (( segid "    " and resid 1215 and name HA  ))
 )(
   (( segid "    " and resid 1215 and name HD2 ))
  OR 
   (( segid "    " and resid 1215 and name HD1 ))
  OR 
   (( segid "    " and resid 1199 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6298 weight  0.10000E+01 volume -0.21400E+00 ppm1      5.273 ppm2      3.172
 ASSI (
   (( segid "    " and resid 1216 and name HB  ))
 )(
   (( segid "    " and resid 1224 and name HB2 ))
  OR 
   (( segid "    " and resid 1224 and name HB1 ))
  OR 
   (( segid "    " and resid 1215 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7870 weight  0.10000E+01 volume -0.25300E+00 ppm1      4.067 ppm2      1.683
 ASSI (
   (( segid "    " and resid 1216 and name HB  ))
 )(
   (( segid "    " and resid 1226 and name HA  ))
  OR 
   (( segid "    " and resid 1223 and name HA  ))
  OR 
   (( segid "    " and resid 1213 and name HB  ))
 )
      6.000     6.000     0.000 peak  7869 weight  0.10000E+01 volume -0.16600E+00 ppm1      4.079 ppm2      4.495
 ASSI (
   (( segid "    " and resid 1216 and name HB  ))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HD2 ))
 )
      6.000     6.000     0.000 peak  7868 weight  0.10000E+01 volume -0.12000E+00 ppm1      4.067 ppm2      7.149
 ASSI (
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )(
   (( segid "    " and resid 1197 and name HB  ))
 )
      3.300     3.300     0.000 peak  8224 weight  0.10000E+01 volume  0.17720E+01 ppm1      1.138 ppm2      1.539
 ASSI (
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1224 and name HG2 ))
  OR 
   (( segid "    " and resid 1198 and name HG2 ))
 )
      5.000     5.000     0.000 peak  7877 weight  0.10000E+01 volume  0.49900E+00 ppm1      1.135 ppm2      2.074
 ASSI (
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )(
   (( segid "    " and resid 1216 and name HA  ))
 )
      5.000     5.000     0.000 peak  6510 weight  0.10000E+01 volume  0.99000E+00 ppm1      1.138 ppm2      4.875
 ASSI (
   (( segid "    " and resid 1217 and name HA  ))
 )(
   (( segid "    " and resid 1219 and name HB2 ))
  OR 
   (( segid "    " and resid 1218 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6534 weight  0.10000E+01 volume -0.27300E+00 ppm1      4.802 ppm2      3.103
 ASSI (
   (( segid "    " and resid 1217 and name HB  ))
 )(
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
 )
      2.700     2.700     0.000 peak  7863 weight  0.10000E+01 volume -0.33720E+01 ppm1      3.885 ppm2      1.055
 ASSI (
   (( segid "    " and resid 1217 and name HB  ))
 )(
   (( segid "    " and resid 1216 and name HB  ))
  OR 
   (( segid "    " and resid 1197 and name HA  ))
 )
      6.000     6.000     0.000 peak  7862 weight  0.10000E+01 volume -0.32600E+00 ppm1      3.886 ppm2      4.076
 ASSI (
   (( segid "    " and resid 1218 and name HB1 ))
 )(
   (( segid "    " and resid 1218 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7580 weight  0.10000E+01 volume  0.10430E+01 ppm1      3.088 ppm2      2.816
 ASSI (
   (( segid "    " and resid 1218 and name HB1 ))
 )(
   (( segid "    " and resid 1219 and name HA  ))
  OR 
   (( segid "    " and resid 1218 and name HA  ))
 )
      6.000     6.000     0.000 peak  7581 weight  0.10000E+01 volume  0.31900E+00 ppm1      3.089 ppm2      4.627
 ASSI (
   (( segid "    " and resid 1218 and name HB1 ))
 )(
   (( segid "    " and resid 1218 and name HN  ))
 )
      5.000     5.000     0.000 peak  7583 weight  0.10000E+01 volume  0.43100E+00 ppm1      3.088 ppm2      8.299
 ASSI (
   (( segid "    " and resid 1218 and name HB2 ))
 )(
   (( segid "    " and resid 1219 and name HA  ))
  OR 
   (( segid "    " and resid 1218 and name HA  ))
 )
      5.000     5.000     0.000 peak  7594 weight  0.10000E+01 volume  0.47700E+00 ppm1      2.824 ppm2      4.626
 ASSI (
   (( segid "    " and resid 1218 and name HB2 ))
 )(
   (( segid "    " and resid 1218 and name HN  ))
 )
      5.000     5.000     0.000 peak  7590 weight  0.10000E+01 volume  0.43900E+00 ppm1      2.822 ppm2      8.299
 ASSI (
   (( segid "    " and resid 1219 and name HB1 ))
 )(
   (( segid "    " and resid 1219 and name HB2 ))
 )
      2.700     2.700     0.000 peak  7598 weight  0.10000E+01 volume  0.35990E+01 ppm1      3.372 ppm2      3.057
 ASSI (
   (( segid "    " and resid 1219 and name HB1 ))
 )(
   (( segid "    " and resid 1219 and name HE3 ))
 )
      5.000     5.000     0.000 peak  7604 weight  0.10000E+01 volume  0.41700E+00 ppm1      3.373 ppm2      7.594
 ASSI (
   (( segid "    " and resid 1219 and name HB1 ))
 )(
   (( segid "    " and resid 1220 and name HN  ))
  OR 
   (( segid "    " and resid 1219 and name HN  ))
 )
      6.000     6.000     0.000 peak  7606 weight  0.10000E+01 volume  0.38700E+00 ppm1      3.374 ppm2      8.951
 ASSI (
   (( segid "    " and resid 1219 and name HB2 ))
 )(
   (( segid "    " and resid 1219 and name HA  ))
  OR 
   (( segid "    " and resid 1218 and name HA  ))
 )
      6.000     6.000     0.000 peak  3000 weight  0.10000E+01 volume  0.37600E+00 ppm1      3.071 ppm2      4.641
 ASSI (
   (( segid "    " and resid 1219 and name HB2 ))
 )(
   (( segid "    " and resid 1219 and name HE3 ))
 )
      6.000     6.000     0.000 peak  7605 weight  0.10000E+01 volume  0.21600E+00 ppm1      3.075 ppm2      7.592
 ASSI (
   (( segid "    " and resid 1219 and name HB2 ))
 )(
   (( segid "    " and resid 1219 and name HN  ))
 )
      6.000     6.000     0.000 peak  7607 weight  0.10000E+01 volume  0.15700E+00 ppm1      3.076 ppm2      8.952
 ASSI (
   (( segid "    " and resid 1219 and name HZ2 ))
 )(
   (( segid "    " and resid 1219 and name HH2 ))
 )
      5.000     5.000     0.000 peak  7181 weight  0.10000E+01 volume  0.95000E+00 ppm1      7.413 ppm2      7.142
 ASSI (
   (( segid "    " and resid 1220 and name HB1 ))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
 )
      5.000     5.000     0.000 peak  7579 weight  0.10000E+01 volume  0.41500E+00 ppm1      3.094 ppm2      0.657
 ASSI (
   (( segid "    " and resid 1220 and name HB1 ))
 )(
   (( segid "    " and resid 1219 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7582 weight  0.10000E+01 volume  0.16600E+00 ppm1      3.089 ppm2      7.173
 ASSI (
   (( segid "    " and resid 1220 and name HB2 ))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
 )
      5.000     5.000     0.000 peak  7584 weight  0.10000E+01 volume  0.69300E+00 ppm1      1.767 ppm2      0.659
 ASSI (
   (( segid "    " and resid 1220 and name HB2 ))
 )(
   (( segid "    " and resid 1220 and name HB1 ))
 )
      3.300     3.300     0.000 peak  7576 weight  0.10000E+01 volume  0.18380E+01 ppm1      1.766 ppm2      3.116
 ASSI (
   (( segid "    " and resid 1221 and name HA1 ))
 )(
   (( segid "    " and resid 1222 and name HA  ))
  OR 
   (( segid "    " and resid 1220 and name HA  ))
 )
      6.000     6.000     0.000 peak  7565 weight  0.10000E+01 volume -0.32900E+00 ppm1      4.055 ppm2      4.493
 ASSI (
   (( segid "    " and resid 1221 and name HA1 ))
 )(
   (( segid "    " and resid 1219 and name HA  ))
  OR 
   (( segid "    " and resid 1218 and name HA  ))
 )
      6.000     6.000     0.000 peak  7566 weight  0.10000E+01 volume -0.21300E+00 ppm1      4.055 ppm2      4.632
 ASSI (
   (( segid "    " and resid 1222 and name HA  ))
 )(
   (( segid "    " and resid 1222 and name HG2 ))
 )
      5.000     5.000     0.000 peak  7539 weight  0.10000E+01 volume -0.64000E+00 ppm1      4.493 ppm2      1.367
 ASSI (
   (( segid "    " and resid 1222 and name HA  ))
 )(
   (( segid "    " and resid 1222 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7546 weight  0.10000E+01 volume -0.49000E+00 ppm1      4.489 ppm2      1.424
 ASSI (
   (( segid "    " and resid 1222 and name HA  ))
 )(
   (( segid "    " and resid 1222 and name HD2 ))
  OR 
   (( segid "    " and resid 1222 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7538 weight  0.10000E+01 volume -0.11060E+01 ppm1      4.493 ppm2      1.741
 ASSI (
   (( segid "    " and resid 1222 and name HA  ))
 )(
   (( segid "    " and resid 1169 and name HA  ))
 )
      6.000     6.000     0.000 peak  7541 weight  0.10000E+01 volume -0.25100E+00 ppm1      4.493 ppm2      4.121
 ASSI (
   (( segid "    " and resid 1222 and name HG1 ))
 )(
   (( segid "    " and resid 1223 and name HA  ))
  OR 
   (( segid "    " and resid 1222 and name HA  ))
 )
      5.000     5.000     0.000 peak  7544 weight  0.10000E+01 volume  0.46900E+00 ppm1      1.428 ppm2      4.487
 ASSI (
   (( segid "    " and resid 1223 and name HA  ))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )
      5.000     5.000     0.000 peak  6658 weight  0.10000E+01 volume -0.44300E+00 ppm1      4.480 ppm2      0.407
 ASSI (
   (( segid "    " and resid 1223 and name HA  ))
 )(
   (( segid "    " and resid 1223 and name HG  ))
 )
      5.000     5.000     0.000 peak  6662 weight  0.10000E+01 volume -0.42400E+00 ppm1      4.481 ppm2      1.059
 ASSI (
   (( segid "    " and resid 1223 and name HA  ))
 )(
   (( segid "    " and resid 1223 and name HB2 ))
  OR 
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )
      5.000     5.000     0.000 peak  6660 weight  0.10000E+01 volume -0.72300E+00 ppm1      4.483 ppm2      1.158
 ASSI (
   (( segid "    " and resid 1223 and name HA  ))
 )(
   (( segid "    " and resid 1223 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6661 weight  0.10000E+01 volume -0.40200E+00 ppm1      4.480 ppm2      1.246
 ASSI (
   (( segid "    " and resid 1223 and name HA  ))
 )(
   (( segid "    " and resid 1224 and name HB2 ))
  OR 
   (( segid "    " and resid 1224 and name HB1 ))
  OR 
   (( segid "    " and resid 1169 and name HB  ))
 )
      5.000     5.000     0.000 peak  7520 weight  0.10000E+01 volume -0.43000E+00 ppm1      4.482 ppm2      1.687
 ASSI (
   (( segid "    " and resid 1223 and name HA  ))
 )(
   (( segid "    " and resid 1222 and name HN  ))
 )
      6.000     6.000     0.000 peak  7519 weight  0.10000E+01 volume -0.14500E+00 ppm1      4.482 ppm2      7.796
 ASSI (
   (( segid "    " and resid 1223 and name HB1 ))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )
      5.000     5.000     0.000 peak  7521 weight  0.10000E+01 volume -0.85200E+00 ppm1      1.223 ppm2      0.408
 ASSI (
   (( segid "    " and resid 1223 and name HB1 ))
 )(
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )
      5.000     5.000     0.000 peak  7522 weight  0.10000E+01 volume -0.67300E+00 ppm1      1.222 ppm2      0.530
 ASSI (
   (( segid "    " and resid 1223 and name HB1 ))
 )(
   (( segid "    " and resid 1223 and name HG  ))
 )
      5.000     5.000     0.000 peak  7536 weight  0.10000E+01 volume -0.15030E+01 ppm1      1.222 ppm2      1.031
 ASSI (
   (( segid "    " and resid 1223 and name HB1 ))
 )(
   (( segid "    " and resid 1219 and name HA  ))
  OR 
   (( segid "    " and resid 1218 and name HA  ))
 )
      6.000     6.000     0.000 peak  7530 weight  0.10000E+01 volume -0.20900E+00 ppm1      1.222 ppm2      4.628
 ASSI (
   (( segid "    " and resid 1223 and name HB1 ))
 )(
   (( segid "    " and resid 1224 and name HN  ))
  OR 
   (( segid "    " and resid 1217 and name HN  ))
 )
      6.000     6.000     0.000 peak  7533 weight  0.10000E+01 volume -0.27800E+00 ppm1      1.221 ppm2      8.290
 ASSI (
   (( segid "    " and resid 1223 and name HB2 ))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )
      5.000     5.000     0.000 peak  7523 weight  0.10000E+01 volume -0.77200E+00 ppm1      1.135 ppm2      0.407
 ASSI (
   (( segid "    " and resid 1223 and name HB2 ))
 )(
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )
      5.000     5.000     0.000 peak  7524 weight  0.10000E+01 volume -0.74300E+00 ppm1      1.131 ppm2      0.529
 ASSI (
   (( segid "    " and resid 1223 and name HB2 ))
 )(
   (( segid "    " and resid 1223 and name HG  ))
 )
      5.000     5.000     0.000 peak  7525 weight  0.10000E+01 volume -0.13210E+01 ppm1      1.131 ppm2      1.031
 ASSI (
   (( segid "    " and resid 1223 and name HB2 ))
 )(
   (( segid "    " and resid 1222 and name HG2 ))
  OR 
   (( segid "    " and resid 1169 and name HG11))
 )
      6.000     6.000     0.000 peak  7526 weight  0.10000E+01 volume -0.25000E+00 ppm1      1.133 ppm2      1.392
 ASSI (
   (( segid "    " and resid 1223 and name HB2 ))
 )(
   (( segid "    " and resid 1218 and name HB2 ))
  OR 
   (( segid "    " and resid 1167 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7527 weight  0.10000E+01 volume -0.28200E+00 ppm1      1.145 ppm2      2.789
 ASSI (
   (( segid "    " and resid 1223 and name HB2 ))
 )(
   (( segid "    " and resid 1224 and name HA  ))
  OR 
   (( segid "    " and resid 1223 and name HA  ))
  OR 
   (( segid "    " and resid 1222 and name HA  ))
 )
      5.000     5.000     0.000 peak  7528 weight  0.10000E+01 volume -0.10340E+01 ppm1      1.137 ppm2      4.482
 ASSI (
   (( segid "    " and resid 1223 and name HB2 ))
 )(
   (( segid "    " and resid 1219 and name HA  ))
  OR 
   (( segid "    " and resid 1218 and name HA  ))
 )
      6.000     6.000     0.000 peak  7531 weight  0.10000E+01 volume -0.23400E+00 ppm1      1.140 ppm2      4.633
 ASSI (
   (( segid "    " and resid 1223 and name HB2 ))
 )(
   (( segid "    " and resid 1224 and name HN  ))
 )
      6.000     6.000     0.000 peak  7534 weight  0.10000E+01 volume -0.25500E+00 ppm1      1.134 ppm2      8.295
 ASSI (
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )(
   (( segid "    " and resid 1223 and name HG  ))
 )
      3.300     3.300     0.000 peak  9289 weight  0.10000E+01 volume  0.20760E+01 ppm1      0.528 ppm2      1.051
 ASSI (
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )(
   (( segid "    " and resid 1223 and name HB2 ))
  OR 
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )
      2.700     2.700     0.000 peak  7947 weight  0.10000E+01 volume  0.31690E+01 ppm1      0.527 ppm2      1.148
 ASSI (
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )(
   (( segid "    " and resid 1218 and name HB2 ))
  OR 
   (( segid "    " and resid 1167 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7829 weight  0.10000E+01 volume  0.14240E+01 ppm1      0.529 ppm2      2.811
 ASSI (
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )(
   (( segid "    " and resid 1167 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7853 weight  0.10000E+01 volume  0.40500E+00 ppm1      0.412 ppm2      2.711
 ASSI (
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )(
   (( segid "    " and resid 1226 and name HD2 ))
  OR 
   (( segid "    " and resid 1218 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HG1 ))
  OR 
   (( segid "    " and resid 1167 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7842 weight  0.10000E+01 volume  0.89700E+00 ppm1      0.415 ppm2      2.811
 ASSI (
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )(
   (( segid "    " and resid 1225 and name HA  ))
  OR 
   (( segid "    " and resid 1169 and name HA  ))
  OR 
   (( segid "    " and resid 1168 and name HA  ))
 )
      6.000     6.000     0.000 peak  6939 weight  0.10000E+01 volume  0.33500E+00 ppm1      0.409 ppm2      4.171
 ASSI (
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )(
   (( segid "    " and resid 1224 and name HA  ))
  OR 
   (( segid "    " and resid 1223 and name HA  ))
  OR 
   (( segid "    " and resid 1222 and name HA  ))
 )
      5.000     5.000     0.000 peak  6940 weight  0.10000E+01 volume  0.67200E+00 ppm1      0.410 ppm2      4.477
 ASSI (
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )(
   (( segid "    " and resid 1219 and name HA  ))
  OR 
   (( segid "    " and resid 1218 and name HA  ))
 )
      5.000     5.000     0.000 peak  7850 weight  0.10000E+01 volume  0.86200E+00 ppm1      0.411 ppm2      4.631
 ASSI (
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )(
   (( segid "    " and resid 1217 and name HA  ))
  OR 
   (( segid "    " and resid 1167 and name HA  ))
 )
      6.000     6.000     0.000 peak  7851 weight  0.10000E+01 volume  0.23100E+00 ppm1      0.411 ppm2      4.790
 ASSI (
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )(
   (( segid "    " and resid 1225 and name HE2 ))
  OR 
   (( segid "    " and resid 1225 and name HE1 ))
 )
      5.000     5.000     0.000 peak  7848 weight  0.10000E+01 volume  0.41800E+00 ppm1      0.410 ppm2      6.699
 ASSI (
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )(
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7847 weight  0.10000E+01 volume  0.84700E+00 ppm1      0.411 ppm2      6.790
 ASSI (
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )(
   (( segid "    " and resid 1224 and name HN  ))
  OR 
   (( segid "    " and resid 1218 and name HN  ))
  OR 
   (( segid "    " and resid 1217 and name HN  ))
 )
      5.000     5.000     0.000 peak  7844 weight  0.10000E+01 volume  0.40300E+00 ppm1      0.410 ppm2      8.278
 ASSI (
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )(
   (( segid "    " and resid 1220 and name HN  ))
  OR 
   (( segid "    " and resid 1219 and name HN  ))
  OR 
   (( segid "    " and resid 1197 and name HN  ))
 )
      6.000     6.000     0.000 peak  7843 weight  0.10000E+01 volume  0.27500E+00 ppm1      0.409 ppm2      8.949
 ASSI (
   (( segid "    " and resid 1224 and name HA  ))
 )(
   (( segid "    " and resid 1224 and name HG2 ))
 )
      5.000     5.000     0.000 peak  3147 weight  0.10000E+01 volume -0.77800E+00 ppm1      4.441 ppm2      2.051
 ASSI (
   (( segid "    " and resid 1224 and name HA  ))
 )(
   (( segid "    " and resid 1224 and name HG1 ))
 )
      5.000     5.000     0.000 peak  6648 weight  0.10000E+01 volume -0.50200E+00 ppm1      4.440 ppm2      2.203
 ASSI (
   (( segid "    " and resid 1224 and name HA  ))
 )(
   (( segid "    " and resid 1225 and name HB2 ))
  OR 
   (( segid "    " and resid 1225 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6652 weight  0.10000E+01 volume -0.60400E+00 ppm1      4.439 ppm2      2.493
 ASSI (
   (( segid "    " and resid 1224 and name HB2 ))
  OR 
   (( segid "    " and resid 1224 and name HB1 ))
 )(
   (( segid "    " and resid 1212 and name HD2 ))
 )
      6.000     6.000     0.000 peak  7510 weight  0.10000E+01 volume  0.39000E+00 ppm1      1.676 ppm2      7.347
 ASSI (
   (( segid "    " and resid 1224 and name HG1 ))
 )(
   (( segid "    " and resid 1224 and name HN  ))
  OR 
   (( segid "    " and resid 1217 and name HN  ))
 )
      5.000     5.000     0.000 peak  9292 weight  0.10000E+01 volume  0.44700E+00 ppm1      2.205 ppm2      8.276
 ASSI (
   (( segid "    " and resid 1224 and name HG2 ))
 )(
   (( segid "    " and resid 1224 and name HN  ))
 )
      5.000     5.000     0.000 peak  9291 weight  0.10000E+01 volume  0.67300E+00 ppm1      2.054 ppm2      8.274
 ASSI (
   (( segid "    " and resid 1225 and name HA  ))
 )(
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      3.300     3.300     0.000 peak  6632 weight  0.10000E+01 volume -0.26190E+01 ppm1      4.166 ppm2      0.680
 ASSI (
   (( segid "    " and resid 1225 and name HA  ))
 )(
   (( segid "    " and resid 1225 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7483 weight  0.10000E+01 volume -0.61800E+00 ppm1      4.156 ppm2      2.486
 ASSI (
   (( segid "    " and resid 1225 and name HA  ))
 )(
   (( segid "    " and resid 1225 and name HB2 ))
  OR 
   (( segid "    " and resid 1225 and name HB1 ))
 )
      5.000     5.000     0.000 peak  2629 weight  0.10000E+01 volume -0.81100E+00 ppm1      4.157 ppm2      2.548
 ASSI (
   (( segid "    " and resid 1225 and name HB1 ))
 )(
   (( segid "    " and resid 1177 and name HE2 ))
  OR 
   (( segid "    " and resid 1177 and name HE1 ))
 )
      6.000     6.000     0.000 peak  7489 weight  0.10000E+01 volume  0.34200E+00 ppm1      2.545 ppm2      6.589
 ASSI (
   (( segid "    " and resid 1225 and name HE2 ))
  OR 
   (( segid "    " and resid 1225 and name HE1 ))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
  OR 
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )
      5.000     5.000     0.000 peak  9609 weight  0.10000E+01 volume -0.48600E+00 ppm1      6.715 ppm2      0.388
 ASSI (
   (( segid "    " and resid 1225 and name HE2 ))
  OR 
   (( segid "    " and resid 1225 and name HE1 ))
 )(
   (( segid "    " and resid 1223 and name HG  ))
  OR 
   (( segid "    " and resid 1179 and name HG12))
  OR 
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )
      5.000     5.000     0.000 peak  4396 weight  0.10000E+01 volume -0.72500E+00 ppm1      6.715 ppm2      1.034
 ASSI (
   (( segid "    " and resid 1225 and name HE2 ))
  OR 
   (( segid "    " and resid 1225 and name HE1 ))
 )(
   (( segid "    " and resid 1223 and name HB2 ))
  OR 
   (( segid "    " and resid 1179 and name HG11))
  OR 
   (( segid "    " and resid 1173 and name HB  ))
 )
      6.000     6.000     0.000 peak  9604 weight  0.10000E+01 volume -0.33000E+00 ppm1      6.719 ppm2      1.137
 ASSI (
   (( segid "    " and resid 1225 and name HE2 ))
  OR 
   (( segid "    " and resid 1225 and name HE1 ))
 )(
   (( segid "    " and resid 1226 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HG1 ))
 )
      6.000     6.000     0.000 peak  2646 weight  0.10000E+01 volume -0.32900E+00 ppm1      6.723 ppm2      2.864
 ASSI (
   (( segid "    " and resid 1226 and name HA  ))
 )(
   (( segid "    " and resid 1227 and name HG23))
  OR 
   (( segid "    " and resid 1227 and name HG22))
  OR 
   (( segid "    " and resid 1227 and name HG21))
  OR 
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )
      6.000     6.000     0.000 peak  6622 weight  0.10000E+01 volume -0.28800E+00 ppm1      4.492 ppm2      0.680
 ASSI (
   (( segid "    " and resid 1226 and name HA  ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
 )
      6.000     6.000     0.000 peak  6627 weight  0.10000E+01 volume -0.18300E+00 ppm1      4.492 ppm2      2.065
 ASSI (
   (( segid "    " and resid 1226 and name HA  ))
 )(
   (( segid "    " and resid 1212 and name HB2 ))
  OR 
   (( segid "    " and resid 1201 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6623 weight  0.10000E+01 volume -0.27100E+00 ppm1      4.492 ppm2      3.073
 ASSI (
   (( segid "    " and resid 1226 and name HA  ))
 )(
   (( segid "    " and resid 1212 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6626 weight  0.10000E+01 volume -0.21100E+00 ppm1      4.492 ppm2      3.215
 ASSI (
   (( segid "    " and resid 1226 and name HA  ))
 )(
   (( segid "    " and resid 1225 and name HA  ))
  OR 
   (( segid "    " and resid 1214 and name HA  ))
 )
      6.000     6.000     0.000 peak  7409 weight  0.10000E+01 volume -0.24200E+00 ppm1      4.492 ppm2      4.155
 ASSI (
   (( segid "    " and resid 1226 and name HB2 ))
 )(
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )
      5.000     5.000     0.000 peak  7414 weight  0.10000E+01 volume  0.45200E+00 ppm1      1.628 ppm2      0.678
 ASSI (
   (( segid "    " and resid 1226 and name HD1 ))
 )(
   (( segid "    " and resid 1226 and name HA  ))
  OR 
   (( segid "    " and resid 1224 and name HA  ))
 )
      6.000     6.000     0.000 peak  7296 weight  0.10000E+01 volume -0.31700E+00 ppm1      3.465 ppm2      4.485
 ASSI (
   (( segid "    " and resid 1226 and name HD2 ))
 )(
   (( segid "    " and resid 1226 and name HG2 ))
 )
      5.000     5.000     0.000 peak  7283 weight  0.10000E+01 volume -0.60000E+00 ppm1      2.855 ppm2      1.678
 ASSI (
   (( segid "    " and resid 1226 and name HD2 ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7284 weight  0.10000E+01 volume -0.49400E+00 ppm1      2.853 ppm2      2.086
 ASSI (
   (( segid "    " and resid 1226 and name HD2 ))
 )(
   (( segid "    " and resid 1225 and name HB2 ))
  OR 
   (( segid "    " and resid 1225 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7286 weight  0.10000E+01 volume -0.25200E+00 ppm1      2.853 ppm2      2.490
 ASSI (
   (( segid "    " and resid 1226 and name HD2 ))
 )(
   (( segid "    " and resid 1225 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7285 weight  0.10000E+01 volume -0.21200E+00 ppm1      2.855 ppm2      2.587
 ASSI (
   (( segid "    " and resid 1227 and name HA  ))
 )(
   (( segid "    " and resid 1228 and name HB1 ))
  OR 
   (( segid "    " and resid 1227 and name HB  ))
  OR 
   (( segid "    " and resid 1177 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6614 weight  0.10000E+01 volume -0.23940E+01 ppm1      4.547 ppm2      3.705
 ASSI (
   (( segid "    " and resid 1227 and name HA  ))
 )(
   (( segid "    " and resid 1227 and name HN  ))
 )
      6.000     6.000     0.000 peak  7398 weight  0.10000E+01 volume -0.31300E+00 ppm1      4.545 ppm2      7.939
 ASSI (
   (( segid "    " and resid 1227 and name HA  ))
 )(
   (( segid "    " and resid 1228 and name HN  ))
 )
      3.300     3.300     0.000 peak  6610 weight  0.10000E+01 volume -0.24030E+01 ppm1      4.547 ppm2      8.365
 ASSI (
   (( segid "    " and resid 1227 and name HB  ))
 )(
   (( segid "    " and resid 1227 and name HG23))
  OR 
   (( segid "    " and resid 1227 and name HG22))
  OR 
   (( segid "    " and resid 1227 and name HG21))
 )
      2.700     2.700     0.000 peak  7400 weight  0.10000E+01 volume -0.38360E+01 ppm1      3.690 ppm2      0.665
 ASSI (
   (( segid "    " and resid 1227 and name HB  ))
 )(
   (( segid "    " and resid 1211 and name HA  ))
  OR 
   (( segid "    " and resid 1207 and name HA  ))
 )
      6.000     6.000     0.000 peak  7402 weight  0.10000E+01 volume -0.24600E+00 ppm1      3.693 ppm2      4.370
 ASSI (
   (( segid "    " and resid 1227 and name HG23))
  OR 
   (( segid "    " and resid 1227 and name HG22))
  OR 
   (( segid "    " and resid 1227 and name HG21))
 )(
   (( segid "    " and resid 1227 and name HB  ))
  OR 
   (( segid "    " and resid 1177 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6619 weight  0.10000E+01 volume  0.30070E+01 ppm1      0.663 ppm2      3.699
 ASSI (
   (( segid "    " and resid 1227 and name HG23))
  OR 
   (( segid "    " and resid 1227 and name HG22))
  OR 
   (( segid "    " and resid 1227 and name HG21))
 )(
   (( segid "    " and resid 1227 and name HA  ))
 )
      5.000     5.000     0.000 peak  6617 weight  0.10000E+01 volume  0.47000E+00 ppm1      0.663 ppm2      4.531
 ASSI (
   (( segid "    " and resid 1227 and name HG23))
  OR 
   (( segid "    " and resid 1227 and name HG22))
  OR 
   (( segid "    " and resid 1227 and name HG21))
 )(
   (( segid "    " and resid 1228 and name HN  ))
  OR 
   (( segid "    " and resid 1209 and name HN  ))
 )
      5.000     5.000     0.000 peak  6618 weight  0.10000E+01 volume  0.43700E+00 ppm1      0.662 ppm2      8.366
 ASSI (
   (( segid "    " and resid 1228 and name HA  ))
 )(
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )
      6.000     6.000     0.000 peak  6255 weight  0.10000E+01 volume -0.16700E+00 ppm1      5.535 ppm2      0.961
 ASSI (
   (( segid "    " and resid 1228 and name HB1 ))
 )(
   (( segid "    " and resid 1230 and name HG1 ))
  OR 
   (( segid "    " and resid 1202 and name HG1 ))
  OR 
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
  OR 
   (( segid "    " and resid 1178 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7377 weight  0.10000E+01 volume -0.28500E+00 ppm1      3.711 ppm2      1.201
 ASSI (
   (( segid "    " and resid 1228 and name HB1 ))
 )(
   (( segid "    " and resid 1228 and name HB2 ))
  OR 
   (( segid "    " and resid 1205 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7380 weight  0.10000E+01 volume -0.15350E+01 ppm1      3.710 ppm2      2.714
 ASSI (
   (( segid "    " and resid 1228 and name HB1 ))
 )(
   (( segid "    " and resid 1178 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7381 weight  0.10000E+01 volume -0.84000E+00 ppm1      3.712 ppm2      2.803
 ASSI (
   (( segid "    " and resid 1228 and name HB1 ))
 )(
   (( segid "    " and resid 1228 and name HN  ))
 )
      5.000     5.000     0.000 peak  7388 weight  0.10000E+01 volume -0.46500E+00 ppm1      3.715 ppm2      8.359
 ASSI (
   (( segid "    " and resid 1228 and name HB2 ))
 )(
   (( segid "    " and resid 1230 and name HG1 ))
  OR 
   (( segid "    " and resid 1202 and name HG1 ))
  OR 
   (( segid "    " and resid 1178 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7378 weight  0.10000E+01 volume -0.19000E+00 ppm1      2.719 ppm2      1.185
 ASSI (
   (( segid "    " and resid 1228 and name HB2 ))
 )(
   (( segid "    " and resid 1230 and name HD1 ))
  OR 
   (( segid "    " and resid 1230 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
  OR 
   (( segid "    " and resid 1207 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7379 weight  0.10000E+01 volume -0.13600E+00 ppm1      2.717 ppm2      1.446
 ASSI (
   (( segid "    " and resid 1228 and name HB2 ))
 )(
   (( segid "    " and resid 1205 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7383 weight  0.10000E+01 volume -0.29200E+00 ppm1      2.723 ppm2      3.211
 ASSI (
   (( segid "    " and resid 1228 and name HB2 ))
 )(
   (( segid "    " and resid 1228 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6251 weight  0.10000E+01 volume -0.13350E+01 ppm1      2.719 ppm2      3.716
 ASSI (
   (( segid "    " and resid 1228 and name HB2 ))
 )(
   (( segid "    " and resid 1228 and name HN  ))
  OR 
   (( segid "    " and resid 1205 and name HN  ))
 )
      6.000     6.000     0.000 peak  7387 weight  0.10000E+01 volume -0.23600E+00 ppm1      2.708 ppm2      8.345
 ASSI (
   (( segid "    " and resid 1229 and name HA  ))
 )(
   (( segid "    " and resid 1230 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
  OR 
   (( segid "    " and resid 1179 and name HG11))
 )
      6.000     6.000     0.000 peak  6498 weight  0.10000E+01 volume -0.22800E+00 ppm1      4.966 ppm2      1.090
 ASSI (
   (( segid "    " and resid 1229 and name HA  ))
 )(
   (( segid "    " and resid 1230 and name HG1 ))
  OR 
   (( segid "    " and resid 1202 and name HG1 ))
  OR 
   (( segid "    " and resid 1178 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6497 weight  0.10000E+01 volume -0.34600E+00 ppm1      4.965 ppm2      1.204
 ASSI (
   (( segid "    " and resid 1229 and name HA  ))
 )(
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )
      2.700     2.700     0.000 peak  6496 weight  0.10000E+01 volume -0.41070E+01 ppm1      4.966 ppm2      1.442
 ASSI (
   (( segid "    " and resid 1229 and name HA  ))
 )(
   (( segid "    " and resid 1230 and name HE2 ))
  OR 
   (( segid "    " and resid 1230 and name HE1 ))
  OR 
   (( segid "    " and resid 1178 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7375 weight  0.10000E+01 volume -0.21200E+00 ppm1      4.965 ppm2      2.822
 ASSI (
   (( segid "    " and resid 1229 and name HA  ))
 )(
   (( segid "    " and resid 1178 and name HD22))
 )
      6.000     6.000     0.000 peak  6492 weight  0.10000E+01 volume -0.30700E+00 ppm1      4.967 ppm2      6.799
 ASSI (
   (( segid "    " and resid 1229 and name HA  ))
 )(
   (( segid "    " and resid 1178 and name HD21))
 )
      6.000     6.000     0.000 peak  6491 weight  0.10000E+01 volume -0.29300E+00 ppm1      4.965 ppm2      7.124
 ASSI (
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )(
   (( segid "    " and resid 1227 and name HG23))
  OR 
   (( segid "    " and resid 1227 and name HG22))
  OR 
   (( segid "    " and resid 1227 and name HG21))
 )
      5.000     5.000     0.000 peak  7366 weight  0.10000E+01 volume  0.49400E+00 ppm1      1.444 ppm2      0.660
 ASSI (
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )(
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )
      6.000     6.000     0.000 peak  7368 weight  0.10000E+01 volume  0.32200E+00 ppm1      1.439 ppm2      0.939
 ASSI (
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )(
   (( segid "    " and resid 1230 and name HG2 ))
 )
      5.000     5.000     0.000 peak  7369 weight  0.10000E+01 volume  0.83200E+00 ppm1      1.442 ppm2      1.083
 ASSI (
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )(
   (( segid "    " and resid 1230 and name HG1 ))
  OR 
   (( segid "    " and resid 1178 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7370 weight  0.10000E+01 volume  0.10070E+01 ppm1      1.441 ppm2      1.211
 ASSI (
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )(
   (( segid "    " and resid 1207 and name HG  ))
  OR 
   (( segid "    " and resid 1207 and name HB1 ))
  OR 
   (( segid "    " and resid 1206 and name HB2 ))
  OR 
   (( segid "    " and resid 1206 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7365 weight  0.10000E+01 volume  0.61800E+00 ppm1      1.442 ppm2      1.793
 ASSI (
   (( segid "    " and resid 1230 and name HA  ))
 )(
   (( segid "    " and resid 1231 and name HG1 ))
  OR 
   (( segid "    " and resid 1230 and name HD2 ))
  OR 
   (( segid "    " and resid 1230 and name HD1 ))
  OR 
   (( segid "    " and resid 1230 and name HB2 ))
 )
      3.300     3.300     0.000 peak  6601 weight  0.10000E+01 volume -0.21510E+01 ppm1      3.721 ppm2      1.428
 ASSI (
   (( segid "    " and resid 1230 and name HB1 ))
 )(
   (( segid "    " and resid 1230 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7351 weight  0.10000E+01 volume  0.68100E+00 ppm1      1.630 ppm2      1.222
 ASSI (
   (( segid "    " and resid 1230 and name HB1 ))
 )(
   (( segid "    " and resid 1230 and name HD2 ))
  OR 
   (( segid "    " and resid 1230 and name HD1 ))
  OR 
   (( segid "    " and resid 1230 and name HB2 ))
 )
      2.700     2.700     0.000 peak  7350 weight  0.10000E+01 volume  0.46330E+01 ppm1      1.631 ppm2      1.441
 ASSI (
   (( segid "    " and resid 1230 and name HB1 ))
 )(
   (( segid "    " and resid 1231 and name HN  ))
 )
      6.000     6.000     0.000 peak  7348 weight  0.10000E+01 volume  0.18200E+00 ppm1      1.630 ppm2      7.756
 ASSI (
   (( segid "    " and resid 1230 and name HB2 ))
 )(
   (( segid "    " and resid 1230 and name HG2 ))
 )
      5.000     5.000     0.000 peak  7353 weight  0.10000E+01 volume  0.64000E+00 ppm1      1.448 ppm2      1.100
 ASSI (
   (( segid "    " and resid 1230 and name HB2 ))
 )(
   (( segid "    " and resid 1230 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7354 weight  0.10000E+01 volume  0.83400E+00 ppm1      1.445 ppm2      1.216
 ASSI (
   (( segid "    " and resid 1230 and name HB2 ))
 )(
   (( segid "    " and resid 1230 and name HB1 ))
 )
      2.700     2.700     0.000 peak  7349 weight  0.10000E+01 volume  0.39380E+01 ppm1      1.447 ppm2      1.623
 ASSI (
   (( segid "    " and resid 1230 and name HB2 ))
 )(
   (( segid "    " and resid 1205 and name HE2 ))
  OR 
   (( segid "    " and resid 1205 and name HE1 ))
  OR 
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7347 weight  0.10000E+01 volume  0.35500E+00 ppm1      1.444 ppm2      6.680
 ASSI (
   (( segid "    " and resid 1230 and name HB2 ))
 )(
   (( segid "    " and resid 1231 and name HN  ))
 )
      6.000     6.000     0.000 peak  7346 weight  0.10000E+01 volume  0.17700E+00 ppm1      1.444 ppm2      7.767
 ASSI (
   (( segid "    " and resid 1230 and name HG1 ))
 )(
   (( segid "    " and resid 1230 and name HE2 ))
  OR 
   (( segid "    " and resid 1230 and name HE1 ))
 )
      5.000     5.000     0.000 peak  9278 weight  0.10000E+01 volume  0.71200E+00 ppm1      1.202 ppm2      2.811
 ASSI (
   (( segid "    " and resid 1230 and name HG1 ))
 )(
   (( segid "    " and resid 1230 and name HA  ))
 )
      5.000     5.000     0.000 peak  6608 weight  0.10000E+01 volume  0.47700E+00 ppm1      1.204 ppm2      3.725
 ASSI (
   (( segid "    " and resid 1230 and name HG2 ))
 )(
   (( segid "    " and resid 1230 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7356 weight  0.10000E+01 volume  0.10510E+01 ppm1      1.094 ppm2      1.613
 ASSI (
   (( segid "    " and resid 1231 and name HA  ))
 )(
   (( segid "    " and resid 1231 and name HB2 ))
 )
      3.300     3.300     0.000 peak  6597 weight  0.10000E+01 volume -0.16260E+01 ppm1      4.015 ppm2      1.568
 ASSI (
   (( segid "    " and resid 1231 and name HA  ))
 )(
   (( segid "    " and resid 1231 and name HD2 ))
  OR 
   (( segid "    " and resid 1231 and name HD1 ))
 )
      5.000     5.000     0.000 peak  6595 weight  0.10000E+01 volume -0.73100E+00 ppm1      4.015 ppm2      3.153
 ASSI (
   (( segid "    " and resid 1231 and name HB1 ))
 )(
   (( segid "    " and resid 1230 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7336 weight  0.10000E+01 volume  0.33900E+00 ppm1      1.713 ppm2      1.067
 ASSI (
   (( segid "    " and resid 1231 and name HB1 ))
 )(
   (( segid "    " and resid 1230 and name HG1 ))
  OR 
   (( segid "    " and resid 1202 and name HG1 ))
  OR 
   (( segid "    " and resid 1178 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7337 weight  0.10000E+01 volume  0.51600E+00 ppm1      1.713 ppm2      1.195
 ASSI (
   (( segid "    " and resid 1231 and name HB1 ))
 )(
   (( segid "    " and resid 1202 and name HD2 ))
 )
      5.000     5.000     0.000 peak  7338 weight  0.10000E+01 volume  0.50800E+00 ppm1      1.712 ppm2      1.304
 ASSI (
   (( segid "    " and resid 1231 and name HB1 ))
 )(
   (( segid "    " and resid 1231 and name HD2 ))
  OR 
   (( segid "    " and resid 1231 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7329 weight  0.10000E+01 volume  0.73400E+00 ppm1      1.714 ppm2      3.129
 ASSI (
   (( segid "    " and resid 1231 and name HB2 ))
 )(
   (( segid "    " and resid 1230 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7334 weight  0.10000E+01 volume  0.19700E+00 ppm1      1.545 ppm2      1.065
 ASSI (
   (( segid "    " and resid 1231 and name HB2 ))
 )(
   (( segid "    " and resid 1230 and name HG1 ))
  OR 
   (( segid "    " and resid 1202 and name HG1 ))
  OR 
   (( segid "    " and resid 1178 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7333 weight  0.10000E+01 volume  0.32500E+00 ppm1      1.542 ppm2      1.196
 ASSI (
   (( segid "    " and resid 1231 and name HB2 ))
 )(
   (( segid "    " and resid 1231 and name HB1 ))
 )
      2.700     2.700     0.000 peak  7331 weight  0.10000E+01 volume  0.63530E+01 ppm1      1.544 ppm2      1.712
 ASSI (
   (( segid "    " and resid 1231 and name HB2 ))
 )(
   (( segid "    " and resid 1231 and name HD2 ))
  OR 
   (( segid "    " and resid 1231 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7328 weight  0.10000E+01 volume  0.53100E+00 ppm1      1.547 ppm2      3.111
 ASSI (
   (( segid "    " and resid 1211 and name HB1 ))
 )(
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )
      5.000     5.000     0.000 peak  7960 weight  0.10000E+01 volume -0.60000E+00 ppm1      3.942 ppm2      0.948
 ASSI (
   (( segid "    " and resid 1211 and name HB2 ))
 )(
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )
      5.000     5.000     0.000 peak  7963 weight  0.10000E+01 volume -0.61300E+00 ppm1      3.784 ppm2      0.951
 ASSI (
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )(
   (( segid "    " and resid 1189 and name HA  ))
 )
      6.000     6.000     0.000 peak  8610 weight  0.10000E+01 volume  0.17000E+00 ppm1      1.027 ppm2      4.343
 ASSI (
   (( segid "    " and resid 1113 and name HG1 ))
 )(
   (( segid "    " and resid 1113 and name HD2 ))
 )
      5.000     5.000     0.000 peak  9222 weight  0.10000E+01 volume  0.98300E+00 ppm1      1.978 ppm2      2.953
 ASSI (
   (( segid "    " and resid 1116 and name HA  ))
 )(
   (( segid "    " and resid 1116 and name HB2 ))
  OR 
   (( segid "    " and resid 1116 and name HB1 ))
 )
      2.700     2.700     0.000 peak  8372 weight  0.10000E+01 volume -0.41600E+01 ppm1      4.355 ppm2      2.505
 ASSI (
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )(
   (( segid "    " and resid 1120 and name HB  ))
 )
      3.300     3.300     0.000 peak  6407 weight  0.10000E+01 volume  0.21440E+01 ppm1      0.106 ppm2      1.524
 ASSI (
   (( segid "    " and resid 1123 and name HA  ))
 )(
   (( segid "    " and resid 1124 and name HD2 ))
 )
      2.700     2.700     0.000 peak  7059 weight  0.10000E+01 volume -0.31700E+01 ppm1      4.690 ppm2      2.975
 ASSI (
   (( segid "    " and resid 1135 and name HG1 ))
 )(
   (( segid "    " and resid 1135 and name HA  ))
 )
      5.000     5.000     0.000 peak  9362 weight  0.10000E+01 volume  0.54100E+00 ppm1      2.174 ppm2      5.375
 ASSI (
   (( segid "    " and resid 1163 and name HB2 ))
  OR 
   (( segid "    " and resid 1116 and name HB1 ))
 )(
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9582 weight  0.10000E+01 volume  0.33000E+00 ppm1      2.512 ppm2      6.657
 ASSI (
   (( segid "    " and resid 1164 and name HG  ))
 )(
   (( segid "    " and resid 1145 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG1 ))
  OR 
   (( segid "    " and resid 1142 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8659 weight  0.10000E+01 volume  0.47000E+00 ppm1      0.636 ppm2      2.260
 ASSI (
   (( segid "    " and resid 1149 and name HA  ))
 )(
   (( segid "    " and resid 1149 and name HG1 ))
  OR 
   (( segid "    " and resid 1149 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6266 weight  0.10000E+01 volume -0.10860E+01 ppm1      5.394 ppm2      1.585
 ASSI (
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )
      5.000     5.000     0.000 peak  8126 weight  0.10000E+01 volume  0.42700E+00 ppm1      1.777 ppm2      0.764
 ASSI (
   (( segid "    " and resid 1133 and name HB1 ))
 )(
   (( segid "    " and resid 1134 and name HA  ))
 )
      6.000     6.000     0.000 peak  7183 weight  0.10000E+01 volume -0.11400E+00 ppm1      3.823 ppm2      4.385
 ASSI (
   (( segid "    " and resid 1133 and name HB2 ))
 )(
   (( segid "    " and resid 1134 and name HA  ))
 )
      6.000     6.000     0.000 peak  7182 weight  0.10000E+01 volume -0.19300E+00 ppm1      3.755 ppm2      4.380
 ASSI (
   (( segid "    " and resid 1158 and name HA  ))
 )(
   (( segid "    " and resid 1159 and name HN  ))
 )
      2.700     2.700     0.000 peak  2635 weight  0.10000E+01 volume -0.32300E+01 ppm1      4.485 ppm2      7.969
 ASSI (
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
 )
      2.700     2.700     0.000 peak  8663 weight  0.10000E+01 volume  0.31270E+01 ppm1      0.415 ppm2      0.644
 ASSI (
   (( segid "    " and resid 1225 and name HB1 ))
  OR 
   (( segid "    " and resid 1176 and name HB2 ))
 )(
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )
      5.000     5.000     0.000 peak  7758 weight  0.10000E+01 volume  0.44600E+00 ppm1      2.582 ppm2     -0.397
 ASSI (
   (( segid "    " and resid 1176 and name HB2 ))
  OR 
   (( segid "    " and resid 1176 and name HB1 ))
 )(
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )
      6.000     6.000     0.000 peak  7759 weight  0.10000E+01 volume  0.30700E+00 ppm1      2.620 ppm2     -0.397
 ASSI (
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )(
   (( segid "    " and resid 1175 and name HA  ))
 )
      5.000     5.000     0.000 peak  8285 weight  0.10000E+01 volume  0.14590E+01 ppm1      2.009 ppm2      3.971
 ASSI (
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )(
   (( segid "    " and resid 1176 and name HN  ))
 )
      5.000     5.000     0.000 peak  8287 weight  0.10000E+01 volume  0.74500E+00 ppm1      2.005 ppm2      7.546
 ASSI (
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
 )(
   (( segid "    " and resid 1180 and name HA  ))
 )
      2.700     2.700     0.000 peak  8412 weight  0.10000E+01 volume  0.52730E+01 ppm1      1.223 ppm2      4.722
 ASSI (
   (( segid "    " and resid 1181 and name HA  ))
 )(
   (( segid "    " and resid 1181 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8371 weight  0.10000E+01 volume -0.78500E+00 ppm1      4.354 ppm2      1.351
 ASSI (
   (( segid "    " and resid 1187 and name HB2 ))
  OR 
   (( segid "    " and resid 1187 and name HB1 ))
  OR 
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )(
   (( segid "    " and resid 1187 and name HA  ))
 )
      3.300     3.300     0.000 peak  8282 weight  0.10000E+01 volume  0.18940E+01 ppm1      2.011 ppm2      4.148
 ASSI (
   (( segid "    " and resid 1189 and name HA  ))
 )(
   (( segid "    " and resid 1189 and name HB1 ))
 )
      3.300     3.300     0.000 peak  8492 weight  0.10000E+01 volume -0.19690E+01 ppm1      4.346 ppm2      1.757
 ASSI (
   (( segid "    " and resid 1189 and name HA  ))
 )(
   (( segid "    " and resid 1189 and name HB2 ))
 )
      3.300     3.300     0.000 peak  8370 weight  0.10000E+01 volume -0.19870E+01 ppm1      4.346 ppm2      1.551
 ASSI (
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )(
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )
      6.000     6.000     0.000 peak  7948 weight  0.10000E+01 volume  0.34400E+00 ppm1      1.138 ppm2      0.143
 ASSI (
   (( segid "    " and resid 1199 and name HA  ))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
  OR 
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )
      5.000     5.000     0.000 peak  6310 weight  0.10000E+01 volume -0.76600E+00 ppm1      5.273 ppm2      7.158
 ASSI (
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
  OR 
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7913 weight  0.10000E+01 volume  0.33600E+00 ppm1      0.688 ppm2      7.162
 ASSI (
   (( segid "    " and resid 1226 and name HD1 ))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
  OR 
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )
      5.000     5.000     0.000 peak  2567 weight  0.10000E+01 volume -0.75100E+00 ppm1      3.469 ppm2      7.150
 ASSI (
   (( segid "    " and resid 1226 and name HD2 ))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7291 weight  0.10000E+01 volume -0.40200E+00 ppm1      2.850 ppm2      7.159
 ASSI (
   (( segid "    " and resid 1207 and name HA  ))
 )(
   (( segid "    " and resid 1207 and name HG  ))
  OR 
   (( segid "    " and resid 1207 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6726 weight  0.10000E+01 volume -0.13550E+01 ppm1      4.410 ppm2      1.791
 ASSI (
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )(
   (( segid "    " and resid 1207 and name HG  ))
  OR 
   (( segid "    " and resid 1207 and name HB1 ))
 )
      2.700     2.700     0.000 peak  9337 weight  0.10000E+01 volume  0.32640E+01 ppm1      0.946 ppm2      1.797
 ASSI (
   (( segid "    " and resid 1214 and name HG  ))
 )(
   (( segid "    " and resid 1214 and name HN  ))
 )
      5.000     5.000     0.000 peak  9332 weight  0.10000E+01 volume  0.42400E+00 ppm1      1.702 ppm2      8.374
 ASSI (
   (( segid "    " and resid 1106 and name HA  ))
 )(
   (( segid "    " and resid 1106 and name HB1 ))
 )
      3.300     3.300     0.000 peak  7159 weight  0.10000E+01 volume -0.17580E+01 ppm1      4.549 ppm2      3.136
 ASSI (
   (( segid "    " and resid 1106 and name HB2 ))
 )(
   (( segid "    " and resid 1106 and name HB1 ))
 )
      2.700     2.700     0.000 peak  9255 weight  0.10000E+01 volume  0.99040E+01 ppm1      3.012 ppm2      3.122
 ASSI (
   (( segid "    " and resid 1106 and name HA  ))
 )(
   (( segid "    " and resid 1106 and name HB2 ))
 )
      3.300     3.300     0.000 peak  7160 weight  0.10000E+01 volume -0.17340E+01 ppm1      4.549 ppm2      3.009
 ASSI (
   (( segid "    " and resid 1106 and name HB2 ))
 )(
   (( segid "    " and resid 1106 and name HN  ))
 )
      5.000     5.000     0.000 peak  8164 weight  0.10000E+01 volume  0.68600E+00 ppm1      3.011 ppm2      8.186
 ASSI (
   (( segid "    " and resid 1107 and name HA2 ))
 )(
   (( segid "    " and resid 1107 and name HA1 ))
 )
      2.700     2.700     0.000 peak  2616 weight  0.10000E+01 volume -0.68590E+01 ppm1      3.474 ppm2      3.806
 ASSI (
   (( segid "    " and resid 1154 and name HA  ))
 )(
   (( segid "    " and resid 1107 and name HA1 ))
 )
      5.000     5.000     0.000 peak  6991 weight  0.10000E+01 volume -0.46800E+00 ppm1      4.260 ppm2      3.813
 ASSI (
   (( segid "    " and resid 1154 and name HA  ))
 )(
   (( segid "    " and resid 1107 and name HA2 ))
 )
      5.000     5.000     0.000 peak  6990 weight  0.10000E+01 volume -0.60800E+00 ppm1      4.261 ppm2      3.491
 ASSI (
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )(
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9460 weight  0.10000E+01 volume  0.12700E+01 ppm1      0.850 ppm2      1.540
 ASSI (
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
 )(
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9461 weight  0.10000E+01 volume  0.14620E+01 ppm1      0.799 ppm2      1.545
 ASSI (
   (( segid "    " and resid 1130 and name HG1 ))
 )(
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9459 weight  0.10000E+01 volume  0.44700E+00 ppm1      2.028 ppm2      1.548
 ASSI (
   (( segid "    " and resid 1108 and name HG1 ))
 )(
   (( segid "    " and resid 1108 and name HE2 ))
  OR 
   (( segid "    " and resid 1108 and name HE1 ))
 )
      5.000     5.000     0.000 peak  9507 weight  0.10000E+01 volume  0.78300E+00 ppm1      1.413 ppm2      2.923
 ASSI (
   (( segid "    " and resid 1108 and name HG2 ))
 )(
   (( segid "    " and resid 1108 and name HE2 ))
  OR 
   (( segid "    " and resid 1108 and name HE1 ))
 )
      5.000     5.000     0.000 peak  7029 weight  0.10000E+01 volume  0.51000E+00 ppm1      1.283 ppm2      2.914
 ASSI (
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )(
   (( segid "    " and resid 1108 and name HE2 ))
  OR 
   (( segid "    " and resid 1108 and name HE1 ))
 )
      6.000     6.000     0.000 peak  9467 weight  0.10000E+01 volume  0.24100E+00 ppm1      0.850 ppm2      2.917
 ASSI (
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
 )(
   (( segid "    " and resid 1108 and name HE2 ))
  OR 
   (( segid "    " and resid 1108 and name HE1 ))
 )
      6.000     6.000     0.000 peak  9471 weight  0.10000E+01 volume  0.24400E+00 ppm1      0.804 ppm2      2.921
 ASSI (
   (( segid "    " and resid 1129 and name HA  ))
 )(
   (( segid "    " and resid 1108 and name HG2 ))
 )
      5.000     5.000     0.000 peak  7022 weight  0.10000E+01 volume -0.73200E+00 ppm1      4.350 ppm2      1.277
 ASSI (
   (( segid "    " and resid 1130 and name HD1 ))
 )(
   (( segid "    " and resid 1108 and name HG2 ))
 )
      6.000     6.000     0.000 peak  9514 weight  0.10000E+01 volume -0.39200E+00 ppm1      3.658 ppm2      1.289
 ASSI (
   (( segid "    " and resid 1130 and name HD2 ))
 )(
   (( segid "    " and resid 1108 and name HG2 ))
 )
      5.000     5.000     0.000 peak  9501 weight  0.10000E+01 volume -0.44200E+00 ppm1      3.409 ppm2      1.286
 ASSI (
   (( segid "    " and resid 1107 and name HA1 ))
 )(
   (( segid "    " and resid 1108 and name HN  ))
 )
      5.000     5.000     0.000 peak  9241 weight  0.10000E+01 volume -0.61500E+00 ppm1      3.806 ppm2      7.500
 ASSI (
   (( segid "    " and resid 1107 and name HA2 ))
 )(
   (( segid "    " and resid 1109 and name HA  ))
 )
      6.000     6.000     0.000 peak  9245 weight  0.10000E+01 volume -0.25900E+00 ppm1      3.484 ppm2      4.552
 ASSI (
   (( segid "    " and resid 1109 and name HB1 ))
 )(
   (( segid "    " and resid 1109 and name HA  ))
 )
      5.000     5.000     0.000 peak  7167 weight  0.10000E+01 volume -0.50700E+00 ppm1      2.869 ppm2      4.534
 ASSI (
   (( segid "    " and resid 1109 and name HB2 ))
 )(
   (( segid "    " and resid 1109 and name HA  ))
 )
      5.000     5.000     0.000 peak  7165 weight  0.10000E+01 volume -0.65800E+00 ppm1      2.056 ppm2      4.533
 ASSI (
   (( segid "    " and resid 1109 and name HB1 ))
 )(
   (( segid "    " and resid 1109 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8145 weight  0.10000E+01 volume -0.11770E+01 ppm1      2.870 ppm2      2.064
 ASSI (
   (( segid "    " and resid 1109 and name HA  ))
 )(
   (( segid "    " and resid 1109 and name HN  ))
 )
      5.000     5.000     0.000 peak  7153 weight  0.10000E+01 volume -0.67200E+00 ppm1      4.531 ppm2      8.635
 ASSI (
   (( segid "    " and resid 1109 and name HB2 ))
 )(
   (( segid "    " and resid 1109 and name HN  ))
 )
      5.000     5.000     0.000 peak  8648 weight  0.10000E+01 volume -0.50800E+00 ppm1      2.058 ppm2      8.631
 ASSI (
   (( segid "    " and resid 1111 and name HD1 ))
 )(
   (( segid "    " and resid 1110 and name HA1 ))
 )
      5.000     5.000     0.000 peak  7133 weight  0.10000E+01 volume -0.10850E+01 ppm1      3.864 ppm2      4.716
 ASSI (
   (( segid "    " and resid 1111 and name HD2 ))
 )(
   (( segid "    " and resid 1110 and name HA1 ))
 )
      5.000     5.000     0.000 peak  7132 weight  0.10000E+01 volume -0.12340E+01 ppm1      3.652 ppm2      4.719
 ASSI (
   (( segid "    " and resid 1111 and name HD1 ))
 )(
   (( segid "    " and resid 1110 and name HA2 ))
 )
      5.000     5.000     0.000 peak  7138 weight  0.10000E+01 volume -0.83400E+00 ppm1      3.869 ppm2      3.977
 ASSI (
   (( segid "    " and resid 1111 and name HD2 ))
 )(
   (( segid "    " and resid 1110 and name HA2 ))
 )
      5.000     5.000     0.000 peak  7136 weight  0.10000E+01 volume -0.13050E+01 ppm1      3.650 ppm2      3.977
 ASSI (
   (( segid "    " and resid 1111 and name HB1 ))
 )(
   (( segid "    " and resid 1111 and name HA  ))
 )
      5.000     5.000     0.000 peak  7247 weight  0.10000E+01 volume  0.98100E+00 ppm1      2.514 ppm2      4.759
 ASSI (
   (( segid "    " and resid 1111 and name HG1 ))
 )(
   (( segid "    " and resid 1111 and name HA  ))
 )
      5.000     5.000     0.000 peak  7242 weight  0.10000E+01 volume  0.44000E+00 ppm1      2.214 ppm2      4.758
 ASSI (
   (( segid "    " and resid 1111 and name HG2 ))
 )(
   (( segid "    " and resid 1111 and name HA  ))
 )
      5.000     5.000     0.000 peak  2618 weight  0.10000E+01 volume  0.49400E+00 ppm1      2.183 ppm2      4.754
 ASSI (
   (( segid "    " and resid 1112 and name HD1 ))
 )(
   (( segid "    " and resid 1111 and name HA  ))
 )
      3.300     3.300     0.000 peak  7276 weight  0.10000E+01 volume -0.19400E+01 ppm1      3.536 ppm2      4.770
 ASSI (
   (( segid "    " and resid 1112 and name HD2 ))
 )(
   (( segid "    " and resid 1111 and name HA  ))
 )
      5.000     5.000     0.000 peak  7277 weight  0.10000E+01 volume -0.15290E+01 ppm1      3.467 ppm2      4.770
 ASSI (
   (( segid "    " and resid 1112 and name HG2 ))
 )(
   (( segid "    " and resid 1111 and name HA  ))
 )
      6.000     6.000     0.000 peak  7318 weight  0.10000E+01 volume  0.22400E+00 ppm1      1.104 ppm2      4.763
 ASSI (
   (( segid "    " and resid 1126 and name HB2 ))
  OR 
   (( segid "    " and resid 1126 and name HB1 ))
 )(
   (( segid "    " and resid 1111 and name HA  ))
 )
      5.000     5.000     0.000 peak  9133 weight  0.10000E+01 volume -0.42400E+00 ppm1      3.900 ppm2      4.767
 ASSI (
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )(
   (( segid "    " and resid 1111 and name HA  ))
 )
      5.000     5.000     0.000 peak  9110 weight  0.10000E+01 volume -0.70100E+00 ppm1      6.820 ppm2      4.770
 ASSI (
   (( segid "    " and resid 1111 and name HG1 ))
 )(
   (( segid "    " and resid 1111 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7151 weight  0.10000E+01 volume  0.14220E+01 ppm1      2.212 ppm2      2.516
 ASSI (
   (( segid "    " and resid 1111 and name HG2 ))
 )(
   (( segid "    " and resid 1111 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7150 weight  0.10000E+01 volume  0.15860E+01 ppm1      2.181 ppm2      2.516
 ASSI (
   (( segid "    " and resid 1111 and name HG1 ))
 )(
   (( segid "    " and resid 1111 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7238 weight  0.10000E+01 volume  0.15460E+01 ppm1      2.214 ppm2      1.850
 ASSI (
   (( segid "    " and resid 1111 and name HG2 ))
 )(
   (( segid "    " and resid 1111 and name HB2 ))
 )
      3.300     3.300     0.000 peak  7237 weight  0.10000E+01 volume  0.17060E+01 ppm1      2.181 ppm2      1.849
 ASSI (
   (( segid "    " and resid 1111 and name HG1 ))
 )(
   (( segid "    " and resid 1111 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7240 weight  0.10000E+01 volume  0.12850E+01 ppm1      2.215 ppm2      3.875
 ASSI (
   (( segid "    " and resid 1111 and name HG2 ))
 )(
   (( segid "    " and resid 1111 and name HD1 ))
 )
      5.000     5.000     0.000 peak  2609 weight  0.10000E+01 volume  0.12790E+01 ppm1      2.181 ppm2      3.874
 ASSI (
   (( segid "    " and resid 1111 and name HG1 ))
 )(
   (( segid "    " and resid 1111 and name HD2 ))
 )
      5.000     5.000     0.000 peak  7239 weight  0.10000E+01 volume  0.11790E+01 ppm1      2.216 ppm2      3.654
 ASSI (
   (( segid "    " and resid 1111 and name HG2 ))
 )(
   (( segid "    " and resid 1111 and name HD2 ))
 )
      5.000     5.000     0.000 peak  2607 weight  0.10000E+01 volume  0.12850E+01 ppm1      2.182 ppm2      3.656
 ASSI (
   (( segid "    " and resid 1111 and name HA  ))
 )(
   (( segid "    " and resid 1111 and name HG2 ))
  OR 
   (( segid "    " and resid 1111 and name HG1 ))
 )
      6.000     6.000     0.000 peak  7271 weight  0.10000E+01 volume -0.38600E+00 ppm1      4.766 ppm2      2.184
 ASSI (
   (( segid "    " and resid 1111 and name HB1 ))
 )(
   (( segid "    " and resid 1111 and name HG2 ))
  OR 
   (( segid "    " and resid 1111 and name HG1 ))
 )
      3.300     3.300     0.000 peak  7253 weight  0.10000E+01 volume  0.22720E+01 ppm1      2.516 ppm2      2.194
 ASSI (
   (( segid "    " and resid 1126 and name HA  ))
 )(
   (( segid "    " and resid 1111 and name HG2 ))
  OR 
   (( segid "    " and resid 1111 and name HG1 ))
 )
      5.000     5.000     0.000 peak  3306 weight  0.10000E+01 volume -0.13080E+01 ppm1      4.385 ppm2      2.194
 ASSI (
   (( segid "    " and resid 1126 and name HB2 ))
  OR 
   (( segid "    " and resid 1126 and name HB1 ))
 )(
   (( segid "    " and resid 1111 and name HG2 ))
  OR 
   (( segid "    " and resid 1111 and name HG1 ))
 )
      6.000     6.000     0.000 peak  9131 weight  0.10000E+01 volume -0.31100E+00 ppm1      3.900 ppm2      2.198
 ASSI (
   (( segid "    " and resid 1112 and name HB1 ))
 )(
   (( segid "    " and resid 1112 and name HA  ))
 )
      5.000     5.000     0.000 peak  9529 weight  0.10000E+01 volume  0.45200E+00 ppm1      1.289 ppm2      3.285
 ASSI (
   (( segid "    " and resid 1112 and name HB2 ))
 )(
   (( segid "    " and resid 1112 and name HA  ))
 )
      5.000     5.000     0.000 peak  9530 weight  0.10000E+01 volume  0.67600E+00 ppm1      0.369 ppm2      3.287
 ASSI (
   (( segid "    " and resid 1113 and name HD1 ))
 )(
   (( segid "    " and resid 1112 and name HA  ))
 )
      6.000     6.000     0.000 peak  9528 weight  0.10000E+01 volume -0.32700E+00 ppm1      2.991 ppm2      3.297
 ASSI (
   (( segid "    " and resid 1113 and name HD2 ))
 )(
   (( segid "    " and resid 1112 and name HA  ))
 )
      5.000     5.000     0.000 peak  9527 weight  0.10000E+01 volume -0.63500E+00 ppm1      2.950 ppm2      3.289
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1112 and name HA  ))
 )
      5.000     5.000     0.000 peak  8726 weight  0.10000E+01 volume  0.42900E+00 ppm1      0.447 ppm2      3.289
 ASSI (
   (( segid "    " and resid 1112 and name HG2 ))
 )(
   (( segid "    " and resid 1112 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7319 weight  0.10000E+01 volume  0.68000E+00 ppm1      1.100 ppm2      1.300
 ASSI (
   (( segid "    " and resid 1112 and name HB1 ))
 )(
   (( segid "    " and resid 1112 and name HB2 ))
 )
      3.300     3.300     0.000 peak  7213 weight  0.10000E+01 volume  0.16710E+01 ppm1      1.290 ppm2      0.374
 ASSI (
   (( segid "    " and resid 1112 and name HD1 ))
 )(
   (( segid "    " and resid 1112 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7309 weight  0.10000E+01 volume -0.24300E+00 ppm1      3.546 ppm2      0.379
 ASSI (
   (( segid "    " and resid 1112 and name HG2 ))
 )(
   (( segid "    " and resid 1112 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9234 weight  0.10000E+01 volume  0.51300E+00 ppm1      1.102 ppm2      0.378
 ASSI (
   (( segid "    " and resid 1111 and name HB1 ))
 )(
   (( segid "    " and resid 1112 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7257 weight  0.10000E+01 volume  0.69600E+00 ppm1      2.517 ppm2      3.545
 ASSI (
   (( segid "    " and resid 1112 and name HG2 ))
 )(
   (( segid "    " and resid 1112 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7313 weight  0.10000E+01 volume  0.79800E+00 ppm1      1.104 ppm2      3.536
 ASSI (
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )(
   (( segid "    " and resid 1112 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7311 weight  0.10000E+01 volume -0.49100E+00 ppm1      6.819 ppm2      3.539
 ASSI (
   (( segid "    " and resid 1111 and name HB1 ))
 )(
   (( segid "    " and resid 1112 and name HD2 ))
 )
      5.000     5.000     0.000 peak  7258 weight  0.10000E+01 volume  0.59000E+00 ppm1      2.516 ppm2      3.488
 ASSI (
   (( segid "    " and resid 1112 and name HB2 ))
 )(
   (( segid "    " and resid 1112 and name HD2 ))
 )
      6.000     6.000     0.000 peak  9535 weight  0.10000E+01 volume  0.27900E+00 ppm1      0.371 ppm2      3.472
 ASSI (
   (( segid "    " and resid 1112 and name HG2 ))
 )(
   (( segid "    " and resid 1112 and name HD2 ))
 )
      5.000     5.000     0.000 peak  7314 weight  0.10000E+01 volume  0.74700E+00 ppm1      1.104 ppm2      3.468
 ASSI (
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )(
   (( segid "    " and resid 1112 and name HD2 ))
 )
      5.000     5.000     0.000 peak  9115 weight  0.10000E+01 volume -0.47400E+00 ppm1      6.816 ppm2      3.471
 ASSI (
   (( segid "    " and resid 1112 and name HB2 ))
 )(
   (( segid "    " and resid 1112 and name HG1 ))
 )
      5.000     5.000     0.000 peak  9532 weight  0.10000E+01 volume  0.45100E+00 ppm1      0.371 ppm2      1.542
 ASSI (
   (( segid "    " and resid 1112 and name HD1 ))
 )(
   (( segid "    " and resid 1112 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7280 weight  0.10000E+01 volume -0.10600E+01 ppm1      3.535 ppm2      1.546
 ASSI (
   (( segid "    " and resid 1112 and name HD2 ))
 )(
   (( segid "    " and resid 1112 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7281 weight  0.10000E+01 volume -0.75500E+00 ppm1      3.463 ppm2      1.546
 ASSI (
   (( segid "    " and resid 1112 and name HG2 ))
 )(
   (( segid "    " and resid 1112 and name HG1 ))
 )
      3.300     3.300     0.000 peak  7312 weight  0.10000E+01 volume  0.26310E+01 ppm1      1.105 ppm2      1.546
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1112 and name HG1 ))
 )
      3.300     3.300     0.000 peak  7080 weight  0.10000E+01 volume  0.23020E+01 ppm1      0.501 ppm2      1.533
 ASSI (
   (( segid "    " and resid 1112 and name HA  ))
 )(
   (( segid "    " and resid 1112 and name HG2 ))
 )
      6.000     6.000     0.000 peak  9539 weight  0.10000E+01 volume -0.26300E+00 ppm1      3.279 ppm2      1.112
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1112 and name HG2 ))
 )
      5.000     5.000     0.000 peak  7083 weight  0.10000E+01 volume  0.70100E+00 ppm1      0.501 ppm2      1.119
 ASSI (
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )(
   (( segid "    " and resid 1112 and name HG2 ))
 )
      6.000     6.000     0.000 peak  6408 weight  0.10000E+01 volume  0.33300E+00 ppm1      0.105 ppm2      1.112
 ASSI (
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )(
   (( segid "    " and resid 1112 and name HG2 ))
 )
      5.000     5.000     0.000 peak  7769 weight  0.10000E+01 volume  0.49800E+00 ppm1      0.098 ppm2      1.114
 ASSI (
   (( segid "    " and resid 1114 and name HG2 ))
  OR 
   (( segid "    " and resid 1114 and name HG1 ))
 )(
   (( segid "    " and resid 1113 and name HA  ))
 )
      5.000     5.000     0.000 peak  9226 weight  0.10000E+01 volume  0.98300E+00 ppm1      1.977 ppm2      4.586
 ASSI (
   (( segid "    " and resid 1113 and name HB2 ))
 )(
   (( segid "    " and resid 1113 and name HB1 ))
 )
      2.700     2.700     0.000 peak  7324 weight  0.10000E+01 volume  0.38000E+01 ppm1      1.754 ppm2      2.234
 ASSI (
   (( segid "    " and resid 1114 and name HB1 ))
 )(
   (( segid "    " and resid 1114 and name HA  ))
 )
      5.000     5.000     0.000 peak  8638 weight  0.10000E+01 volume  0.14570E+01 ppm1      2.208 ppm2      4.664
 ASSI (
   (( segid "    " and resid 1114 and name HB2 ))
 )(
   (( segid "    " and resid 1114 and name HA  ))
 )
      5.000     5.000     0.000 peak  8639 weight  0.10000E+01 volume  0.12440E+01 ppm1      1.852 ppm2      4.671
 ASSI (
   (( segid "    " and resid 1114 and name HG2 ))
  OR 
   (( segid "    " and resid 1114 and name HG1 ))
 )(
   (( segid "    " and resid 1114 and name HA  ))
 )
      5.000     5.000     0.000 peak  9227 weight  0.10000E+01 volume  0.81500E+00 ppm1      1.977 ppm2      4.652
 ASSI (
   (( segid "    " and resid 1114 and name HG2 ))
  OR 
   (( segid "    " and resid 1114 and name HG1 ))
 )(
   (( segid "    " and resid 1114 and name HB1 ))
 )
      2.700     2.700     0.000 peak  9216 weight  0.10000E+01 volume  0.33150E+01 ppm1      1.981 ppm2      2.209
 ASSI (
   (( segid "    " and resid 1114 and name HB1 ))
 )(
   (( segid "    " and resid 1114 and name HB2 ))
 )
      2.700     2.700     0.000 peak  9214 weight  0.10000E+01 volume  0.33440E+01 ppm1      2.211 ppm2      1.853
 ASSI (
   (( segid "    " and resid 1114 and name HB1 ))
 )(
   (( segid "    " and resid 1114 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9211 weight  0.10000E+01 volume  0.15000E+00 ppm1      2.208 ppm2      3.814
 ASSI (
   (( segid "    " and resid 1114 and name HG2 ))
  OR 
   (( segid "    " and resid 1114 and name HG1 ))
 )(
   (( segid "    " and resid 1114 and name HD1 ))
 )
      3.300     3.300     0.000 peak  9225 weight  0.10000E+01 volume  0.18740E+01 ppm1      1.979 ppm2      3.813
 ASSI (
   (( segid "    " and resid 1114 and name HB1 ))
 )(
   (( segid "    " and resid 1114 and name HD2 ))
 )
      6.000     6.000     0.000 peak  9212 weight  0.10000E+01 volume  0.27300E+00 ppm1      2.210 ppm2      3.639
 ASSI (
   (( segid "    " and resid 1114 and name HG2 ))
  OR 
   (( segid "    " and resid 1114 and name HG1 ))
 )(
   (( segid "    " and resid 1114 and name HD2 ))
 )
      3.300     3.300     0.000 peak  9224 weight  0.10000E+01 volume  0.21270E+01 ppm1      1.977 ppm2      3.637
 ASSI (
   (( segid "    " and resid 1160 and name HD1 ))
 )(
   (( segid "    " and resid 1114 and name HG2 ))
  OR 
   (( segid "    " and resid 1114 and name HG1 ))
 )
      6.000     6.000     0.000 peak  7660 weight  0.10000E+01 volume -0.38900E+00 ppm1      3.988 ppm2      1.990
 ASSI (
   (( segid "    " and resid 1160 and name HD2 ))
 )(
   (( segid "    " and resid 1114 and name HG2 ))
  OR 
   (( segid "    " and resid 1114 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7662 weight  0.10000E+01 volume -0.40300E+00 ppm1      3.685 ppm2      1.984
 ASSI (
   (( segid "    " and resid 1115 and name HB  ))
 )(
   (( segid "    " and resid 1115 and name HA  ))
 )
      5.000     5.000     0.000 peak  8268 weight  0.10000E+01 volume  0.79700E+00 ppm1      1.567 ppm2      4.522
 ASSI (
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )(
   (( segid "    " and resid 1115 and name HB  ))
 )
      2.700     2.700     0.000 peak  8900 weight  0.10000E+01 volume  0.35180E+01 ppm1      0.436 ppm2      1.555
 ASSI (
   (( segid "    " and resid 1115 and name HA  ))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      5.000     5.000     0.000 peak  7124 weight  0.10000E+01 volume -0.49700E+00 ppm1      4.519 ppm2      0.194
 ASSI (
   (( segid "    " and resid 1115 and name HB  ))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      5.000     5.000     0.000 peak  8262 weight  0.10000E+01 volume  0.68500E+00 ppm1      1.564 ppm2      0.198
 ASSI (
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      2.700     2.700     0.000 peak  8901 weight  0.10000E+01 volume  0.39380E+01 ppm1      0.433 ppm2      0.196
 ASSI (
   (( segid "    " and resid 1118 and name HA2 ))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      6.000     6.000     0.000 peak  7107 weight  0.10000E+01 volume -0.39000E+00 ppm1      3.846 ppm2      0.194
 ASSI (
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      5.000     5.000     0.000 peak  7700 weight  0.10000E+01 volume -0.60500E+00 ppm1      6.600 ppm2      0.197
 ASSI (
   (( segid "    " and resid 1137 and name HA  ))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      6.000     6.000     0.000 peak  6966 weight  0.10000E+01 volume -0.30600E+00 ppm1      4.524 ppm2      0.199
 ASSI (
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )(
   (( segid "    " and resid 1115 and name HG11))
 )
      5.000     5.000     0.000 peak  8902 weight  0.10000E+01 volume  0.76500E+00 ppm1      0.436 ppm2      0.870
 ASSI (
   (( segid "    " and resid 1115 and name HA  ))
 )(
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )
      3.300     3.300     0.000 peak  7123 weight  0.10000E+01 volume -0.20280E+01 ppm1      4.524 ppm2      0.438
 ASSI (
   (( segid "    " and resid 1137 and name HA  ))
 )(
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )
      6.000     6.000     0.000 peak  9515 weight  0.10000E+01 volume -0.13800E+00 ppm1      4.526 ppm2      0.430
 ASSI (
   (( segid "    " and resid 1114 and name HB2 ))
 )(
   (( segid "    " and resid 1115 and name HN  ))
 )
      5.000     5.000     0.000 peak  9218 weight  0.10000E+01 volume  0.41700E+00 ppm1      1.847 ppm2      8.712
 ASSI (
   (( segid "    " and resid 1115 and name HA  ))
 )(
   (( segid "    " and resid 1115 and name HN  ))
 )
      5.000     5.000     0.000 peak  7119 weight  0.10000E+01 volume -0.56200E+00 ppm1      4.518 ppm2      8.714
 ASSI (
   (( segid "    " and resid 1119 and name HA  ))
 )(
   (( segid "    " and resid 1115 and name HN  ))
 )
      6.000     6.000     0.000 peak  6388 weight  0.10000E+01 volume -0.25000E+00 ppm1      5.004 ppm2      8.727
 ASSI (
   (( segid "    " and resid 1115 and name HA  ))
 )(
   (( segid "    " and resid 1116 and name HB2 ))
  OR 
   (( segid "    " and resid 1116 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7121 weight  0.10000E+01 volume -0.63900E+00 ppm1      4.517 ppm2      2.504
 ASSI (
   (( segid "    " and resid 1117 and name HB2 ))
 )(
   (( segid "    " and resid 1116 and name HB2 ))
  OR 
   (( segid "    " and resid 1116 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9205 weight  0.10000E+01 volume  0.25900E+00 ppm1      1.273 ppm2      2.523
 ASSI (
   (( segid "    " and resid 1115 and name HA  ))
 )(
   (( segid "    " and resid 1116 and name HN  ))
 )
      2.700     2.700     0.000 peak  7120 weight  0.10000E+01 volume -0.31430E+01 ppm1      4.524 ppm2      8.179
 ASSI (
   (( segid "    " and resid 1117 and name HB2 ))
 )(
   (( segid "    " and resid 1117 and name HA  ))
 )
      5.000     5.000     0.000 peak  7117 weight  0.10000E+01 volume  0.70200E+00 ppm1      1.268 ppm2      3.786
 ASSI (
   (( segid "    " and resid 1117 and name HA  ))
 )(
   (( segid "    " and resid 1117 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7115 weight  0.10000E+01 volume -0.69000E+00 ppm1      3.784 ppm2      2.100
 ASSI (
   (( segid "    " and resid 1117 and name HB2 ))
 )(
   (( segid "    " and resid 1117 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9204 weight  0.10000E+01 volume  0.14670E+01 ppm1      1.271 ppm2      2.108
 ASSI (
   (( segid "    " and resid 1116 and name HB2 ))
  OR 
   (( segid "    " and resid 1116 and name HB1 ))
 )(
   (( segid "    " and resid 1117 and name HD21))
 )
      5.000     5.000     0.000 peak  9203 weight  0.10000E+01 volume  0.42700E+00 ppm1      2.499 ppm2      7.430
 ASSI (
   (( segid "    " and resid 1117 and name HA  ))
 )(
   (( segid "    " and resid 1117 and name HD21))
 )
      5.000     5.000     0.000 peak  7110 weight  0.10000E+01 volume -0.49900E+00 ppm1      3.781 ppm2      7.421
 ASSI (
   (( segid "    " and resid 1117 and name HA  ))
 )(
   (( segid "    " and resid 1117 and name HD22))
 )
      6.000     6.000     0.000 peak  7112 weight  0.10000E+01 volume -0.25700E+00 ppm1      3.787 ppm2      6.648
 ASSI (
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )(
   (( segid "    " and resid 1118 and name HA1 ))
 )
      5.000     5.000     0.000 peak  6976 weight  0.10000E+01 volume  0.95800E+00 ppm1      0.196 ppm2      4.527
 ASSI (
   (( segid "    " and resid 1118 and name HA2 ))
 )(
   (( segid "    " and resid 1118 and name HA1 ))
 )
      3.300     3.300     0.000 peak  7105 weight  0.10000E+01 volume -0.19500E+01 ppm1      3.838 ppm2      4.539
 ASSI (
   (( segid "    " and resid 1138 and name HA  ))
 )(
   (( segid "    " and resid 1118 and name HA1 ))
 )
      5.000     5.000     0.000 peak  6342 weight  0.10000E+01 volume -0.12160E+01 ppm1      5.142 ppm2      4.537
 ASSI (
   (( segid "    " and resid 1138 and name HA  ))
 )(
   (( segid "    " and resid 1118 and name HA2 ))
 )
      5.000     5.000     0.000 peak  6344 weight  0.10000E+01 volume -0.74900E+00 ppm1      5.140 ppm2      3.839
 ASSI (
   (( segid "    " and resid 1138 and name HA  ))
 )(
   (( segid "    " and resid 1119 and name HN  ))
 )
      5.000     5.000     0.000 peak  6347 weight  0.10000E+01 volume -0.44700E+00 ppm1      5.139 ppm2      8.557
 ASSI (
   (( segid "    " and resid 1120 and name HB  ))
 )(
   (( segid "    " and resid 1120 and name HA  ))
 )
      5.000     5.000     0.000 peak  6581 weight  0.10000E+01 volume  0.11280E+01 ppm1      1.503 ppm2      4.731
 ASSI (
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )(
   (( segid "    " and resid 1120 and name HA  ))
 )
      5.000     5.000     0.000 peak  6406 weight  0.10000E+01 volume  0.12980E+01 ppm1      0.106 ppm2      4.734
 ASSI (
   (( segid "    " and resid 1136 and name HA  ))
 )(
   (( segid "    " and resid 1120 and name HA  ))
 )
      3.300     3.300     0.000 peak  6444 weight  0.10000E+01 volume -0.17670E+01 ppm1      4.994 ppm2      4.733
 ASSI (
   (( segid "    " and resid 1136 and name HA  ))
 )(
   (( segid "    " and resid 1120 and name HB  ))
 )
      6.000     6.000     0.000 peak  6442 weight  0.10000E+01 volume -0.37000E+00 ppm1      4.994 ppm2      1.513
 ASSI (
   (( segid "    " and resid 1120 and name HB  ))
 )(
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )
      5.000     5.000     0.000 peak  9178 weight  0.10000E+01 volume  0.11080E+01 ppm1      1.502 ppm2      0.502
 ASSI (
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )(
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )
      3.300     3.300     0.000 peak  6412 weight  0.10000E+01 volume  0.28440E+01 ppm1      0.107 ppm2      0.495
 ASSI (
   (( segid "    " and resid 1124 and name HA  ))
 )(
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )
      5.000     5.000     0.000 peak  7069 weight  0.10000E+01 volume -0.84900E+00 ppm1      4.268 ppm2      0.502
 ASSI (
   (( segid "    " and resid 1124 and name HB2 ))
 )(
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )
      6.000     6.000     0.000 peak  9149 weight  0.10000E+01 volume  0.29300E+00 ppm1      1.896 ppm2      0.498
 ASSI (
   (( segid "    " and resid 1124 and name HD1 ))
 )(
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )
      6.000     6.000     0.000 peak  9485 weight  0.10000E+01 volume -0.23800E+00 ppm1      3.738 ppm2      0.495
 ASSI (
   (( segid "    " and resid 1124 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG1 ))
 )(
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )
      5.000     5.000     0.000 peak  9492 weight  0.10000E+01 volume  0.52200E+00 ppm1      1.878 ppm2      0.500
 ASSI (
   (( segid "    " and resid 1120 and name HG12))
 )(
   (( segid "    " and resid 1120 and name HG11))
 )
      3.300     3.300     0.000 peak  9500 weight  0.10000E+01 volume  0.23070E+01 ppm1      0.758 ppm2      1.415
 ASSI (
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )(
   (( segid "    " and resid 1120 and name HG11))
 )
      5.000     5.000     0.000 peak  7768 weight  0.10000E+01 volume  0.52800E+00 ppm1      0.099 ppm2      1.406
 ASSI (
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )(
   (( segid "    " and resid 1120 and name HG12))
 )
      5.000     5.000     0.000 peak  7772 weight  0.10000E+01 volume  0.54600E+00 ppm1      0.100 ppm2      0.770
 ASSI (
   (( segid "    " and resid 1119 and name HA  ))
 )(
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      5.000     5.000     0.000 peak  6398 weight  0.10000E+01 volume -0.47300E+00 ppm1      5.002 ppm2      0.103
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      2.700     2.700     0.000 peak  7085 weight  0.10000E+01 volume  0.44180E+01 ppm1      0.500 ppm2      0.104
 ASSI (
   (( segid "    " and resid 1136 and name HA  ))
 )(
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      5.000     5.000     0.000 peak  6440 weight  0.10000E+01 volume -0.52200E+00 ppm1      4.993 ppm2      0.107
 ASSI (
   (( segid "    " and resid 1119 and name HA  ))
 )(
   (( segid "    " and resid 1120 and name HN  ))
 )
      2.700     2.700     0.000 peak  6387 weight  0.10000E+01 volume -0.47420E+01 ppm1      5.006 ppm2      8.526
 ASSI (
   (( segid "    " and resid 1120 and name HB  ))
 )(
   (( segid "    " and resid 1120 and name HN  ))
 )
      6.000     6.000     0.000 peak  9183 weight  0.10000E+01 volume  0.32500E+00 ppm1      1.503 ppm2      8.520
 ASSI (
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )(
   (( segid "    " and resid 1120 and name HN  ))
 )
      5.000     5.000     0.000 peak  6401 weight  0.10000E+01 volume  0.95700E+00 ppm1      0.105 ppm2      8.518
 ASSI (
   (( segid "    " and resid 1121 and name HB  ))
 )(
   (( segid "    " and resid 1121 and name HA  ))
 )
      3.300     3.300     0.000 peak  7097 weight  0.10000E+01 volume -0.23830E+01 ppm1      4.432 ppm2      4.159
 ASSI (
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )(
   (( segid "    " and resid 1121 and name HA  ))
 )
      3.300     3.300     0.000 peak  6460 weight  0.10000E+01 volume  0.16680E+01 ppm1      0.967 ppm2      4.155
 ASSI (
   (( segid "    " and resid 1121 and name HB  ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      2.700     2.700     0.000 peak  7100 weight  0.10000E+01 volume -0.34180E+01 ppm1      4.430 ppm2      0.976
 ASSI (
   (( segid "    " and resid 1135 and name HG2 ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      6.000     6.000     0.000 peak  9493 weight  0.10000E+01 volume  0.22800E+00 ppm1      2.063 ppm2      0.962
 ASSI (
   (( segid "    " and resid 1136 and name HA  ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      5.000     5.000     0.000 peak  6441 weight  0.10000E+01 volume -0.43500E+00 ppm1      4.992 ppm2      0.978
 ASSI (
   (( segid "    " and resid 1137 and name HG2 ))
  OR 
   (( segid "    " and resid 1137 and name HG1 ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      5.000     5.000     0.000 peak  9176 weight  0.10000E+01 volume  0.53300E+00 ppm1      2.240 ppm2      0.973
 ASSI (
   (( segid "    " and resid 1120 and name HA  ))
 )(
   (( segid "    " and resid 1121 and name HN  ))
 )
      3.300     3.300     0.000 peak  6571 weight  0.10000E+01 volume -0.16810E+01 ppm1      4.737 ppm2      8.273
 ASSI (
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )(
   (( segid "    " and resid 1121 and name HN  ))
 )
      5.000     5.000     0.000 peak  6402 weight  0.10000E+01 volume  0.78400E+00 ppm1      0.106 ppm2      8.273
 ASSI (
   (( segid "    " and resid 1121 and name HA  ))
 )(
   (( segid "    " and resid 1121 and name HN  ))
 )
      5.000     5.000     0.000 peak  7096 weight  0.10000E+01 volume -0.15300E+01 ppm1      4.159 ppm2      8.272
 ASSI (
   (( segid "    " and resid 1121 and name HB  ))
 )(
   (( segid "    " and resid 1121 and name HN  ))
 )
      5.000     5.000     0.000 peak  7099 weight  0.10000E+01 volume -0.46400E+00 ppm1      4.435 ppm2      8.279
 ASSI (
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )(
   (( segid "    " and resid 1121 and name HN  ))
 )
      3.300     3.300     0.000 peak  6461 weight  0.10000E+01 volume  0.16670E+01 ppm1      0.968 ppm2      8.272
 ASSI (
   (( segid "    " and resid 1136 and name HA  ))
 )(
   (( segid "    " and resid 1121 and name HN  ))
 )
      5.000     5.000     0.000 peak  6446 weight  0.10000E+01 volume -0.59200E+00 ppm1      4.993 ppm2      8.272
 ASSI (
   (( segid "    " and resid 1122 and name HB1 ))
 )(
   (( segid "    " and resid 1122 and name HA  ))
 )
      3.300     3.300     0.000 peak  9169 weight  0.10000E+01 volume -0.21200E+01 ppm1      3.969 ppm2      4.641
 ASSI (
   (( segid "    " and resid 1122 and name HB2 ))
 )(
   (( segid "    " and resid 1122 and name HA  ))
 )
      3.300     3.300     0.000 peak  9170 weight  0.10000E+01 volume -0.24130E+01 ppm1      3.830 ppm2      4.642
 ASSI (
   (( segid "    " and resid 1121 and name HA  ))
 )(
   (( segid "    " and resid 1122 and name HN  ))
 )
      5.000     5.000     0.000 peak  7095 weight  0.10000E+01 volume -0.53300E+00 ppm1      4.159 ppm2      7.078
 ASSI (
   (( segid "    " and resid 1123 and name HB1 ))
 )(
   (( segid "    " and resid 1123 and name HA  ))
 )
      5.000     5.000     0.000 peak  9154 weight  0.10000E+01 volume  0.14680E+01 ppm1      3.068 ppm2      4.686
 ASSI (
   (( segid "    " and resid 1123 and name HB2 ))
 )(
   (( segid "    " and resid 1123 and name HA  ))
 )
      3.300     3.300     0.000 peak  9155 weight  0.10000E+01 volume  0.18620E+01 ppm1      3.032 ppm2      4.686
 ASSI (
   (( segid "    " and resid 1124 and name HD1 ))
 )(
   (( segid "    " and resid 1123 and name HA  ))
 )
      3.300     3.300     0.000 peak  9483 weight  0.10000E+01 volume -0.25220E+01 ppm1      3.736 ppm2      4.687
 ASSI (
   (( segid "    " and resid 1124 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG1 ))
 )(
   (( segid "    " and resid 1123 and name HA  ))
 )
      5.000     5.000     0.000 peak  7090 weight  0.10000E+01 volume  0.55900E+00 ppm1      1.874 ppm2      4.683
 ASSI (
   (( segid "    " and resid 1123 and name HA  ))
 )(
   (( segid "    " and resid 1123 and name HB2 ))
  OR 
   (( segid "    " and resid 1123 and name HB1 ))
 )
      2.700     2.700     0.000 peak  7058 weight  0.10000E+01 volume -0.31070E+01 ppm1      4.686 ppm2      3.047
 ASSI (
   (( segid "    " and resid 1123 and name HD2 ))
  OR 
   (( segid "    " and resid 1123 and name HD1 ))
 )(
   (( segid "    " and resid 1123 and name HB2 ))
  OR 
   (( segid "    " and resid 1123 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9157 weight  0.10000E+01 volume -0.40000E+00 ppm1      7.262 ppm2      3.050
 ASSI (
   (( segid "    " and resid 1123 and name HB1 ))
 )(
   (( segid "    " and resid 1123 and name HD2 ))
  OR 
   (( segid "    " and resid 1123 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9159 weight  0.10000E+01 volume  0.67400E+00 ppm1      3.073 ppm2      7.261
 ASSI (
   (( segid "    " and resid 1123 and name HB2 ))
 )(
   (( segid "    " and resid 1123 and name HD2 ))
  OR 
   (( segid "    " and resid 1123 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9161 weight  0.10000E+01 volume  0.55800E+00 ppm1      3.030 ppm2      7.264
 ASSI (
   (( segid "    " and resid 1124 and name HD1 ))
 )(
   (( segid "    " and resid 1123 and name HD2 ))
  OR 
   (( segid "    " and resid 1123 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9484 weight  0.10000E+01 volume -0.14700E+00 ppm1      3.732 ppm2      7.265
 ASSI (
   (( segid "    " and resid 1123 and name HB1 ))
 )(
   (( segid "    " and resid 1123 and name HN  ))
 )
      3.300     3.300     0.000 peak  9163 weight  0.10000E+01 volume  0.19030E+01 ppm1      3.073 ppm2      8.301
 ASSI (
   (( segid "    " and resid 1123 and name HB2 ))
 )(
   (( segid "    " and resid 1123 and name HN  ))
 )
      3.300     3.300     0.000 peak  9162 weight  0.10000E+01 volume  0.16440E+01 ppm1      3.027 ppm2      8.304
 ASSI (
   (( segid "    " and resid 1124 and name HB1 ))
 )(
   (( segid "    " and resid 1124 and name HA  ))
 )
      5.000     5.000     0.000 peak  7086 weight  0.10000E+01 volume  0.71900E+00 ppm1      2.110 ppm2      4.264
 ASSI (
   (( segid "    " and resid 1124 and name HB2 ))
 )(
   (( segid "    " and resid 1124 and name HA  ))
 )
      5.000     5.000     0.000 peak  7087 weight  0.10000E+01 volume  0.53900E+00 ppm1      1.894 ppm2      4.263
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1124 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7078 weight  0.10000E+01 volume  0.64000E+00 ppm1      0.501 ppm2      2.109
 ASSI (
   (( segid "    " and resid 1124 and name HD1 ))
 )(
   (( segid "    " and resid 1124 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9482 weight  0.10000E+01 volume -0.41400E+00 ppm1      3.740 ppm2      2.089
 ASSI (
   (( segid "    " and resid 1124 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG1 ))
 )(
   (( segid "    " and resid 1124 and name HB1 ))
 )
      3.300     3.300     0.000 peak  7091 weight  0.10000E+01 volume  0.27330E+01 ppm1      1.870 ppm2      2.107
 ASSI (
   (( segid "    " and resid 1124 and name HD2 ))
 )(
   (( segid "    " and resid 1124 and name HD1 ))
 )
      2.700     2.700     0.000 peak  9165 weight  0.10000E+01 volume -0.39690E+01 ppm1      2.977 ppm2      3.742
 ASSI (
   (( segid "    " and resid 1124 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG1 ))
 )(
   (( segid "    " and resid 1124 and name HD1 ))
 )
      3.300     3.300     0.000 peak  9489 weight  0.10000E+01 volume  0.17730E+01 ppm1      1.873 ppm2      3.744
 ASSI (
   (( segid "    " and resid 1124 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG1 ))
 )(
   (( segid "    " and resid 1124 and name HD2 ))
 )
      3.300     3.300     0.000 peak  9477 weight  0.10000E+01 volume  0.26780E+01 ppm1      1.873 ppm2      2.970
 ASSI (
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
 )(
   (( segid "    " and resid 1125 and name HA  ))
 )
      3.300     3.300     0.000 peak  9481 weight  0.10000E+01 volume  0.22460E+01 ppm1      0.880 ppm2      4.583
 ASSI (
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )(
   (( segid "    " and resid 1125 and name HD13))
  OR 
   (( segid "    " and resid 1125 and name HD12))
  OR 
   (( segid "    " and resid 1125 and name HD11))
 )
      6.000     6.000     0.000 peak  9118 weight  0.10000E+01 volume -0.34700E+00 ppm1      6.820 ppm2      0.701
 ASSI (
   (( segid "    " and resid 1124 and name HB2 ))
 )(
   (( segid "    " and resid 1125 and name HN  ))
 )
      6.000     6.000     0.000 peak  9153 weight  0.10000E+01 volume  0.30600E+00 ppm1      1.903 ppm2      7.737
 ASSI (
   (( segid "    " and resid 1111 and name HG1 ))
 )(
   (( segid "    " and resid 1126 and name HA  ))
 )
      5.000     5.000     0.000 peak  7241 weight  0.10000E+01 volume  0.62900E+00 ppm1      2.215 ppm2      4.382
 ASSI (
   (( segid "    " and resid 1111 and name HG2 ))
 )(
   (( segid "    " and resid 1126 and name HA  ))
 )
      5.000     5.000     0.000 peak  2617 weight  0.10000E+01 volume  0.67500E+00 ppm1      2.181 ppm2      4.383
 ASSI (
   (( segid "    " and resid 1126 and name HB2 ))
  OR 
   (( segid "    " and resid 1126 and name HB1 ))
 )(
   (( segid "    " and resid 1126 and name HA  ))
 )
      2.700     2.700     0.000 peak  9057 weight  0.10000E+01 volume -0.67710E+01 ppm1      3.903 ppm2      4.387
 ASSI (
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
 )(
   (( segid "    " and resid 1126 and name HB2 ))
  OR 
   (( segid "    " and resid 1126 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9472 weight  0.10000E+01 volume  0.29200E+00 ppm1      0.804 ppm2      3.912
 ASSI (
   (( segid "    " and resid 1127 and name HB  ))
 )(
   (( segid "    " and resid 1127 and name HA  ))
 )
      5.000     5.000     0.000 peak  6585 weight  0.10000E+01 volume  0.14760E+01 ppm1      1.878 ppm2      4.720
 ASSI (
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )(
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
  OR 
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )
      3.300     3.300     0.000 peak  9147 weight  0.10000E+01 volume  0.22330E+01 ppm1      1.551 ppm2      0.827
 ASSI (
   (( segid "    " and resid 1127 and name HB  ))
 )(
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
  OR 
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )
      2.700     2.700     0.000 peak  9125 weight  0.10000E+01 volume  0.38880E+01 ppm1      1.877 ppm2      0.829
 ASSI (
   (( segid "    " and resid 1126 and name HB2 ))
  OR 
   (( segid "    " and resid 1126 and name HB1 ))
 )(
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )
      5.000     5.000     0.000 peak  7968 weight  0.10000E+01 volume -0.15090E+01 ppm1      3.901 ppm2      0.844
 ASSI (
   (( segid "    " and resid 1125 and name HB1 ))
 )(
   (( segid "    " and resid 1127 and name HN  ))
 )
      5.000     5.000     0.000 peak  9139 weight  0.10000E+01 volume  0.43700E+00 ppm1      1.265 ppm2      6.984
 ASSI (
   (( segid "    " and resid 1126 and name HA  ))
 )(
   (( segid "    " and resid 1127 and name HN  ))
 )
      5.000     5.000     0.000 peak  3561 weight  0.10000E+01 volume -0.46100E+00 ppm1      4.392 ppm2      6.996
 ASSI (
   (( segid "    " and resid 1127 and name HA  ))
 )(
   (( segid "    " and resid 1127 and name HN  ))
 )
      5.000     5.000     0.000 peak  6583 weight  0.10000E+01 volume -0.66300E+00 ppm1      4.718 ppm2      6.985
 ASSI (
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )(
   (( segid "    " and resid 1127 and name HN  ))
 )
      6.000     6.000     0.000 peak  9464 weight  0.10000E+01 volume  0.39000E+00 ppm1      0.854 ppm2      6.988
 ASSI (
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
 )(
   (( segid "    " and resid 1127 and name HN  ))
 )
      5.000     5.000     0.000 peak  9474 weight  0.10000E+01 volume  0.46200E+00 ppm1      0.805 ppm2      6.985
 ASSI (
   (( segid "    " and resid 1128 and name HA  ))
 )(
   (( segid "    " and resid 1128 and name HB1 ))
 )
      5.000     5.000     0.000 peak  1863 weight  0.10000E+01 volume -0.62900E+00 ppm1      4.579 ppm2      2.966
 ASSI (
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )(
   (( segid "    " and resid 1128 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9113 weight  0.10000E+01 volume -0.28300E+00 ppm1      7.115 ppm2      2.956
 ASSI (
   (( segid "    " and resid 1157 and name HZ2 ))
 )(
   (( segid "    " and resid 1128 and name HB1 ))
 )
      6.000     6.000     0.000 peak  2132 weight  0.10000E+01 volume  0.24200E+00 ppm1      6.543 ppm2      2.943
 ASSI (
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )(
   (( segid "    " and resid 1128 and name HB2 ))
 )
      6.000     6.000     0.000 peak  9114 weight  0.10000E+01 volume -0.19100E+00 ppm1      7.124 ppm2      2.505
 ASSI (
   (( segid "    " and resid 1112 and name HD1 ))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7295 weight  0.10000E+01 volume -0.22300E+00 ppm1      3.537 ppm2      7.116
 ASSI (
   (( segid "    " and resid 1127 and name HA  ))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6582 weight  0.10000E+01 volume -0.32900E+00 ppm1      4.717 ppm2      7.115
 ASSI (
   (( segid "    " and resid 1128 and name HA  ))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7033 weight  0.10000E+01 volume -0.52900E+00 ppm1      4.575 ppm2      7.113
 ASSI (
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8108 weight  0.10000E+01 volume -0.12000E+01 ppm1      6.820 ppm2      7.123
 ASSI (
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9053 weight  0.10000E+01 volume  0.25900E+00 ppm1      0.578 ppm2      7.111
 ASSI (
   (( segid "    " and resid 1111 and name HB1 ))
 )(
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )
      6.000     6.000     0.000 peak  7260 weight  0.10000E+01 volume  0.27000E+00 ppm1      2.522 ppm2      6.818
 ASSI (
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )(
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )
      5.000     5.000     0.000 peak  9109 weight  0.10000E+01 volume -0.63800E+00 ppm1      7.114 ppm2      6.818
 ASSI (
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )(
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )
      5.000     5.000     0.000 peak  9052 weight  0.10000E+01 volume  0.10500E+01 ppm1      0.578 ppm2      6.818
 ASSI (
   (( segid "    " and resid 1127 and name HB  ))
 )(
   (( segid "    " and resid 1128 and name HN  ))
 )
      6.000     6.000     0.000 peak  9127 weight  0.10000E+01 volume  0.33000E+00 ppm1      1.878 ppm2      8.957
 ASSI (
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )(
   (( segid "    " and resid 1128 and name HN  ))
 )
      5.000     5.000     0.000 peak  9466 weight  0.10000E+01 volume  0.40500E+00 ppm1      0.849 ppm2      8.961
 ASSI (
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
 )(
   (( segid "    " and resid 1128 and name HN  ))
 )
      5.000     5.000     0.000 peak  9470 weight  0.10000E+01 volume  0.52800E+00 ppm1      0.803 ppm2      8.959
 ASSI (
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
 )(
   (( segid "    " and resid 1129 and name HA  ))
 )
      2.700     2.700     0.000 peak  7027 weight  0.10000E+01 volume  0.31960E+01 ppm1      1.387 ppm2      4.351
 ASSI (
   (( segid "    " and resid 1130 and name HD1 ))
 )(
   (( segid "    " and resid 1129 and name HA  ))
 )
      3.300     3.300     0.000 peak  7023 weight  0.10000E+01 volume -0.16780E+01 ppm1      3.653 ppm2      4.348
 ASSI (
   (( segid "    " and resid 1130 and name HD2 ))
 )(
   (( segid "    " and resid 1129 and name HA  ))
 )
      3.300     3.300     0.000 peak  7024 weight  0.10000E+01 volume -0.20100E+01 ppm1      3.403 ppm2      4.348
 ASSI (
   (( segid "    " and resid 1130 and name HG2 ))
 )(
   (( segid "    " and resid 1129 and name HA  ))
 )
      5.000     5.000     0.000 peak  7026 weight  0.10000E+01 volume  0.46900E+00 ppm1      1.903 ppm2      4.337
 ASSI (
   (( segid "    " and resid 1130 and name HD1 ))
 )(
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
 )
      3.300     3.300     0.000 peak  9101 weight  0.10000E+01 volume -0.18180E+01 ppm1      3.656 ppm2      1.389
 ASSI (
   (( segid "    " and resid 1130 and name HD2 ))
 )(
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9102 weight  0.10000E+01 volume -0.13470E+01 ppm1      3.404 ppm2      1.389
 ASSI (
   (( segid "    " and resid 1130 and name HG1 ))
 )(
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9103 weight  0.10000E+01 volume  0.48400E+00 ppm1      2.029 ppm2      1.383
 ASSI (
   (( segid "    " and resid 1130 and name HG2 ))
 )(
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9104 weight  0.10000E+01 volume  0.76700E+00 ppm1      1.905 ppm2      1.383
 ASSI (
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
 )(
   (( segid "    " and resid 1129 and name HN  ))
 )
      3.300     3.300     0.000 peak  9098 weight  0.10000E+01 volume  0.29570E+01 ppm1      1.385 ppm2      8.330
 ASSI (
   (( segid "    " and resid 1130 and name HG1 ))
 )(
   (( segid "    " and resid 1130 and name HA  ))
 )
      6.000     6.000     0.000 peak  9454 weight  0.10000E+01 volume  0.35300E+00 ppm1      2.029 ppm2      3.969
 ASSI (
   (( segid "    " and resid 1130 and name HG2 ))
 )(
   (( segid "    " and resid 1130 and name HA  ))
 )
      5.000     5.000     0.000 peak  9455 weight  0.10000E+01 volume  0.56200E+00 ppm1      1.900 ppm2      3.963
 ASSI (
   (( segid "    " and resid 1130 and name HA  ))
 )(
   (( segid "    " and resid 1130 and name HB1 ))
 )
      3.300     3.300     0.000 peak  7010 weight  0.10000E+01 volume -0.22020E+01 ppm1      3.961 ppm2      2.294
 ASSI (
   (( segid "    " and resid 1130 and name HG1 ))
 )(
   (( segid "    " and resid 1130 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9456 weight  0.10000E+01 volume  0.15140E+01 ppm1      2.027 ppm2      2.285
 ASSI (
   (( segid "    " and resid 1130 and name HG2 ))
 )(
   (( segid "    " and resid 1130 and name HB1 ))
 )
      3.300     3.300     0.000 peak  9457 weight  0.10000E+01 volume  0.16060E+01 ppm1      1.899 ppm2      2.285
 ASSI (
   (( segid "    " and resid 1107 and name HA1 ))
 )(
   (( segid "    " and resid 1130 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9246 weight  0.10000E+01 volume -0.42300E+00 ppm1      3.805 ppm2      1.894
 ASSI (
   (( segid "    " and resid 1130 and name HA  ))
 )(
   (( segid "    " and resid 1130 and name HB2 ))
 )
      3.300     3.300     0.000 peak  7011 weight  0.10000E+01 volume -0.16500E+01 ppm1      3.960 ppm2      1.893
 ASSI (
   (( segid "    " and resid 1130 and name HG1 ))
 )(
   (( segid "    " and resid 1130 and name HD2 ))
 )
      5.000     5.000     0.000 peak  9449 weight  0.10000E+01 volume  0.98700E+00 ppm1      2.031 ppm2      3.412
 ASSI (
   (( segid "    " and resid 1130 and name HG2 ))
 )(
   (( segid "    " and resid 1130 and name HD2 ))
 )
      5.000     5.000     0.000 peak  9451 weight  0.10000E+01 volume  0.10630E+01 ppm1      1.899 ppm2      3.412
 ASSI (
   (( segid "    " and resid 1130 and name HD1 ))
 )(
   (( segid "    " and resid 1130 and name HG1 ))
 )
      3.300     3.300     0.000 peak  9655 weight  0.10000E+01 volume -0.20500E+01 ppm1      3.660 ppm2      2.025
 ASSI (
   (( segid "    " and resid 1130 and name HD1 ))
 )(
   (( segid "    " and resid 1130 and name HG2 ))
 )
      3.300     3.300     0.000 peak  9654 weight  0.10000E+01 volume -0.25040E+01 ppm1      3.659 ppm2      1.896
 ASSI (
   (( segid "    " and resid 1131 and name HB3 ))
  OR 
   (( segid "    " and resid 1131 and name HB2 ))
  OR 
   (( segid "    " and resid 1131 and name HB1 ))
 )(
   (( segid "    " and resid 1131 and name HA  ))
 )
      2.700     2.700     0.000 peak  7006 weight  0.10000E+01 volume  0.36760E+01 ppm1      1.615 ppm2      3.811
 ASSI (
   (( segid "    " and resid 1131 and name HB3 ))
  OR 
   (( segid "    " and resid 1131 and name HB2 ))
  OR 
   (( segid "    " and resid 1131 and name HB1 ))
 )(
   (( segid "    " and resid 1131 and name HN  ))
 )
      5.000     5.000     0.000 peak  7007 weight  0.10000E+01 volume  0.70200E+00 ppm1      1.616 ppm2      9.011
 ASSI (
   (( segid "    " and resid 1132 and name HB1 ))
 )(
   (( segid "    " and resid 1132 and name HA  ))
 )
      5.000     5.000     0.000 peak  9067 weight  0.10000E+01 volume -0.11820E+01 ppm1      4.203 ppm2      4.560
 ASSI (
   (( segid "    " and resid 1132 and name HB2 ))
 )(
   (( segid "    " and resid 1132 and name HA  ))
 )
      5.000     5.000     0.000 peak  9069 weight  0.10000E+01 volume -0.95700E+00 ppm1      4.029 ppm2      4.556
 ASSI (
   (( segid "    " and resid 1131 and name HA  ))
 )(
   (( segid "    " and resid 1132 and name HN  ))
 )
      5.000     5.000     0.000 peak  7002 weight  0.10000E+01 volume -0.41700E+00 ppm1      3.809 ppm2      7.860
 ASSI (
   (( segid "    " and resid 1132 and name HB1 ))
 )(
   (( segid "    " and resid 1132 and name HN  ))
 )
      5.000     5.000     0.000 peak  9076 weight  0.10000E+01 volume -0.41700E+00 ppm1      4.205 ppm2      7.858
 ASSI (
   (( segid "    " and resid 1152 and name HB1 ))
 )(
   (( segid "    " and resid 1132 and name HN  ))
 )
      6.000     6.000     0.000 peak  8846 weight  0.10000E+01 volume  0.29900E+00 ppm1      2.328 ppm2      7.860
 ASSI (
   (( segid "    " and resid 1133 and name HB1 ))
 )(
   (( segid "    " and resid 1133 and name HA  ))
 )
      5.000     5.000     0.000 peak  6240 weight  0.10000E+01 volume -0.12850E+01 ppm1      3.822 ppm2      6.022
 ASSI (
   (( segid "    " and resid 1133 and name HB2 ))
 )(
   (( segid "    " and resid 1133 and name HA  ))
 )
      5.000     5.000     0.000 peak  6239 weight  0.10000E+01 volume -0.11380E+01 ppm1      3.755 ppm2      6.022
 ASSI (
   (( segid "    " and resid 1151 and name HA  ))
 )(
   (( segid "    " and resid 1133 and name HA  ))
 )
      5.000     5.000     0.000 peak  6236 weight  0.10000E+01 volume -0.82200E+00 ppm1      5.437 ppm2      6.022
 ASSI (
   (( segid "    " and resid 1151 and name HA  ))
 )(
   (( segid "    " and resid 1133 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6258 weight  0.10000E+01 volume -0.35500E+00 ppm1      5.433 ppm2      3.820
 ASSI (
   (( segid "    " and resid 1132 and name HA  ))
 )(
   (( segid "    " and resid 1133 and name HN  ))
 )
      2.700     2.700     0.000 peak  9064 weight  0.10000E+01 volume -0.39390E+01 ppm1      4.566 ppm2      8.483
 ASSI (
   (( segid "    " and resid 1132 and name HB1 ))
 )(
   (( segid "    " and resid 1133 and name HN  ))
 )
      5.000     5.000     0.000 peak  9078 weight  0.10000E+01 volume -0.59200E+00 ppm1      4.205 ppm2      8.486
 ASSI (
   (( segid "    " and resid 1132 and name HB2 ))
 )(
   (( segid "    " and resid 1133 and name HN  ))
 )
      5.000     5.000     0.000 peak  9079 weight  0.10000E+01 volume -0.56500E+00 ppm1      4.031 ppm2      8.487
 ASSI (
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )(
   (( segid "    " and resid 1134 and name HA  ))
 )
      5.000     5.000     0.000 peak  7765 weight  0.10000E+01 volume  0.40300E+00 ppm1      0.102 ppm2      4.384
 ASSI (
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )(
   (( segid "    " and resid 1134 and name HB  ))
 )
      2.700     2.700     0.000 peak  8966 weight  0.10000E+01 volume  0.31730E+01 ppm1      0.577 ppm2      1.571
 ASSI (
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )(
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )
      5.000     5.000     0.000 peak  6411 weight  0.10000E+01 volume  0.13170E+01 ppm1      0.105 ppm2      0.584
 ASSI (
   (( segid "    " and resid 1134 and name HA  ))
 )(
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )
      3.300     3.300     0.000 peak  3526 weight  0.10000E+01 volume -0.16540E+01 ppm1      4.390 ppm2      0.583
 ASSI (
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )(
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )
      2.700     2.700     0.000 peak  7770 weight  0.10000E+01 volume  0.36750E+01 ppm1      0.099 ppm2      0.584
 ASSI (
   (( segid "    " and resid 1134 and name HB  ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )
      3.300     3.300     0.000 peak  8173 weight  0.10000E+01 volume  0.16020E+01 ppm1      1.578 ppm2      0.101
 ASSI (
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )
      6.000     6.000     0.000 peak  8858 weight  0.10000E+01 volume  0.20500E+00 ppm1      0.755 ppm2      0.101
 ASSI (
   (( segid "    " and resid 1135 and name HA  ))
 )(
   (( segid "    " and resid 1135 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6280 weight  0.10000E+01 volume -0.73700E+00 ppm1      5.357 ppm2      1.849
 ASSI (
   (( segid "    " and resid 1135 and name HA  ))
 )(
   (( segid "    " and resid 1135 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6281 weight  0.10000E+01 volume -0.10780E+01 ppm1      5.358 ppm2      1.736
 ASSI (
   (( segid "    " and resid 1149 and name HA  ))
 )(
   (( segid "    " and resid 1135 and name HG2 ))
 )
      5.000     5.000     0.000 peak  6267 weight  0.10000E+01 volume -0.43900E+00 ppm1      5.394 ppm2      2.068
 ASSI (
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )(
   (( segid "    " and resid 1136 and name HA  ))
 )
      5.000     5.000     0.000 peak  6451 weight  0.10000E+01 volume  0.51700E+00 ppm1      2.454 ppm2      4.990
 ASSI (
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )(
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9048 weight  0.10000E+01 volume  0.12560E+01 ppm1      0.195 ppm2      2.459
 ASSI (
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )(
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7694 weight  0.10000E+01 volume -0.13640E+01 ppm1      6.599 ppm2      2.455
 ASSI (
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7703 weight  0.10000E+01 volume  0.10270E+01 ppm1      0.199 ppm2      6.598
 ASSI (
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7705 weight  0.10000E+01 volume  0.34200E+00 ppm1      0.438 ppm2      6.599
 ASSI (
   (( segid "    " and resid 1119 and name HA  ))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6389 weight  0.10000E+01 volume -0.24400E+00 ppm1      5.007 ppm2      6.597
 ASSI (
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6404 weight  0.10000E+01 volume  0.34700E+00 ppm1      0.106 ppm2      6.585
 ASSI (
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7702 weight  0.10000E+01 volume  0.20600E+00 ppm1      0.101 ppm2      6.585
 ASSI (
   (( segid "    " and resid 1135 and name HA  ))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6276 weight  0.10000E+01 volume -0.28700E+00 ppm1      5.356 ppm2      6.600
 ASSI (
   (( segid "    " and resid 1136 and name HA  ))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6445 weight  0.10000E+01 volume -0.30300E+00 ppm1      4.997 ppm2      6.606
 ASSI (
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      3.300     3.300     0.000 peak  7709 weight  0.10000E+01 volume -0.17910E+01 ppm1      6.434 ppm2      6.599
 ASSI (
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7706 weight  0.10000E+01 volume  0.29600E+00 ppm1      0.759 ppm2      6.605
 ASSI (
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )(
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )
      5.000     5.000     0.000 peak  8893 weight  0.10000E+01 volume  0.55800E+00 ppm1      0.435 ppm2      6.437
 ASSI (
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )(
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )
      5.000     5.000     0.000 peak  6405 weight  0.10000E+01 volume  0.41300E+00 ppm1      0.106 ppm2      6.436
 ASSI (
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )(
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )
      6.000     6.000     0.000 peak  7737 weight  0.10000E+01 volume  0.37500E+00 ppm1      0.101 ppm2      6.432
 ASSI (
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )(
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )
      5.000     5.000     0.000 peak  7692 weight  0.10000E+01 volume -0.14010E+01 ppm1      6.601 ppm2      6.441
 ASSI (
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )(
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )
      5.000     5.000     0.000 peak  7707 weight  0.10000E+01 volume  0.65700E+00 ppm1      0.758 ppm2      6.438
 ASSI (
   (( segid "    " and resid 1136 and name HA  ))
 )(
   (( segid "    " and resid 1136 and name HN  ))
 )
      5.000     5.000     0.000 peak  6447 weight  0.10000E+01 volume -0.42600E+00 ppm1      4.994 ppm2      8.383
 ASSI (
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )(
   (( segid "    " and resid 1136 and name HN  ))
 )
      5.000     5.000     0.000 peak  6453 weight  0.10000E+01 volume  0.46800E+00 ppm1      2.454 ppm2      8.378
 ASSI (
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )(
   (( segid "    " and resid 1136 and name HN  ))
 )
      5.000     5.000     0.000 peak  7689 weight  0.10000E+01 volume -0.45100E+00 ppm1      6.600 ppm2      8.377
 ASSI (
   (( segid "    " and resid 1137 and name HB2 ))
 )(
   (( segid "    " and resid 1137 and name HA  ))
 )
      5.000     5.000     0.000 peak  9044 weight  0.10000E+01 volume  0.89500E+00 ppm1      1.796 ppm2      4.526
 ASSI (
   (( segid "    " and resid 1138 and name HB2 ))
 )(
   (( segid "    " and resid 1137 and name HA  ))
 )
      6.000     6.000     0.000 peak  9039 weight  0.10000E+01 volume  0.27800E+00 ppm1      2.535 ppm2      4.543
 ASSI (
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )(
   (( segid "    " and resid 1137 and name HA  ))
 )
      5.000     5.000     0.000 peak  8529 weight  0.10000E+01 volume  0.77700E+00 ppm1      0.759 ppm2      4.528
 ASSI (
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )(
   (( segid "    " and resid 1137 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6465 weight  0.10000E+01 volume  0.16290E+01 ppm1      0.969 ppm2      1.891
 ASSI (
   (( segid "    " and resid 1137 and name HA  ))
 )(
   (( segid "    " and resid 1137 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6965 weight  0.10000E+01 volume -0.17400E+01 ppm1      4.529 ppm2      1.897
 ASSI (
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )(
   (( segid "    " and resid 1137 and name HB2 ))
 )
      3.300     3.300     0.000 peak  6466 weight  0.10000E+01 volume  0.20590E+01 ppm1      0.970 ppm2      1.786
 ASSI (
   (( segid "    " and resid 1120 and name HA  ))
 )(
   (( segid "    " and resid 1137 and name HN  ))
 )
      5.000     5.000     0.000 peak  6574 weight  0.10000E+01 volume -0.58300E+00 ppm1      4.740 ppm2      8.792
 ASSI (
   (( segid "    " and resid 1142 and name HB2 ))
 )(
   (( segid "    " and resid 1138 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8982 weight  0.10000E+01 volume  0.30200E+00 ppm1      2.269 ppm2      2.970
 ASSI (
   (( segid "    " and resid 1138 and name HA  ))
 )(
   (( segid "    " and resid 1138 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6349 weight  0.10000E+01 volume -0.67200E+00 ppm1      5.138 ppm2      2.548
 ASSI (
   (( segid "    " and resid 1139 and name HG1 ))
 )(
   (( segid "    " and resid 1139 and name HA  ))
 )
      5.000     5.000     0.000 peak  9032 weight  0.10000E+01 volume  0.93900E+00 ppm1      2.286 ppm2      4.111
 ASSI (
   (( segid "    " and resid 1139 and name HG2 ))
 )(
   (( segid "    " and resid 1139 and name HA  ))
 )
      5.000     5.000     0.000 peak  9033 weight  0.10000E+01 volume  0.67400E+00 ppm1      2.167 ppm2      4.108
 ASSI (
   (( segid "    " and resid 1140 and name HA  ))
 )(
   (( segid "    " and resid 1139 and name HA  ))
 )
      5.000     5.000     0.000 peak  8272 weight  0.10000E+01 volume -0.49900E+00 ppm1      4.378 ppm2      4.111
 ASSI (
   (( segid "    " and resid 1140 and name HB1 ))
 )(
   (( segid "    " and resid 1139 and name HA  ))
 )
      5.000     5.000     0.000 peak  8156 weight  0.10000E+01 volume  0.47800E+00 ppm1      2.817 ppm2      4.108
 ASSI (
   (( segid "    " and resid 1140 and name HB2 ))
 )(
   (( segid "    " and resid 1139 and name HA  ))
 )
      6.000     6.000     0.000 peak  8157 weight  0.10000E+01 volume  0.37600E+00 ppm1      2.675 ppm2      4.105
 ASSI (
   (( segid "    " and resid 1139 and name HA  ))
 )(
   (( segid "    " and resid 1139 and name HB1 ))
 )
      3.300     3.300     0.000 peak  9022 weight  0.10000E+01 volume -0.18440E+01 ppm1      4.107 ppm2      1.926
 ASSI (
   (( segid "    " and resid 1139 and name HG1 ))
 )(
   (( segid "    " and resid 1139 and name HB1 ))
 )
      3.300     3.300     0.000 peak  9432 weight  0.10000E+01 volume  0.27640E+01 ppm1      2.285 ppm2      1.922
 ASSI (
   (( segid "    " and resid 1139 and name HG2 ))
 )(
   (( segid "    " and resid 1139 and name HB1 ))
 )
      3.300     3.300     0.000 peak  9431 weight  0.10000E+01 volume  0.19790E+01 ppm1      2.165 ppm2      1.924
 ASSI (
   (( segid "    " and resid 1139 and name HA  ))
 )(
   (( segid "    " and resid 1139 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9027 weight  0.10000E+01 volume -0.10820E+01 ppm1      4.106 ppm2      1.609
 ASSI (
   (( segid "    " and resid 1139 and name HG2 ))
 )(
   (( segid "    " and resid 1139 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9429 weight  0.10000E+01 volume  0.12800E+01 ppm1      2.164 ppm2      1.615
 ASSI (
   (( segid "    " and resid 1139 and name HG2 ))
 )(
   (( segid "    " and resid 1139 and name HE21))
 )
      6.000     6.000     0.000 peak  8793 weight  0.10000E+01 volume  0.37700E+00 ppm1      2.168 ppm2      7.394
 ASSI (
   (( segid "    " and resid 1139 and name HB1 ))
 )(
   (( segid "    " and resid 1139 and name HE22))
 )
      6.000     6.000     0.000 peak  9035 weight  0.10000E+01 volume  0.24500E+00 ppm1      1.930 ppm2      6.673
 ASSI (
   (( segid "    " and resid 1118 and name HA2 ))
 )(
   (( segid "    " and resid 1139 and name HN  ))
 )
      5.000     5.000     0.000 peak  7103 weight  0.10000E+01 volume -0.45400E+00 ppm1      3.837 ppm2      8.365
 ASSI (
   (( segid "    " and resid 1138 and name HB2 ))
 )(
   (( segid "    " and resid 1139 and name HN  ))
 )
      5.000     5.000     0.000 peak  9040 weight  0.10000E+01 volume  0.42900E+00 ppm1      2.536 ppm2      8.345
 ASSI (
   (( segid "    " and resid 1139 and name HA  ))
 )(
   (( segid "    " and resid 1139 and name HN  ))
 )
      5.000     5.000     0.000 peak  9030 weight  0.10000E+01 volume -0.84400E+00 ppm1      4.103 ppm2      8.344
 ASSI (
   (( segid "    " and resid 1139 and name HG1 ))
 )(
   (( segid "    " and resid 1139 and name HN  ))
 )
      5.000     5.000     0.000 peak  9434 weight  0.10000E+01 volume  0.45800E+00 ppm1      2.285 ppm2      8.356
 ASSI (
   (( segid "    " and resid 1139 and name HG2 ))
 )(
   (( segid "    " and resid 1139 and name HN  ))
 )
      5.000     5.000     0.000 peak  9435 weight  0.10000E+01 volume  0.56900E+00 ppm1      2.167 ppm2      8.356
 ASSI (
   (( segid "    " and resid 1140 and name HB1 ))
 )(
   (( segid "    " and resid 1140 and name HA  ))
 )
      3.300     3.300     0.000 peak  8158 weight  0.10000E+01 volume  0.16490E+01 ppm1      2.814 ppm2      4.381
 ASSI (
   (( segid "    " and resid 1140 and name HB2 ))
 )(
   (( segid "    " and resid 1140 and name HA  ))
 )
      5.000     5.000     0.000 peak  8159 weight  0.10000E+01 volume  0.15810E+01 ppm1      2.673 ppm2      4.381
 ASSI (
   (( segid "    " and resid 1141 and name HA  ))
 )(
   (( segid "    " and resid 1140 and name HA  ))
 )
      5.000     5.000     0.000 peak  8987 weight  0.10000E+01 volume -0.59300E+00 ppm1      3.691 ppm2      4.382
 ASSI (
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1140 and name HA  ))
 )
      5.000     5.000     0.000 peak  9018 weight  0.10000E+01 volume  0.50100E+00 ppm1      0.629 ppm2      4.376
 ASSI (
   (( segid "    " and resid 1140 and name HB1 ))
 )(
   (( segid "    " and resid 1140 and name HD21))
 )
      5.000     5.000     0.000 peak  8160 weight  0.10000E+01 volume  0.50300E+00 ppm1      2.814 ppm2      7.675
 ASSI (
   (( segid "    " and resid 1140 and name HB2 ))
 )(
   (( segid "    " and resid 1140 and name HD21))
 )
      5.000     5.000     0.000 peak  8161 weight  0.10000E+01 volume  0.97200E+00 ppm1      2.676 ppm2      7.674
 ASSI (
   (( segid "    " and resid 1139 and name HA  ))
 )(
   (( segid "    " and resid 1140 and name HN  ))
 )
      2.700     2.700     0.000 peak  9031 weight  0.10000E+01 volume -0.38960E+01 ppm1      4.106 ppm2      8.474
 ASSI (
   (( segid "    " and resid 1140 and name HA  ))
 )(
   (( segid "    " and resid 1140 and name HN  ))
 )
      3.300     3.300     0.000 peak  8274 weight  0.10000E+01 volume -0.20170E+01 ppm1      4.377 ppm2      8.463
 ASSI (
   (( segid "    " and resid 1141 and name HB2 ))
 )(
   (( segid "    " and resid 1141 and name HA  ))
 )
      5.000     5.000     0.000 peak  9004 weight  0.10000E+01 volume  0.46000E+00 ppm1      1.192 ppm2      3.699
 ASSI (
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1141 and name HA  ))
 )
      3.300     3.300     0.000 peak  9013 weight  0.10000E+01 volume  0.18310E+01 ppm1      0.630 ppm2      3.698
 ASSI (
   (( segid "    " and resid 1141 and name HA  ))
 )(
   (( segid "    " and resid 1141 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8991 weight  0.10000E+01 volume -0.56600E+00 ppm1      3.690 ppm2      2.085
 ASSI (
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1141 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9642 weight  0.10000E+01 volume  0.63400E+00 ppm1      0.630 ppm2      2.080
 ASSI (
   (( segid "    " and resid 1141 and name HG  ))
 )(
   (( segid "    " and resid 1141 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9009 weight  0.10000E+01 volume  0.69200E+00 ppm1      1.423 ppm2      2.087
 ASSI (
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1141 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9016 weight  0.10000E+01 volume  0.10610E+01 ppm1      0.630 ppm2      1.196
 ASSI (
   (( segid "    " and resid 1141 and name HA  ))
 )(
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )
      5.000     5.000     0.000 peak  8996 weight  0.10000E+01 volume -0.40400E+00 ppm1      3.692 ppm2      0.432
 ASSI (
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )(
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )
      6.000     6.000     0.000 peak  7675 weight  0.10000E+01 volume -0.21700E+00 ppm1      6.846 ppm2      0.430
 ASSI (
   (( segid "    " and resid 1141 and name HG  ))
 )(
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )
      3.300     3.300     0.000 peak  9010 weight  0.10000E+01 volume  0.17480E+01 ppm1      1.421 ppm2      0.632
 ASSI (
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )(
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )
      6.000     6.000     0.000 peak  7676 weight  0.10000E+01 volume -0.19200E+00 ppm1      6.847 ppm2      0.636
 ASSI (
   (( segid "    " and resid 1140 and name HB2 ))
 )(
   (( segid "    " and resid 1141 and name HG  ))
 )
      6.000     6.000     0.000 peak  8151 weight  0.10000E+01 volume  0.28700E+00 ppm1      2.672 ppm2      1.419
 ASSI (
   (( segid "    " and resid 1141 and name HA  ))
 )(
   (( segid "    " and resid 1141 and name HG  ))
 )
      5.000     5.000     0.000 peak  8994 weight  0.10000E+01 volume -0.59400E+00 ppm1      3.691 ppm2      1.428
 ASSI (
   (( segid "    " and resid 1140 and name HA  ))
 )(
   (( segid "    " and resid 1141 and name HN  ))
 )
      2.700     2.700     0.000 peak  8273 weight  0.10000E+01 volume -0.47120E+01 ppm1      4.381 ppm2      8.284
 ASSI (
   (( segid "    " and resid 1140 and name HB1 ))
 )(
   (( segid "    " and resid 1141 and name HN  ))
 )
      5.000     5.000     0.000 peak  9020 weight  0.10000E+01 volume  0.62600E+00 ppm1      2.816 ppm2      8.297
 ASSI (
   (( segid "    " and resid 1140 and name HB2 ))
 )(
   (( segid "    " and resid 1141 and name HN  ))
 )
      5.000     5.000     0.000 peak  9019 weight  0.10000E+01 volume  0.91000E+00 ppm1      2.673 ppm2      8.303
 ASSI (
   (( segid "    " and resid 1141 and name HA  ))
 )(
   (( segid "    " and resid 1141 and name HN  ))
 )
      3.300     3.300     0.000 peak  8988 weight  0.10000E+01 volume -0.16410E+01 ppm1      3.690 ppm2      8.291
 ASSI (
   (( segid "    " and resid 1138 and name HB2 ))
 )(
   (( segid "    " and resid 1142 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8985 weight  0.10000E+01 volume  0.41700E+00 ppm1      2.551 ppm2      3.426
 ASSI (
   (( segid "    " and resid 1142 and name HA  ))
 )(
   (( segid "    " and resid 1142 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8970 weight  0.10000E+01 volume -0.25300E+00 ppm1      4.369 ppm2      3.439
 ASSI (
   (( segid "    " and resid 1138 and name HB2 ))
 )(
   (( segid "    " and resid 1142 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9038 weight  0.10000E+01 volume  0.42400E+00 ppm1      2.540 ppm2      2.285
 ASSI (
   (( segid "    " and resid 1142 and name HA  ))
 )(
   (( segid "    " and resid 1142 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8971 weight  0.10000E+01 volume -0.45400E+00 ppm1      4.367 ppm2      2.274
 ASSI (
   (( segid "    " and resid 1139 and name HG1 ))
 )(
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8767 weight  0.10000E+01 volume  0.31700E+00 ppm1      2.282 ppm2      6.670
 ASSI (
   (( segid "    " and resid 1142 and name HA  ))
 )(
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8444 weight  0.10000E+01 volume -0.27500E+00 ppm1      4.369 ppm2      6.676
 ASSI (
   (( segid "    " and resid 1142 and name HE2 ))
  OR 
   (( segid "    " and resid 1142 and name HE1 ))
 )(
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7724 weight  0.10000E+01 volume -0.15220E+01 ppm1      6.196 ppm2      6.670
 ASSI (
   (( segid "    " and resid 1166 and name HD2 ))
 )(
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9569 weight  0.10000E+01 volume -0.23700E+00 ppm1      1.984 ppm2      6.660
 ASSI (
   (( segid "    " and resid 1142 and name HB1 ))
 )(
   (( segid "    " and resid 1142 and name HN  ))
 )
      5.000     5.000     0.000 peak  8978 weight  0.10000E+01 volume  0.48800E+00 ppm1      3.427 ppm2      8.452
 ASSI (
   (( segid "    " and resid 1143 and name HG2 ))
  OR 
   (( segid "    " and resid 1143 and name HG1 ))
 )(
   (( segid "    " and resid 1143 and name HE21))
 )
      5.000     5.000     0.000 peak  9426 weight  0.10000E+01 volume  0.62000E+00 ppm1      2.175 ppm2      7.457
 ASSI (
   (( segid "    " and resid 1193 and name HB  ))
 )(
   (( segid "    " and resid 1143 and name HG2 ))
  OR 
   (( segid "    " and resid 1143 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8240 weight  0.10000E+01 volume -0.40400E+00 ppm1      3.564 ppm2      2.189
 ASSI (
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )(
   (( segid "    " and resid 1143 and name HG2 ))
  OR 
   (( segid "    " and resid 1143 and name HG1 ))
 )
      5.000     5.000     0.000 peak  9307 weight  0.10000E+01 volume  0.69000E+00 ppm1      0.418 ppm2      2.184
 ASSI (
   (( segid "    " and resid 1144 and name HG  ))
 )(
   (( segid "    " and resid 1144 and name HA  ))
 )
      5.000     5.000     0.000 peak  8670 weight  0.10000E+01 volume  0.14930E+01 ppm1      1.342 ppm2      4.635
 ASSI (
   (( segid "    " and resid 1163 and name HA  ))
 )(
   (( segid "    " and resid 1144 and name HA  ))
 )
      5.000     5.000     0.000 peak  6382 weight  0.10000E+01 volume -0.93000E+00 ppm1      5.062 ppm2      4.629
 ASSI (
   (( segid "    " and resid 1144 and name HB1 ))
 )(
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )
      3.300     3.300     0.000 peak  8959 weight  0.10000E+01 volume  0.17280E+01 ppm1      1.614 ppm2      0.769
 ASSI (
   (( segid "    " and resid 1144 and name HB2 ))
 )(
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )
      3.300     3.300     0.000 peak  8958 weight  0.10000E+01 volume  0.19530E+01 ppm1      1.592 ppm2      0.771
 ASSI (
   (( segid "    " and resid 1148 and name HA  ))
 )(
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )
      5.000     5.000     0.000 peak  3276 weight  0.10000E+01 volume -0.14720E+01 ppm1      3.968 ppm2      0.769
 ASSI (
   (( segid "    " and resid 1148 and name HB1 ))
 )(
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )
      5.000     5.000     0.000 peak  8913 weight  0.10000E+01 volume  0.47000E+00 ppm1      2.123 ppm2      0.760
 ASSI (
   (( segid "    " and resid 1148 and name HB1 ))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      5.000     5.000     0.000 peak  8914 weight  0.10000E+01 volume  0.81400E+00 ppm1      2.121 ppm2      0.584
 ASSI (
   (( segid "    " and resid 1148 and name HG1 ))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      6.000     6.000     0.000 peak  3339 weight  0.10000E+01 volume  0.28700E+00 ppm1      1.579 ppm2      0.587
 ASSI (
   (( segid "    " and resid 1143 and name HA  ))
 )(
   (( segid "    " and resid 1144 and name HN  ))
 )
      3.300     3.300     0.000 peak  8967 weight  0.10000E+01 volume -0.27410E+01 ppm1      4.678 ppm2      8.578
 ASSI (
   (( segid "    " and resid 1143 and name HG2 ))
  OR 
   (( segid "    " and resid 1143 and name HG1 ))
 )(
   (( segid "    " and resid 1144 and name HN  ))
 )
      6.000     6.000     0.000 peak  9427 weight  0.10000E+01 volume  0.28100E+00 ppm1      2.173 ppm2      8.568
 ASSI (
   (( segid "    " and resid 1144 and name HB1 ))
 )(
   (( segid "    " and resid 1144 and name HN  ))
 )
      5.000     5.000     0.000 peak  8964 weight  0.10000E+01 volume  0.12170E+01 ppm1      1.616 ppm2      8.578
 ASSI (
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )(
   (( segid "    " and resid 1144 and name HN  ))
 )
      5.000     5.000     0.000 peak  8527 weight  0.10000E+01 volume  0.55100E+00 ppm1      0.758 ppm2      8.576
 ASSI (
   (( segid "    " and resid 1145 and name HB1 ))
 )(
   (( segid "    " and resid 1145 and name HA  ))
 )
      5.000     5.000     0.000 peak  8666 weight  0.10000E+01 volume  0.71000E+00 ppm1      1.963 ppm2      4.697
 ASSI (
   (( segid "    " and resid 1164 and name HG  ))
 )(
   (( segid "    " and resid 1145 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8657 weight  0.10000E+01 volume  0.84000E+00 ppm1      0.636 ppm2      1.791
 ASSI (
   (( segid "    " and resid 1163 and name HA  ))
 )(
   (( segid "    " and resid 1145 and name HN  ))
 )
      5.000     5.000     0.000 peak  6385 weight  0.10000E+01 volume -0.56000E+00 ppm1      5.064 ppm2      9.414
 ASSI (
   (( segid "    " and resid 1145 and name HA  ))
 )(
   (( segid "    " and resid 1146 and name HN  ))
 )
      2.700     2.700     0.000 peak  8950 weight  0.10000E+01 volume -0.35110E+01 ppm1      4.701 ppm2      8.534
 ASSI (
   (( segid "    " and resid 1147 and name HB2 ))
 )(
   (( segid "    " and resid 1147 and name HA  ))
 )
      3.300     3.300     0.000 peak  8923 weight  0.10000E+01 volume  0.17730E+01 ppm1      2.750 ppm2      4.557
 ASSI (
   (( segid "    " and resid 1147 and name HA  ))
 )(
   (( segid "    " and resid 1147 and name HB1 ))
 )
      3.300     3.300     0.000 peak  7047 weight  0.10000E+01 volume -0.21360E+01 ppm1      4.555 ppm2      2.932
 ASSI (
   (( segid "    " and resid 1147 and name HB1 ))
 )(
   (( segid "    " and resid 1147 and name HN  ))
 )
      5.000     5.000     0.000 peak  8916 weight  0.10000E+01 volume  0.81000E+00 ppm1      2.936 ppm2      8.354
 ASSI (
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )(
   (( segid "    " and resid 1148 and name HA  ))
 )
      5.000     5.000     0.000 peak  8524 weight  0.10000E+01 volume  0.79900E+00 ppm1      0.760 ppm2      3.975
 ASSI (
   (( segid "    " and resid 1148 and name HG1 ))
 )(
   (( segid "    " and resid 1148 and name HB1 ))
 )
      5.000     5.000     0.000 peak  2754 weight  0.10000E+01 volume  0.53600E+00 ppm1      1.579 ppm2      2.115
 ASSI (
   (( segid "    " and resid 1148 and name HG1 ))
 )(
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
 )
      3.300     3.300     0.000 peak  9060 weight  0.10000E+01 volume  0.24860E+01 ppm1      1.579 ppm2      1.769
 ASSI (
   (( segid "    " and resid 1148 and name HG1 ))
 )(
   (( segid "    " and resid 1148 and name HE2 ))
  OR 
   (( segid "    " and resid 1148 and name HE1 ))
 )
      5.000     5.000     0.000 peak  2857 weight  0.10000E+01 volume  0.46800E+00 ppm1      1.580 ppm2      3.037
 ASSI (
   (( segid "    " and resid 1148 and name HG2 ))
 )(
   (( segid "    " and resid 1148 and name HE2 ))
  OR 
   (( segid "    " and resid 1148 and name HE1 ))
 )
      5.000     5.000     0.000 peak  2927 weight  0.10000E+01 volume  0.87000E+00 ppm1      1.481 ppm2      3.034
 ASSI (
   (( segid "    " and resid 1149 and name HG1 ))
 )(
   (( segid "    " and resid 1149 and name HA  ))
 )
      6.000     6.000     0.000 peak  6273 weight  0.10000E+01 volume  0.37600E+00 ppm1      1.571 ppm2      5.399
 ASSI (
   (( segid "    " and resid 1149 and name HA  ))
 )(
   (( segid "    " and resid 1149 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6265 weight  0.10000E+01 volume -0.99400E+00 ppm1      5.397 ppm2      1.710
 ASSI (
   (( segid "    " and resid 1135 and name HG1 ))
 )(
   (( segid "    " and resid 1149 and name HD2 ))
  OR 
   (( segid "    " and resid 1149 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9363 weight  0.10000E+01 volume  0.37800E+00 ppm1      2.173 ppm2      3.160
 ASSI (
   (( segid "    " and resid 1135 and name HG2 ))
 )(
   (( segid "    " and resid 1149 and name HD2 ))
  OR 
   (( segid "    " and resid 1149 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9364 weight  0.10000E+01 volume  0.20100E+00 ppm1      2.050 ppm2      3.164
 ASSI (
   (( segid "    " and resid 1149 and name HG2 ))
 )(
   (( segid "    " and resid 1149 and name HD2 ))
  OR 
   (( segid "    " and resid 1149 and name HD1 ))
 )
      3.300     3.300     0.000 peak  2666 weight  0.10000E+01 volume  0.24950E+01 ppm1      1.385 ppm2      3.142
 ASSI (
   (( segid "    " and resid 1133 and name HB1 ))
 )(
   (( segid "    " and resid 1149 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7190 weight  0.10000E+01 volume -0.66500E+00 ppm1      3.823 ppm2      1.576
 ASSI (
   (( segid "    " and resid 1133 and name HB2 ))
 )(
   (( segid "    " and resid 1149 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7191 weight  0.10000E+01 volume -0.62200E+00 ppm1      3.752 ppm2      1.573
 ASSI (
   (( segid "    " and resid 1149 and name HA  ))
 )(
   (( segid "    " and resid 1149 and name HG2 ))
 )
      5.000     5.000     0.000 peak  6268 weight  0.10000E+01 volume -0.45600E+00 ppm1      5.392 ppm2      1.387
 ASSI (
   (( segid "    " and resid 1148 and name HG1 ))
 )(
   (( segid "    " and resid 1149 and name HN  ))
 )
      6.000     6.000     0.000 peak  2977 weight  0.10000E+01 volume  0.22700E+00 ppm1      1.577 ppm2      7.725
 ASSI (
   (( segid "    " and resid 1149 and name HA  ))
 )(
   (( segid "    " and resid 1149 and name HN  ))
 )
      5.000     5.000     0.000 peak  6269 weight  0.10000E+01 volume -0.48400E+00 ppm1      5.394 ppm2      7.725
 ASSI (
   (( segid "    " and resid 1149 and name HB2 ))
 )(
   (( segid "    " and resid 1149 and name HN  ))
 )
      5.000     5.000     0.000 peak  8316 weight  0.10000E+01 volume  0.92400E+00 ppm1      1.624 ppm2      7.725
 ASSI (
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )(
   (( segid "    " and resid 1150 and name HB  ))
 )
      3.300     3.300     0.000 peak  8857 weight  0.10000E+01 volume  0.16790E+01 ppm1      0.758 ppm2      2.034
 ASSI (
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )
      3.300     3.300     0.000 peak  7773 weight  0.10000E+01 volume  0.16020E+01 ppm1      0.099 ppm2      0.435
 ASSI (
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )
      3.300     3.300     0.000 peak  8859 weight  0.10000E+01 volume  0.23250E+01 ppm1      0.756 ppm2      0.441
 ASSI (
   (( segid "    " and resid 1157 and name HA  ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )
      6.000     6.000     0.000 peak  6427 weight  0.10000E+01 volume -0.32800E+00 ppm1      5.033 ppm2      0.435
 ASSI (
   (( segid "    " and resid 1133 and name HA  ))
 )(
   (( segid "    " and resid 1150 and name HN  ))
 )
      6.000     6.000     0.000 peak  6234 weight  0.10000E+01 volume -0.98000E-01 ppm1      6.015 ppm2      8.742
 ASSI (
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )(
   (( segid "    " and resid 1150 and name HN  ))
 )
      6.000     6.000     0.000 peak  7762 weight  0.10000E+01 volume  0.19400E+00 ppm1      0.099 ppm2      8.738
 ASSI (
   (( segid "    " and resid 1149 and name HA  ))
 )(
   (( segid "    " and resid 1150 and name HN  ))
 )
      3.300     3.300     0.000 peak  6264 weight  0.10000E+01 volume -0.17100E+01 ppm1      5.395 ppm2      8.740
 ASSI (
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )(
   (( segid "    " and resid 1150 and name HN  ))
 )
      6.000     6.000     0.000 peak  8869 weight  0.10000E+01 volume  0.32300E+00 ppm1      0.756 ppm2      8.740
 ASSI (
   (( segid "    " and resid 1133 and name HB2 ))
 )(
   (( segid "    " and resid 1151 and name HA  ))
 )
      6.000     6.000     0.000 peak  7178 weight  0.10000E+01 volume -0.30700E+00 ppm1      3.756 ppm2      5.425
 ASSI (
   (( segid "    " and resid 1151 and name HB  ))
 )(
   (( segid "    " and resid 1151 and name HA  ))
 )
      5.000     5.000     0.000 peak  8460 weight  0.10000E+01 volume -0.60500E+00 ppm1      3.707 ppm2      5.444
 ASSI (
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )(
   (( segid "    " and resid 1151 and name HA  ))
 )
      5.000     5.000     0.000 peak  6263 weight  0.10000E+01 volume  0.79900E+00 ppm1      1.050 ppm2      5.435
 ASSI (
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )(
   (( segid "    " and resid 1151 and name HB  ))
 )
      3.300     3.300     0.000 peak  8850 weight  0.10000E+01 volume  0.25000E+01 ppm1      1.049 ppm2      3.715
 ASSI (
   (( segid "    " and resid 1131 and name HA  ))
 )(
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )
      5.000     5.000     0.000 peak  7005 weight  0.10000E+01 volume -0.12430E+01 ppm1      3.808 ppm2      1.055
 ASSI (
   (( segid "    " and resid 1133 and name HB1 ))
 )(
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )
      6.000     6.000     0.000 peak  7195 weight  0.10000E+01 volume -0.39200E+00 ppm1      3.823 ppm2      1.058
 ASSI (
   (( segid "    " and resid 1133 and name HB2 ))
 )(
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )
      6.000     6.000     0.000 peak  7194 weight  0.10000E+01 volume -0.28900E+00 ppm1      3.760 ppm2      1.057
 ASSI (
   (( segid "    " and resid 1150 and name HB  ))
 )(
   (( segid "    " and resid 1151 and name HN  ))
 )
      5.000     5.000     0.000 peak  8856 weight  0.10000E+01 volume  0.55200E+00 ppm1      2.031 ppm2      8.429
 ASSI (
   (( segid "    " and resid 1152 and name HB1 ))
 )(
   (( segid "    " and resid 1152 and name HA  ))
 )
      5.000     5.000     0.000 peak  3172 weight  0.10000E+01 volume  0.52400E+00 ppm1      2.329 ppm2      3.955
 ASSI (
   (( segid "    " and resid 1152 and name HB2 ))
 )(
   (( segid "    " and resid 1152 and name HA  ))
 )
      5.000     5.000     0.000 peak  3174 weight  0.10000E+01 volume  0.41800E+00 ppm1      0.944 ppm2      3.961
 ASSI (
   (( segid "    " and resid 1157 and name HA  ))
 )(
   (( segid "    " and resid 1152 and name HA  ))
 )
      5.000     5.000     0.000 peak  6422 weight  0.10000E+01 volume -0.12450E+01 ppm1      5.033 ppm2      3.949
 ASSI (
   (( segid "    " and resid 1152 and name HB2 ))
 )(
   (( segid "    " and resid 1152 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8845 weight  0.10000E+01 volume  0.10880E+01 ppm1      0.946 ppm2      2.327
 ASSI (
   (( segid "    " and resid 1152 and name HB1 ))
 )(
   (( segid "    " and resid 1152 and name HN  ))
 )
      5.000     5.000     0.000 peak  8847 weight  0.10000E+01 volume  0.65800E+00 ppm1      2.327 ppm2      8.342
 ASSI (
   (( segid "    " and resid 1152 and name HB2 ))
 )(
   (( segid "    " and resid 1152 and name HN  ))
 )
      5.000     5.000     0.000 peak  8848 weight  0.10000E+01 volume  0.44500E+00 ppm1      0.948 ppm2      8.342
 ASSI (
   (( segid "    " and resid 1154 and name HA  ))
 )(
   (( segid "    " and resid 1153 and name HA  ))
 )
      5.000     5.000     0.000 peak  6995 weight  0.10000E+01 volume -0.73900E+00 ppm1      4.259 ppm2      4.517
 ASSI (
   (( segid "    " and resid 1154 and name HB2 ))
 )(
   (( segid "    " and resid 1153 and name HB2 ))
  OR 
   (( segid "    " and resid 1153 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8819 weight  0.10000E+01 volume  0.23800E+00 ppm1      2.695 ppm2      1.717
 ASSI (
   (( segid "    " and resid 1157 and name HA  ))
 )(
   (( segid "    " and resid 1153 and name HN  ))
 )
      5.000     5.000     0.000 peak  6416 weight  0.10000E+01 volume -0.59500E+00 ppm1      5.033 ppm2      8.729
 ASSI (
   (( segid "    " and resid 1154 and name HB2 ))
 )(
   (( segid "    " and resid 1154 and name HA  ))
 )
      5.000     5.000     0.000 peak  2730 weight  0.10000E+01 volume  0.10710E+01 ppm1      2.697 ppm2      4.261
 ASSI (
   (( segid "    " and resid 1154 and name HA  ))
 )(
   (( segid "    " and resid 1154 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6996 weight  0.10000E+01 volume -0.19680E+01 ppm1      4.261 ppm2      3.025
 ASSI (
   (( segid "    " and resid 1155 and name HA2 ))
 )(
   (( segid "    " and resid 1155 and name HA1 ))
 )
      3.300     3.300     0.000 peak  6984 weight  0.10000E+01 volume -0.29730E+01 ppm1      3.309 ppm2      3.889
 ASSI (
   (( segid "    " and resid 1107 and name HA1 ))
 )(
   (( segid "    " and resid 1155 and name HA2 ))
 )
      5.000     5.000     0.000 peak  9250 weight  0.10000E+01 volume -0.60300E+00 ppm1      3.804 ppm2      3.309
 ASSI (
   (( segid "    " and resid 1107 and name HA2 ))
 )(
   (( segid "    " and resid 1155 and name HA2 ))
 )
      6.000     6.000     0.000 peak  9249 weight  0.10000E+01 volume -0.19800E+00 ppm1      3.473 ppm2      3.301
 ASSI (
   (( segid "    " and resid 1107 and name HA1 ))
 )(
   (( segid "    " and resid 1155 and name HN  ))
 )
      5.000     5.000     0.000 peak  9242 weight  0.10000E+01 volume -0.51600E+00 ppm1      3.805 ppm2      7.654
 ASSI (
   (( segid "    " and resid 1107 and name HA2 ))
 )(
   (( segid "    " and resid 1155 and name HN  ))
 )
      5.000     5.000     0.000 peak  9240 weight  0.10000E+01 volume -0.64400E+00 ppm1      3.478 ppm2      7.663
 ASSI (
   (( segid "    " and resid 1156 and name HG2 ))
  OR 
   (( segid "    " and resid 1156 and name HG1 ))
 )(
   (( segid "    " and resid 1156 and name HB1 ))
 )
      3.300     3.300     0.000 peak  9405 weight  0.10000E+01 volume  0.29570E+01 ppm1      2.324 ppm2      2.094
 ASSI (
   (( segid "    " and resid 1156 and name HG2 ))
  OR 
   (( segid "    " and resid 1156 and name HG1 ))
 )(
   (( segid "    " and resid 1156 and name HB2 ))
 )
      3.300     3.300     0.000 peak  9404 weight  0.10000E+01 volume  0.21720E+01 ppm1      2.326 ppm2      1.850
 ASSI (
   (( segid "    " and resid 1155 and name HA2 ))
 )(
   (( segid "    " and resid 1156 and name HN  ))
 )
      5.000     5.000     0.000 peak  6988 weight  0.10000E+01 volume -0.41100E+00 ppm1      3.308 ppm2      7.546
 ASSI (
   (( segid "    " and resid 1156 and name HB1 ))
 )(
   (( segid "    " and resid 1156 and name HN  ))
 )
      6.000     6.000     0.000 peak  8742 weight  0.10000E+01 volume  0.38700E+00 ppm1      2.083 ppm2      7.556
 ASSI (
   (( segid "    " and resid 1156 and name HG2 ))
  OR 
   (( segid "    " and resid 1156 and name HG1 ))
 )(
   (( segid "    " and resid 1156 and name HN  ))
 )
      5.000     5.000     0.000 peak  9406 weight  0.10000E+01 volume  0.10080E+01 ppm1      2.325 ppm2      7.544
 ASSI (
   (( segid "    " and resid 1157 and name HB1 ))
 )(
   (( segid "    " and resid 1157 and name HA  ))
 )
      5.000     5.000     0.000 peak  6432 weight  0.10000E+01 volume  0.50100E+00 ppm1      3.484 ppm2      5.030
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1157 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8719 weight  0.10000E+01 volume  0.91000E+00 ppm1      0.445 ppm2      3.496
 ASSI (
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )(
   (( segid "    " and resid 1157 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8720 weight  0.10000E+01 volume  0.14800E+01 ppm1      0.441 ppm2      2.956
 ASSI (
   (( segid "    " and resid 1112 and name HA  ))
 )(
   (( segid "    " and resid 1157 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9401 weight  0.10000E+01 volume -0.53300E+00 ppm1      3.279 ppm2      7.131
 ASSI (
   (( segid "    " and resid 1157 and name HB1 ))
 )(
   (( segid "    " and resid 1157 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8716 weight  0.10000E+01 volume  0.38200E+00 ppm1      3.483 ppm2      7.124
 ASSI (
   (( segid "    " and resid 1109 and name HB2 ))
 )(
   (( segid "    " and resid 1157 and name HE1 ))
 )
      5.000     5.000     0.000 peak  8647 weight  0.10000E+01 volume -0.41600E+00 ppm1      2.059 ppm2      9.758
 ASSI (
   (( segid "    " and resid 1156 and name HG2 ))
  OR 
   (( segid "    " and resid 1156 and name HG1 ))
 )(
   (( segid "    " and resid 1157 and name HN  ))
 )
      6.000     6.000     0.000 peak  9407 weight  0.10000E+01 volume  0.25200E+00 ppm1      2.325 ppm2      8.543
 ASSI (
   (( segid "    " and resid 1157 and name HA  ))
 )(
   (( segid "    " and resid 1157 and name HN  ))
 )
      5.000     5.000     0.000 peak  6417 weight  0.10000E+01 volume -0.45000E+00 ppm1      5.032 ppm2      8.558
 ASSI (
   (( segid "    " and resid 1157 and name HB1 ))
 )(
   (( segid "    " and resid 1157 and name HN  ))
 )
      5.000     5.000     0.000 peak  8715 weight  0.10000E+01 volume  0.78100E+00 ppm1      3.483 ppm2      8.556
 ASSI (
   (( segid "    " and resid 1157 and name HB2 ))
 )(
   (( segid "    " and resid 1157 and name HN  ))
 )
      6.000     6.000     0.000 peak  8717 weight  0.10000E+01 volume  0.33600E+00 ppm1      2.954 ppm2      8.554
 ASSI (
   (( segid "    " and resid 1150 and name HB  ))
 )(
   (( segid "    " and resid 1158 and name HN  ))
 )
      6.000     6.000     0.000 peak  8855 weight  0.10000E+01 volume  0.24200E+00 ppm1      2.031 ppm2      8.171
 ASSI (
   (( segid "    " and resid 1158 and name HB2 ))
 )(
   (( segid "    " and resid 1158 and name HN  ))
 )
      5.000     5.000     0.000 peak  7170 weight  0.10000E+01 volume -0.45200E+00 ppm1      4.190 ppm2      8.172
 ASSI (
   (( segid "    " and resid 1159 and name HB1 ))
 )(
   (( segid "    " and resid 1159 and name HA  ))
 )
      5.000     5.000     0.000 peak  8700 weight  0.10000E+01 volume  0.13210E+01 ppm1      2.029 ppm2      4.396
 ASSI (
   (( segid "    " and resid 1159 and name HB2 ))
 )(
   (( segid "    " and resid 1159 and name HA  ))
 )
      5.000     5.000     0.000 peak  8701 weight  0.10000E+01 volume  0.14990E+01 ppm1      1.951 ppm2      4.395
 ASSI (
   (( segid "    " and resid 1160 and name HD1 ))
 )(
   (( segid "    " and resid 1159 and name HA  ))
 )
      3.300     3.300     0.000 peak  7573 weight  0.10000E+01 volume -0.18100E+01 ppm1      3.980 ppm2      4.395
 ASSI (
   (( segid "    " and resid 1159 and name HG2 ))
  OR 
   (( segid "    " and resid 1159 and name HG1 ))
 )(
   (( segid "    " and resid 1159 and name HB1 ))
 )
      3.300     3.300     0.000 peak  8709 weight  0.10000E+01 volume  0.23940E+01 ppm1      2.415 ppm2      2.047
 ASSI (
   (( segid "    " and resid 1159 and name HG2 ))
  OR 
   (( segid "    " and resid 1159 and name HG1 ))
 )(
   (( segid "    " and resid 1159 and name HB2 ))
 )
      2.700     2.700     0.000 peak  8708 weight  0.10000E+01 volume  0.38680E+01 ppm1      2.419 ppm2      1.962
 ASSI (
   (( segid "    " and resid 1160 and name HD1 ))
 )(
   (( segid "    " and resid 1159 and name HG2 ))
  OR 
   (( segid "    " and resid 1159 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7657 weight  0.10000E+01 volume -0.45200E+00 ppm1      3.988 ppm2      2.411
 ASSI (
   (( segid "    " and resid 1160 and name HD2 ))
 )(
   (( segid "    " and resid 1159 and name HG2 ))
  OR 
   (( segid "    " and resid 1159 and name HG1 ))
 )
      5.000     5.000     0.000 peak  7658 weight  0.10000E+01 volume -0.87700E+00 ppm1      3.684 ppm2      2.407
 ASSI (
   (( segid "    " and resid 1158 and name HB1 ))
 )(
   (( segid "    " and resid 1159 and name HN  ))
 )
      5.000     5.000     0.000 peak  7169 weight  0.10000E+01 volume -0.10240E+01 ppm1      4.386 ppm2      7.972
 ASSI (
   (( segid "    " and resid 1159 and name HA  ))
 )(
   (( segid "    " and resid 1159 and name HN  ))
 )
      5.000     5.000     0.000 peak  7648 weight  0.10000E+01 volume -0.10120E+01 ppm1      4.397 ppm2      7.961
 ASSI (
   (( segid "    " and resid 1159 and name HG2 ))
  OR 
   (( segid "    " and resid 1159 and name HG1 ))
 )(
   (( segid "    " and resid 1159 and name HN  ))
 )
      5.000     5.000     0.000 peak  3017 weight  0.10000E+01 volume  0.62300E+00 ppm1      2.427 ppm2      7.969
 ASSI (
   (( segid "    " and resid 1160 and name HD2 ))
 )(
   (( segid "    " and resid 1159 and name HN  ))
 )
      6.000     6.000     0.000 peak  7666 weight  0.10000E+01 volume -0.21100E+00 ppm1      3.694 ppm2      7.971
 ASSI (
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )(
   (( segid "    " and resid 1160 and name HA  ))
 )
      6.000     6.000     0.000 peak  8892 weight  0.10000E+01 volume  0.24500E+00 ppm1      0.436 ppm2      4.377
 ASSI (
   (( segid "    " and resid 1160 and name HG1 ))
 )(
   (( segid "    " and resid 1160 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7669 weight  0.10000E+01 volume  0.63300E+00 ppm1      1.842 ppm2      3.979
 ASSI (
   (( segid "    " and resid 1160 and name HG2 ))
 )(
   (( segid "    " and resid 1160 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7670 weight  0.10000E+01 volume  0.63700E+00 ppm1      1.744 ppm2      3.983
 ASSI (
   (( segid "    " and resid 1159 and name HA  ))
 )(
   (( segid "    " and resid 1160 and name HD2 ))
 )
      2.700     2.700     0.000 peak  6958 weight  0.10000E+01 volume -0.31830E+01 ppm1      4.397 ppm2      3.682
 ASSI (
   (( segid "    " and resid 1159 and name HG2 ))
  OR 
   (( segid "    " and resid 1159 and name HG1 ))
 )(
   (( segid "    " and resid 1160 and name HD2 ))
 )
      5.000     5.000     0.000 peak  8711 weight  0.10000E+01 volume  0.65800E+00 ppm1      2.417 ppm2      3.687
 ASSI (
   (( segid "    " and resid 1160 and name HG1 ))
 )(
   (( segid "    " and resid 1160 and name HD2 ))
 )
      5.000     5.000     0.000 peak  8538 weight  0.10000E+01 volume  0.82600E+00 ppm1      1.840 ppm2      3.676
 ASSI (
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )(
   (( segid "    " and resid 1160 and name HG2 ))
 )
      5.000     5.000     0.000 peak  8899 weight  0.10000E+01 volume  0.13900E+01 ppm1      0.438 ppm2      1.757
 ASSI (
   (( segid "    " and resid 1148 and name HA  ))
 )(
   (( segid "    " and resid 1160 and name HG2 ))
 )
      5.000     5.000     0.000 peak  6887 weight  0.10000E+01 volume -0.84300E+00 ppm1      3.969 ppm2      1.745
 ASSI (
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )(
   (( segid "    " and resid 1161 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8864 weight  0.10000E+01 volume  0.52400E+00 ppm1      0.757 ppm2      3.384
 ASSI (
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )(
   (( segid "    " and resid 1161 and name HD2 ))
 )
      5.000     5.000     0.000 peak  8897 weight  0.10000E+01 volume  0.45800E+00 ppm1      0.439 ppm2      2.470
 ASSI (
   (( segid "    " and resid 1145 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG1 ))
 )(
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
 )
      6.000     6.000     0.000 peak  8671 weight  0.10000E+01 volume  0.27200E+00 ppm1      2.262 ppm2      1.349
 ASSI (
   (( segid "    " and resid 1162 and name HA  ))
 )(
   (( segid "    " and resid 1162 and name HN  ))
 )
      5.000     5.000     0.000 peak  6975 weight  0.10000E+01 volume -0.40400E+00 ppm1      4.525 ppm2      8.059
 ASSI (
   (( segid "    " and resid 1162 and name HB1 ))
 )(
   (( segid "    " and resid 1162 and name HN  ))
 )
      6.000     6.000     0.000 peak  8693 weight  0.10000E+01 volume  0.30000E+00 ppm1      1.696 ppm2      8.065
 ASSI (
   (( segid "    " and resid 1163 and name HB2 ))
 )(
   (( segid "    " and resid 1163 and name HA  ))
 )
      6.000     6.000     0.000 peak  8681 weight  0.10000E+01 volume  0.28300E+00 ppm1      2.531 ppm2      5.074
 ASSI (
   (( segid "    " and resid 1142 and name HB2 ))
 )(
   (( segid "    " and resid 1163 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8981 weight  0.10000E+01 volume  0.34900E+00 ppm1      2.271 ppm2      2.807
 ASSI (
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )(
   (( segid "    " and resid 1163 and name HN  ))
 )
      5.000     5.000     0.000 peak  8894 weight  0.10000E+01 volume  0.40900E+00 ppm1      0.438 ppm2      8.974
 ASSI (
   (( segid "    " and resid 1163 and name HA  ))
 )(
   (( segid "    " and resid 1163 and name HN  ))
 )
      5.000     5.000     0.000 peak  6386 weight  0.10000E+01 volume -0.64200E+00 ppm1      5.065 ppm2      9.010
 ASSI (
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
 )(
   (( segid "    " and resid 1164 and name HA  ))
 )
      3.300     3.300     0.000 peak  7589 weight  0.10000E+01 volume  0.16030E+01 ppm1      0.664 ppm2      4.360
 ASSI (
   (( segid "    " and resid 1164 and name HA  ))
 )(
   (( segid "    " and resid 1164 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8369 weight  0.10000E+01 volume -0.14140E+01 ppm1      4.358 ppm2      1.641
 ASSI (
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )(
   (( segid "    " and resid 1164 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9309 weight  0.10000E+01 volume  0.11820E+01 ppm1      0.413 ppm2      1.651
 ASSI (
   (( segid "    " and resid 1164 and name HA  ))
 )(
   (( segid "    " and resid 1164 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6961 weight  0.10000E+01 volume -0.87500E+00 ppm1      4.357 ppm2      1.152
 ASSI (
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )(
   (( segid "    " and resid 1164 and name HB2 ))
 )
      6.000     6.000     0.000 peak  9312 weight  0.10000E+01 volume  0.37300E+00 ppm1      0.412 ppm2      1.109
 ASSI (
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
 )
      5.000     5.000     0.000 peak  9322 weight  0.10000E+01 volume  0.11800E+01 ppm1      1.364 ppm2      0.662
 ASSI (
   (( segid "    " and resid 1219 and name HD1 ))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
 )
      6.000     6.000     0.000 peak  7613 weight  0.10000E+01 volume -0.15800E+00 ppm1      7.157 ppm2      0.658
 ASSI (
   (( segid "    " and resid 1145 and name HB1 ))
 )(
   (( segid "    " and resid 1164 and name HG  ))
 )
      5.000     5.000     0.000 peak  8661 weight  0.10000E+01 volume  0.13390E+01 ppm1      1.959 ppm2      0.643
 ASSI (
   (( segid "    " and resid 1145 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG1 ))
 )(
   (( segid "    " and resid 1164 and name HG  ))
 )
      5.000     5.000     0.000 peak  8668 weight  0.10000E+01 volume  0.13890E+01 ppm1      2.263 ppm2      0.639
 ASSI (
   (( segid "    " and resid 1166 and name HD2 ))
 )(
   (( segid "    " and resid 1165 and name HA  ))
 )
      5.000     5.000     0.000 peak  9081 weight  0.10000E+01 volume -0.62800E+00 ppm1      1.983 ppm2      4.036
 ASSI (
   (( segid "    " and resid 1165 and name HA  ))
 )(
   (( segid "    " and resid 1165 and name HN  ))
 )
      6.000     6.000     0.000 peak  8637 weight  0.10000E+01 volume -0.31500E+00 ppm1      4.020 ppm2      9.797
 ASSI (
   (( segid "    " and resid 1220 and name HA  ))
 )(
   (( segid "    " and resid 1165 and name HN  ))
 )
      5.000     5.000     0.000 peak  6677 weight  0.10000E+01 volume -0.69800E+00 ppm1      4.490 ppm2      9.797
 ASSI (
   (( segid "    " and resid 1192 and name HA  ))
 )(
   (( segid "    " and resid 1166 and name HA  ))
 )
      5.000     5.000     0.000 peak  6526 weight  0.10000E+01 volume -0.89800E+00 ppm1      4.247 ppm2      4.841
 ASSI (
   (( segid "    " and resid 1166 and name HA  ))
 )(
   (( segid "    " and resid 1166 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6522 weight  0.10000E+01 volume -0.10230E+01 ppm1      4.846 ppm2      2.214
 ASSI (
   (( segid "    " and resid 1166 and name HA  ))
 )(
   (( segid "    " and resid 1166 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6523 weight  0.10000E+01 volume -0.65500E+00 ppm1      4.844 ppm2      1.791
 ASSI (
   (( segid "    " and resid 1165 and name HA  ))
 )(
   (( segid "    " and resid 1166 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9553 weight  0.10000E+01 volume -0.85900E+00 ppm1      4.025 ppm2      2.928
 ASSI (
   (( segid "    " and resid 1166 and name HD2 ))
 )(
   (( segid "    " and resid 1166 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9082 weight  0.10000E+01 volume -0.13150E+01 ppm1      1.983 ppm2      2.932
 ASSI (
   (( segid "    " and resid 1166 and name HG1 ))
 )(
   (( segid "    " and resid 1166 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9565 weight  0.10000E+01 volume  0.33400E+00 ppm1      1.521 ppm2      2.923
 ASSI (
   (( segid "    " and resid 1166 and name HG2 ))
 )(
   (( segid "    " and resid 1166 and name HD1 ))
 )
      5.000     5.000     0.000 peak  9568 weight  0.10000E+01 volume  0.77700E+00 ppm1      1.401 ppm2      2.920
 ASSI (
   (( segid "    " and resid 1166 and name HD2 ))
 )(
   (( segid "    " and resid 1166 and name HG1 ))
 )
      5.000     5.000     0.000 peak  9083 weight  0.10000E+01 volume -0.42800E+00 ppm1      1.982 ppm2      1.520
 ASSI (
   (( segid "    " and resid 1166 and name HD2 ))
 )(
   (( segid "    " and resid 1166 and name HG2 ))
 )
      6.000     6.000     0.000 peak  9084 weight  0.10000E+01 volume -0.33900E+00 ppm1      1.981 ppm2      1.404
 ASSI (
   (( segid "    " and resid 1221 and name HA1 ))
 )(
   (( segid "    " and resid 1167 and name HA  ))
 )
      5.000     5.000     0.000 peak  6670 weight  0.10000E+01 volume -0.58300E+00 ppm1      4.054 ppm2      4.789
 ASSI (
   (( segid "    " and resid 1221 and name HA2 ))
 )(
   (( segid "    " and resid 1167 and name HA  ))
 )
      5.000     5.000     0.000 peak  6671 weight  0.10000E+01 volume -0.60700E+00 ppm1      3.745 ppm2      4.790
 ASSI (
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )(
   (( segid "    " and resid 1167 and name HA  ))
 )
      6.000     6.000     0.000 peak  7833 weight  0.10000E+01 volume  0.30900E+00 ppm1      0.528 ppm2      4.798
 ASSI (
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )(
   (( segid "    " and resid 1167 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7680 weight  0.10000E+01 volume -0.10230E+01 ppm1      6.844 ppm2      2.794
 ASSI (
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )(
   (( segid "    " and resid 1167 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7831 weight  0.10000E+01 volume  0.55200E+00 ppm1      0.529 ppm2      2.708
 ASSI (
   (( segid "    " and resid 1167 and name HB2 ))
 )(
   (( segid "    " and resid 1167 and name HN  ))
 )
      5.000     5.000     0.000 peak  8632 weight  0.10000E+01 volume  0.47300E+00 ppm1      2.718 ppm2      9.426
 ASSI (
   (( segid "    " and resid 1191 and name HB2 ))
 )(
   (( segid "    " and resid 1167 and name HN  ))
 )
      6.000     6.000     0.000 peak  7817 weight  0.10000E+01 volume -0.24000E+00 ppm1      3.439 ppm2      9.411
 ASSI (
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )(
   (( segid "    " and resid 1167 and name HN  ))
 )
      6.000     6.000     0.000 peak  7840 weight  0.10000E+01 volume  0.11900E+00 ppm1      0.529 ppm2      9.434
 ASSI (
   (( segid "    " and resid 1168 and name HB  ))
 )(
   (( segid "    " and resid 1168 and name HA  ))
 )
      5.000     5.000     0.000 peak  6947 weight  0.10000E+01 volume  0.60800E+00 ppm1      1.898 ppm2      4.199
 ASSI (
   (( segid "    " and resid 1168 and name HG13))
  OR 
   (( segid "    " and resid 1168 and name HG12))
  OR 
   (( segid "    " and resid 1168 and name HG11))
 )(
   (( segid "    " and resid 1168 and name HA  ))
 )
      6.000     6.000     0.000 peak  9468 weight  0.10000E+01 volume  0.31300E+00 ppm1      0.849 ppm2      4.204
 ASSI (
   (( segid "    " and resid 1168 and name HG23))
  OR 
   (( segid "    " and resid 1168 and name HG22))
  OR 
   (( segid "    " and resid 1168 and name HG21))
 )(
   (( segid "    " and resid 1168 and name HA  ))
 )
      5.000     5.000     0.000 peak  6948 weight  0.10000E+01 volume  0.44300E+00 ppm1      0.826 ppm2      4.202
 ASSI (
   (( segid "    " and resid 1190 and name HA  ))
 )(
   (( segid "    " and resid 1168 and name HA  ))
 )
      5.000     5.000     0.000 peak  6288 weight  0.10000E+01 volume -0.69300E+00 ppm1      5.356 ppm2      4.203
 ASSI (
   (( segid "    " and resid 1168 and name HA  ))
 )(
   (( segid "    " and resid 1168 and name HG23))
  OR 
   (( segid "    " and resid 1168 and name HG22))
  OR 
   (( segid "    " and resid 1168 and name HG21))
  OR 
   (( segid "    " and resid 1168 and name HG13))
  OR 
   (( segid "    " and resid 1168 and name HG12))
  OR 
   (( segid "    " and resid 1168 and name HG11))
 )
      3.300     3.300     0.000 peak  6946 weight  0.10000E+01 volume -0.27370E+01 ppm1      4.205 ppm2      0.830
 ASSI (
   (( segid "    " and resid 1168 and name HB  ))
 )(
   (( segid "    " and resid 1168 and name HG23))
  OR 
   (( segid "    " and resid 1168 and name HG22))
  OR 
   (( segid "    " and resid 1168 and name HG21))
  OR 
   (( segid "    " and resid 1168 and name HG13))
  OR 
   (( segid "    " and resid 1168 and name HG12))
  OR 
   (( segid "    " and resid 1168 and name HG11))
 )
      2.700     2.700     0.000 peak  8621 weight  0.10000E+01 volume  0.55930E+01 ppm1      1.900 ppm2      0.833
 ASSI (
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )(
   (( segid "    " and resid 1168 and name HG23))
  OR 
   (( segid "    " and resid 1168 and name HG22))
  OR 
   (( segid "    " and resid 1168 and name HG21))
  OR 
   (( segid "    " and resid 1168 and name HG13))
  OR 
   (( segid "    " and resid 1168 and name HG12))
  OR 
   (( segid "    " and resid 1168 and name HG11))
 )
      5.000     5.000     0.000 peak  7677 weight  0.10000E+01 volume -0.41300E+00 ppm1      6.845 ppm2      0.822
 ASSI (
   (( segid "    " and resid 1190 and name HE2 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )(
   (( segid "    " and resid 1168 and name HG23))
  OR 
   (( segid "    " and resid 1168 and name HG22))
  OR 
   (( segid "    " and resid 1168 and name HG21))
 )
      5.000     5.000     0.000 peak  9603 weight  0.10000E+01 volume -0.74500E+00 ppm1      6.737 ppm2      0.809
 ASSI (
   (( segid "    " and resid 1168 and name HA  ))
 )(
   (( segid "    " and resid 1168 and name HN  ))
 )
      5.000     5.000     0.000 peak  6941 weight  0.10000E+01 volume -0.53600E+00 ppm1      4.206 ppm2      8.543
 ASSI (
   (( segid "    " and resid 1168 and name HG13))
  OR 
   (( segid "    " and resid 1168 and name HG12))
  OR 
   (( segid "    " and resid 1168 and name HG11))
 )(
   (( segid "    " and resid 1168 and name HN  ))
 )
      6.000     6.000     0.000 peak  9465 weight  0.10000E+01 volume  0.38000E+00 ppm1      0.848 ppm2      8.546
 ASSI (
   (( segid "    " and resid 1168 and name HG23))
  OR 
   (( segid "    " and resid 1168 and name HG22))
  OR 
   (( segid "    " and resid 1168 and name HG21))
 )(
   (( segid "    " and resid 1168 and name HN  ))
 )
      5.000     5.000     0.000 peak  9476 weight  0.10000E+01 volume  0.56000E+00 ppm1      0.819 ppm2      8.542
 ASSI (
   (( segid "    " and resid 1221 and name HA2 ))
 )(
   (( segid "    " and resid 1168 and name HN  ))
 )
      6.000     6.000     0.000 peak  7568 weight  0.10000E+01 volume -0.22700E+00 ppm1      3.741 ppm2      8.542
 ASSI (
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )(
   (( segid "    " and resid 1169 and name HB  ))
 )
      2.700     2.700     0.000 peak  8598 weight  0.10000E+01 volume  0.32130E+01 ppm1      1.030 ppm2      1.701
 ASSI (
   (( segid "    " and resid 1169 and name HA  ))
 )(
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      5.000     5.000     0.000 peak  6932 weight  0.10000E+01 volume -0.45600E+00 ppm1      4.160 ppm2      0.697
 ASSI (
   (( segid "    " and resid 1169 and name HA  ))
 )(
   (( segid "    " and resid 1169 and name HG11))
 )
      5.000     5.000     0.000 peak  6929 weight  0.10000E+01 volume -0.58500E+00 ppm1      4.161 ppm2      1.361
 ASSI (
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )(
   (( segid "    " and resid 1169 and name HG11))
 )
      3.300     3.300     0.000 peak  8588 weight  0.10000E+01 volume  0.17400E+01 ppm1      0.702 ppm2      1.372
 ASSI (
   (( segid "    " and resid 1169 and name HA  ))
 )(
   (( segid "    " and resid 1169 and name HG12))
 )
      5.000     5.000     0.000 peak  6931 weight  0.10000E+01 volume -0.90400E+00 ppm1      4.160 ppm2      0.962
 ASSI (
   (( segid "    " and resid 1169 and name HA  ))
 )(
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )
      3.300     3.300     0.000 peak  6930 weight  0.10000E+01 volume -0.16120E+01 ppm1      4.159 ppm2      1.040
 ASSI (
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )(
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )
      2.700     2.700     0.000 peak  8590 weight  0.10000E+01 volume  0.33760E+01 ppm1      0.703 ppm2      1.034
 ASSI (
   (( segid "    " and resid 1174 and name HG2 ))
 )(
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )
      5.000     5.000     0.000 peak  8546 weight  0.10000E+01 volume  0.40300E+00 ppm1      2.007 ppm2      1.031
 ASSI (
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )(
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )
      6.000     6.000     0.000 peak  7781 weight  0.10000E+01 volume  0.36100E+00 ppm1      0.146 ppm2      1.024
 ASSI (
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )(
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )
      5.000     5.000     0.000 peak  7791 weight  0.10000E+01 volume -0.40200E+00 ppm1      7.164 ppm2      1.030
 ASSI (
   (( segid "    " and resid 1168 and name HG23))
  OR 
   (( segid "    " and resid 1168 and name HG22))
  OR 
   (( segid "    " and resid 1168 and name HG21))
 )(
   (( segid "    " and resid 1169 and name HN  ))
 )
      5.000     5.000     0.000 peak  9475 weight  0.10000E+01 volume  0.46100E+00 ppm1      0.818 ppm2      8.242
 ASSI (
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )(
   (( segid "    " and resid 1169 and name HN  ))
 )
      6.000     6.000     0.000 peak  8584 weight  0.10000E+01 volume  0.24400E+00 ppm1      0.705 ppm2      8.231
 ASSI (
   (( segid "    " and resid 1189 and name HD13))
  OR 
   (( segid "    " and resid 1189 and name HD12))
  OR 
   (( segid "    " and resid 1189 and name HD11))
 )(
   (( segid "    " and resid 1169 and name HN  ))
 )
      6.000     6.000     0.000 peak  9618 weight  0.10000E+01 volume  0.28100E+00 ppm1      0.918 ppm2      8.249
 ASSI (
   (( segid "    " and resid 1190 and name HA  ))
 )(
   (( segid "    " and resid 1169 and name HN  ))
 )
      5.000     5.000     0.000 peak  6285 weight  0.10000E+01 volume -0.41500E+00 ppm1      5.355 ppm2      8.237
 ASSI (
   (( segid "    " and resid 1171 and name HA  ))
 )(
   (( segid "    " and resid 1170 and name HA  ))
 )
      6.000     6.000     0.000 peak  6923 weight  0.10000E+01 volume -0.38100E+00 ppm1      4.093 ppm2      4.683
 ASSI (
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
 )(
   (( segid "    " and resid 1170 and name HB2 ))
 )
      6.000     6.000     0.000 peak  7752 weight  0.10000E+01 volume  0.20600E+00 ppm1      0.658 ppm2      3.725
 ASSI (
   (( segid "    " and resid 1171 and name HA  ))
 )(
   (( segid "    " and resid 1171 and name HG2 ))
 )
      5.000     5.000     0.000 peak  6925 weight  0.10000E+01 volume -0.10740E+01 ppm1      4.093 ppm2      1.684
 ASSI (
   (( segid "    " and resid 1170 and name HA  ))
 )(
   (( segid "    " and resid 1171 and name HN  ))
 )
      5.000     5.000     0.000 peak  2867 weight  0.10000E+01 volume -0.15380E+01 ppm1      4.685 ppm2      9.009
 ASSI (
   (( segid "    " and resid 1172 and name HB1 ))
 )(
   (( segid "    " and resid 1172 and name HA  ))
 )
      5.000     5.000     0.000 peak  8566 weight  0.10000E+01 volume  0.12580E+01 ppm1      1.900 ppm2      3.911
 ASSI (
   (( segid "    " and resid 1172 and name HB2 ))
 )(
   (( segid "    " and resid 1172 and name HA  ))
 )
      5.000     5.000     0.000 peak  8565 weight  0.10000E+01 volume  0.11590E+01 ppm1      1.795 ppm2      3.910
 ASSI (
   (( segid "    " and resid 1172 and name HG2 ))
  OR 
   (( segid "    " and resid 1172 and name HG1 ))
 )(
   (( segid "    " and resid 1172 and name HA  ))
 )
      5.000     5.000     0.000 peak  8567 weight  0.10000E+01 volume  0.14880E+01 ppm1      2.212 ppm2      3.903
 ASSI (
   (( segid "    " and resid 1172 and name HB1 ))
 )(
   (( segid "    " and resid 1172 and name HG2 ))
 )
      2.700     2.700     0.000 peak  8571 weight  0.10000E+01 volume  0.35330E+01 ppm1      1.900 ppm2      2.204
 ASSI (
   (( segid "    " and resid 1172 and name HB2 ))
 )(
   (( segid "    " and resid 1172 and name HG2 ))
 )
      3.300     3.300     0.000 peak  8570 weight  0.10000E+01 volume  0.23650E+01 ppm1      1.787 ppm2      2.205
 ASSI (
   (( segid "    " and resid 1173 and name HB  ))
 )(
   (( segid "    " and resid 1173 and name HA  ))
 )
      6.000     6.000     0.000 peak  6910 weight  0.10000E+01 volume  0.38500E+00 ppm1      1.126 ppm2      3.211
 ASSI (
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
 )(
   (( segid "    " and resid 1173 and name HA  ))
 )
      5.000     5.000     0.000 peak  6912 weight  0.10000E+01 volume  0.47700E+00 ppm1      0.659 ppm2      3.211
 ASSI (
   (( segid "    " and resid 1173 and name HG12))
 )(
   (( segid "    " and resid 1173 and name HA  ))
 )
      5.000     5.000     0.000 peak  6911 weight  0.10000E+01 volume  0.90600E+00 ppm1      0.745 ppm2      3.211
 ASSI (
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )(
   (( segid "    " and resid 1173 and name HA  ))
 )
      5.000     5.000     0.000 peak  7747 weight  0.10000E+01 volume  0.14440E+01 ppm1     -0.391 ppm2      3.211
 ASSI (
   (( segid "    " and resid 1176 and name HB1 ))
 )(
   (( segid "    " and resid 1173 and name HA  ))
 )
      5.000     5.000     0.000 peak  6908 weight  0.10000E+01 volume  0.11070E+01 ppm1      2.639 ppm2      3.210
 ASSI (
   (( segid "    " and resid 1176 and name HB2 ))
 )(
   (( segid "    " and resid 1173 and name HA  ))
 )
      5.000     5.000     0.000 peak  6909 weight  0.10000E+01 volume  0.91300E+00 ppm1      2.584 ppm2      3.208
 ASSI (
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )(
   (( segid "    " and resid 1173 and name HB  ))
 )
      5.000     5.000     0.000 peak  7744 weight  0.10000E+01 volume  0.15210E+01 ppm1     -0.393 ppm2      1.139
 ASSI (
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )(
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
 )
      2.700     2.700     0.000 peak  7740 weight  0.10000E+01 volume  0.35120E+01 ppm1     -0.391 ppm2      0.659
 ASSI (
   (( segid "    " and resid 1173 and name HA  ))
 )(
   (( segid "    " and resid 1173 and name HG11))
 )
      5.000     5.000     0.000 peak  6904 weight  0.10000E+01 volume -0.44900E+00 ppm1      3.205 ppm2      1.326
 ASSI (
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )(
   (( segid "    " and resid 1173 and name HG11))
 )
      5.000     5.000     0.000 peak  7743 weight  0.10000E+01 volume  0.68500E+00 ppm1     -0.393 ppm2      1.321
 ASSI (
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )(
   (( segid "    " and resid 1173 and name HG12))
 )
      5.000     5.000     0.000 peak  7742 weight  0.10000E+01 volume  0.10670E+01 ppm1     -0.391 ppm2      0.756
 ASSI (
   (( segid "    " and resid 1174 and name HA  ))
 )(
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )
      6.000     6.000     0.000 peak  6899 weight  0.10000E+01 volume -0.23600E+00 ppm1      3.513 ppm2     -0.391
 ASSI (
   (( segid "    " and resid 1177 and name HD2 ))
  OR 
   (( segid "    " and resid 1177 and name HD1 ))
 )(
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )
      6.000     6.000     0.000 peak  3023 weight  0.10000E+01 volume -0.28900E+00 ppm1      6.791 ppm2     -0.394
 ASSI (
   (( segid "    " and resid 1177 and name HE2 ))
  OR 
   (( segid "    " and resid 1177 and name HE1 ))
 )(
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )
      5.000     5.000     0.000 peak  7631 weight  0.10000E+01 volume -0.96300E+00 ppm1      6.580 ppm2     -0.388
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )
      6.000     6.000     0.000 peak  7430 weight  0.10000E+01 volume  0.22800E+00 ppm1      0.374 ppm2     -0.390
 ASSI (
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )(
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )
      6.000     6.000     0.000 peak  7710 weight  0.10000E+01 volume -0.19500E+00 ppm1      6.786 ppm2     -0.388
 ASSI (
   (( segid "    " and resid 1172 and name HB1 ))
 )(
   (( segid "    " and resid 1173 and name HN  ))
 )
      5.000     5.000     0.000 peak  8572 weight  0.10000E+01 volume  0.53100E+00 ppm1      1.903 ppm2      7.373
 ASSI (
   (( segid "    " and resid 1172 and name HB2 ))
 )(
   (( segid "    " and resid 1173 and name HN  ))
 )
      5.000     5.000     0.000 peak  8573 weight  0.10000E+01 volume  0.41600E+00 ppm1      1.795 ppm2      7.367
 ASSI (
   (( segid "    " and resid 1173 and name HB  ))
 )(
   (( segid "    " and resid 1173 and name HN  ))
 )
      5.000     5.000     0.000 peak  8558 weight  0.10000E+01 volume  0.76900E+00 ppm1      1.128 ppm2      7.367
 ASSI (
   (( segid "    " and resid 1174 and name HG2 ))
 )(
   (( segid "    " and resid 1174 and name HA  ))
 )
      5.000     5.000     0.000 peak  2750 weight  0.10000E+01 volume  0.55100E+00 ppm1      2.010 ppm2      3.507
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1174 and name HA  ))
 )
      5.000     5.000     0.000 peak  2763 weight  0.10000E+01 volume  0.89400E+00 ppm1      0.369 ppm2      3.494
 ASSI (
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )(
   (( segid "    " and resid 1174 and name HA  ))
 )
      6.000     6.000     0.000 peak  6369 weight  0.10000E+01 volume  0.14400E+00 ppm1      0.742 ppm2      3.487
 ASSI (
   (( segid "    " and resid 1174 and name HA  ))
 )(
   (( segid "    " and resid 1174 and name HG1 ))
 )
      5.000     5.000     0.000 peak  6891 weight  0.10000E+01 volume -0.71400E+00 ppm1      3.500 ppm2      2.864
 ASSI (
   (( segid "    " and resid 1171 and name HA  ))
 )(
   (( segid "    " and resid 1174 and name HN  ))
 )
      5.000     5.000     0.000 peak  6921 weight  0.10000E+01 volume -0.44400E+00 ppm1      4.094 ppm2      7.457
 ASSI (
   (( segid "    " and resid 1173 and name HB  ))
 )(
   (( segid "    " and resid 1174 and name HN  ))
 )
      5.000     5.000     0.000 peak  8559 weight  0.10000E+01 volume  0.43700E+00 ppm1      1.127 ppm2      7.460
 ASSI (
   (( segid "    " and resid 1174 and name HA  ))
 )(
   (( segid "    " and resid 1174 and name HN  ))
 )
      5.000     5.000     0.000 peak  2903 weight  0.10000E+01 volume -0.71100E+00 ppm1      3.498 ppm2      7.453
 ASSI (
   (( segid "    " and resid 1175 and name HG2 ))
 )(
   (( segid "    " and resid 1175 and name HA  ))
 )
      5.000     5.000     0.000 peak  9396 weight  0.10000E+01 volume  0.83100E+00 ppm1      2.289 ppm2      3.957
 ASSI (
   (( segid "    " and resid 1175 and name HA  ))
 )(
   (( segid "    " and resid 1175 and name HB1 ))
 )
      3.300     3.300     0.000 peak  2826 weight  0.10000E+01 volume -0.24120E+01 ppm1      3.968 ppm2      2.058
 ASSI (
   (( segid "    " and resid 1175 and name HA  ))
 )(
   (( segid "    " and resid 1175 and name HB2 ))
 )
      3.300     3.300     0.000 peak  6883 weight  0.10000E+01 volume -0.21020E+01 ppm1      3.964 ppm2      2.011
 ASSI (
   (( segid "    " and resid 1175 and name HA  ))
 )(
   (( segid "    " and resid 1175 and name HG1 ))
 )
      5.000     5.000     0.000 peak  6881 weight  0.10000E+01 volume -0.10870E+01 ppm1      3.966 ppm2      2.346
 ASSI (
   (( segid "    " and resid 1175 and name HA  ))
 )(
   (( segid "    " and resid 1175 and name HN  ))
 )
      3.300     3.300     0.000 peak  3007 weight  0.10000E+01 volume -0.16110E+01 ppm1      3.967 ppm2      7.816
 ASSI (
   (( segid "    " and resid 1175 and name HB1 ))
 )(
   (( segid "    " and resid 1175 and name HN  ))
 )
      5.000     5.000     0.000 peak  8290 weight  0.10000E+01 volume  0.13850E+01 ppm1      2.062 ppm2      7.810
 ASSI (
   (( segid "    " and resid 1175 and name HB2 ))
 )(
   (( segid "    " and resid 1175 and name HN  ))
 )
      5.000     5.000     0.000 peak  8289 weight  0.10000E+01 volume  0.14440E+01 ppm1      2.007 ppm2      7.814
 ASSI (
   (( segid "    " and resid 1176 and name HB1 ))
 )(
   (( segid "    " and resid 1176 and name HA  ))
 )
      3.300     3.300     0.000 peak  8496 weight  0.10000E+01 volume  0.21710E+01 ppm1      2.639 ppm2      4.375
 ASSI (
   (( segid "    " and resid 1176 and name HA  ))
 )(
   (( segid "    " and resid 1176 and name HB2 ))
 )
      2.700     2.700     0.000 peak  8277 weight  0.10000E+01 volume -0.31710E+01 ppm1      4.375 ppm2      2.582
 ASSI (
   (( segid "    " and resid 1176 and name HB1 ))
 )(
   (( segid "    " and resid 1176 and name HD21))
 )
      5.000     5.000     0.000 peak  8439 weight  0.10000E+01 volume  0.55300E+00 ppm1      2.640 ppm2      6.985
 ASSI (
   (( segid "    " and resid 1176 and name HB2 ))
 )(
   (( segid "    " and resid 1176 and name HD21))
 )
      5.000     5.000     0.000 peak  8440 weight  0.10000E+01 volume  0.55700E+00 ppm1      2.585 ppm2      6.985
 ASSI (
   (( segid "    " and resid 1176 and name HB1 ))
 )(
   (( segid "    " and resid 1176 and name HD22))
 )
      5.000     5.000     0.000 peak  8498 weight  0.10000E+01 volume  0.62100E+00 ppm1      2.635 ppm2      6.806
 ASSI (
   (( segid "    " and resid 1176 and name HB2 ))
 )(
   (( segid "    " and resid 1176 and name HD22))
 )
      5.000     5.000     0.000 peak  7493 weight  0.10000E+01 volume  0.11890E+01 ppm1      2.586 ppm2      6.806
 ASSI (
   (( segid "    " and resid 1175 and name HA  ))
 )(
   (( segid "    " and resid 1176 and name HN  ))
 )
      5.000     5.000     0.000 peak  3400 weight  0.10000E+01 volume -0.55700E+00 ppm1      3.965 ppm2      7.566
 ASSI (
   (( segid "    " and resid 1175 and name HB1 ))
 )(
   (( segid "    " and resid 1176 and name HN  ))
 )
      5.000     5.000     0.000 peak  8288 weight  0.10000E+01 volume  0.64500E+00 ppm1      2.061 ppm2      7.546
 ASSI (
   (( segid "    " and resid 1176 and name HB2 ))
 )(
   (( segid "    " and resid 1176 and name HN  ))
 )
      3.300     3.300     0.000 peak  8499 weight  0.10000E+01 volume  0.20160E+01 ppm1      2.582 ppm2      7.548
 ASSI (
   (( segid "    " and resid 1177 and name HD2 ))
  OR 
   (( segid "    " and resid 1177 and name HD1 ))
 )(
   (( segid "    " and resid 1177 and name HA  ))
 )
      6.000     6.000     0.000 peak  2934 weight  0.10000E+01 volume -0.20500E+00 ppm1      6.787 ppm2      4.733
 ASSI (
   (( segid "    " and resid 1227 and name HA  ))
 )(
   (( segid "    " and resid 1177 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6611 weight  0.10000E+01 volume -0.62200E+00 ppm1      4.549 ppm2      2.683
 ASSI (
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )(
   (( segid "    " and resid 1177 and name HE2 ))
  OR 
   (( segid "    " and resid 1177 and name HE1 ))
 )
      5.000     5.000     0.000 peak  7632 weight  0.10000E+01 volume  0.56400E+00 ppm1     -0.391 ppm2      6.579
 ASSI (
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )(
   (( segid "    " and resid 1177 and name HE2 ))
 )
      5.000     5.000     0.000 peak  7716 weight  0.10000E+01 volume -0.58900E+00 ppm1      6.789 ppm2      6.585
 ASSI (
   (( segid "    " and resid 1177 and name HA  ))
 )(
   (( segid "    " and resid 1177 and name HN  ))
 )
      5.000     5.000     0.000 peak  8453 weight  0.10000E+01 volume -0.61800E+00 ppm1      4.732 ppm2      7.886
 ASSI (
   (( segid "    " and resid 1177 and name HB1 ))
 )(
   (( segid "    " and resid 1177 and name HN  ))
 )
      5.000     5.000     0.000 peak  8467 weight  0.10000E+01 volume  0.53300E+00 ppm1      3.710 ppm2      7.898
 ASSI (
   (( segid "    " and resid 1177 and name HB2 ))
 )(
   (( segid "    " and resid 1177 and name HN  ))
 )
      5.000     5.000     0.000 peak  8458 weight  0.10000E+01 volume  0.76700E+00 ppm1      2.677 ppm2      7.881
 ASSI (
   (( segid "    " and resid 1178 and name HB1 ))
 )(
   (( segid "    " and resid 1178 and name HA  ))
 )
      5.000     5.000     0.000 peak  8424 weight  0.10000E+01 volume  0.43500E+00 ppm1      2.831 ppm2      3.926
 ASSI (
   (( segid "    " and resid 1178 and name HB2 ))
 )(
   (( segid "    " and resid 1178 and name HA  ))
 )
      5.000     5.000     0.000 peak  8425 weight  0.10000E+01 volume  0.58700E+00 ppm1      1.206 ppm2      3.921
 ASSI (
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )(
   (( segid "    " and resid 1178 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8091 weight  0.10000E+01 volume -0.54500E+00 ppm1      6.656 ppm2      2.813
 ASSI (
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )(
   (( segid "    " and resid 1178 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8097 weight  0.10000E+01 volume -0.39000E+00 ppm1      6.651 ppm2      1.200
 ASSI (
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )(
   (( segid "    " and resid 1178 and name HD21))
 )
      6.000     6.000     0.000 peak  8095 weight  0.10000E+01 volume -0.21200E+00 ppm1      6.641 ppm2      7.141
 ASSI (
   (( segid "    " and resid 1179 and name HB  ))
 )(
   (( segid "    " and resid 1179 and name HA  ))
 )
      5.000     5.000     0.000 peak  6326 weight  0.10000E+01 volume  0.72500E+00 ppm1      1.806 ppm2      5.236
 ASSI (
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )(
   (( segid "    " and resid 1179 and name HA  ))
 )
      5.000     5.000     0.000 peak  6361 weight  0.10000E+01 volume  0.10280E+01 ppm1      0.741 ppm2      5.229
 ASSI (
   (( segid "    " and resid 1201 and name HA  ))
 )(
   (( segid "    " and resid 1179 and name HA  ))
 )
      5.000     5.000     0.000 peak  6328 weight  0.10000E+01 volume -0.11610E+01 ppm1      5.103 ppm2      5.240
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1179 and name HB  ))
 )
      5.000     5.000     0.000 peak  7434 weight  0.10000E+01 volume  0.66800E+00 ppm1      0.370 ppm2      1.809
 ASSI (
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )(
   (( segid "    " and resid 1179 and name HB  ))
 )
      5.000     5.000     0.000 peak  6374 weight  0.10000E+01 volume  0.10960E+01 ppm1      0.741 ppm2      1.803
 ASSI (
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )(
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )
      6.000     6.000     0.000 peak  7741 weight  0.10000E+01 volume  0.28900E+00 ppm1     -0.392 ppm2      0.374
 ASSI (
   (( segid "    " and resid 1174 and name HG1 ))
 )(
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )
      6.000     6.000     0.000 peak  8543 weight  0.10000E+01 volume  0.22800E+00 ppm1      2.862 ppm2      0.378
 ASSI (
   (( segid "    " and resid 1174 and name HG2 ))
 )(
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )
      6.000     6.000     0.000 peak  8545 weight  0.10000E+01 volume  0.37100E+00 ppm1      2.009 ppm2      0.372
 ASSI (
   (( segid "    " and resid 1179 and name HA  ))
 )(
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )
      6.000     6.000     0.000 peak  6323 weight  0.10000E+01 volume -0.19700E+00 ppm1      5.226 ppm2      0.375
 ASSI (
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )(
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )
      3.300     3.300     0.000 peak  6376 weight  0.10000E+01 volume  0.24180E+01 ppm1      0.744 ppm2      0.374
 ASSI (
   (( segid "    " and resid 1225 and name HA  ))
 )(
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )
      5.000     5.000     0.000 peak  2808 weight  0.10000E+01 volume -0.54000E+00 ppm1      4.160 ppm2      0.381
 ASSI (
   (( segid "    " and resid 1225 and name HB1 ))
 )(
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )
      6.000     6.000     0.000 peak  7487 weight  0.10000E+01 volume  0.25700E+00 ppm1      2.541 ppm2      0.377
 ASSI (
   (( segid "    " and resid 1225 and name HB2 ))
 )(
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )
      6.000     6.000     0.000 peak  7488 weight  0.10000E+01 volume  0.26000E+00 ppm1      2.494 ppm2      0.378
 ASSI (
   (( segid "    " and resid 1226 and name HD2 ))
 )(
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )
      5.000     5.000     0.000 peak  7289 weight  0.10000E+01 volume -0.62900E+00 ppm1      2.855 ppm2      0.376
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )
      3.300     3.300     0.000 peak  7431 weight  0.10000E+01 volume  0.29040E+01 ppm1      0.374 ppm2      0.732
 ASSI (
   (( segid "    " and resid 1201 and name HA  ))
 )(
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )
      5.000     5.000     0.000 peak  6359 weight  0.10000E+01 volume -0.14090E+01 ppm1      5.102 ppm2      0.748
 ASSI (
   (( segid "    " and resid 1226 and name HD1 ))
 )(
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )
      6.000     6.000     0.000 peak  7306 weight  0.10000E+01 volume -0.34800E+00 ppm1      3.449 ppm2      0.706
 ASSI (
   (( segid "    " and resid 1226 and name HD2 ))
 )(
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )
      6.000     6.000     0.000 peak  7288 weight  0.10000E+01 volume -0.35100E+00 ppm1      2.853 ppm2      0.726
 ASSI (
   (( segid "    " and resid 1179 and name HA  ))
 )(
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6324 weight  0.10000E+01 volume -0.43800E+00 ppm1      5.227 ppm2      1.199
 ASSI (
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )(
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8388 weight  0.10000E+01 volume  0.46400E+00 ppm1      0.488 ppm2      1.212
 ASSI (
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )(
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
 )
      3.300     3.300     0.000 peak  8179 weight  0.10000E+01 volume  0.24720E+01 ppm1      0.612 ppm2      1.228
 ASSI (
   (( segid "    " and resid 1199 and name HA  ))
 )(
   (( segid "    " and resid 1181 and name HA  ))
 )
      5.000     5.000     0.000 peak  6312 weight  0.10000E+01 volume -0.78700E+00 ppm1      5.271 ppm2      4.349
 ASSI (
   (( segid "    " and resid 1181 and name HB2 ))
 )(
   (( segid "    " and resid 1181 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8374 weight  0.10000E+01 volume  0.11650E+01 ppm1      1.353 ppm2      1.523
 ASSI (
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )(
   (( segid "    " and resid 1181 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8402 weight  0.10000E+01 volume  0.11430E+01 ppm1      0.800 ppm2      1.517
 ASSI (
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )(
   (( segid "    " and resid 1181 and name HB1 ))
 )
      3.300     3.300     0.000 peak  8390 weight  0.10000E+01 volume  0.17240E+01 ppm1      0.491 ppm2      1.535
 ASSI (
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )(
   (( segid "    " and resid 1181 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8400 weight  0.10000E+01 volume  0.14330E+01 ppm1      0.800 ppm2      1.361
 ASSI (
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )(
   (( segid "    " and resid 1181 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8384 weight  0.10000E+01 volume  0.15320E+01 ppm1      0.491 ppm2      1.359
 ASSI (
   (( segid "    " and resid 1181 and name HA  ))
 )(
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )
      3.300     3.300     0.000 peak  6334 weight  0.10000E+01 volume -0.28410E+01 ppm1      4.352 ppm2      0.487
 ASSI (
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )(
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )
      2.700     2.700     0.000 peak  8399 weight  0.10000E+01 volume  0.32340E+01 ppm1      0.799 ppm2      0.492
 ASSI (
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )(
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )
      3.300     3.300     0.000 peak  7780 weight  0.10000E+01 volume  0.22070E+01 ppm1      0.146 ppm2      0.490
 ASSI (
   (( segid "    " and resid 1199 and name HA  ))
 )(
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )
      5.000     5.000     0.000 peak  6318 weight  0.10000E+01 volume -0.43200E+00 ppm1      5.273 ppm2      0.489
 ASSI (
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )(
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )
      5.000     5.000     0.000 peak  7789 weight  0.10000E+01 volume -0.41300E+00 ppm1      7.170 ppm2      0.503
 ASSI (
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )(
   (( segid "    " and resid 1181 and name HG  ))
 )
      3.300     3.300     0.000 peak  8389 weight  0.10000E+01 volume  0.22860E+01 ppm1      0.489 ppm2      1.602
 ASSI (
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )(
   (( segid "    " and resid 1181 and name HN  ))
 )
      5.000     5.000     0.000 peak  8396 weight  0.10000E+01 volume  0.60500E+00 ppm1      0.491 ppm2      8.342
 ASSI (
   (( segid "    " and resid 1182 and name HD1 ))
 )(
   (( segid "    " and resid 1182 and name HA  ))
 )
      6.000     6.000     0.000 peak  6859 weight  0.10000E+01 volume  0.37600E+00 ppm1      2.749 ppm2      3.790
 ASSI (
   (( segid "    " and resid 1182 and name HG2 ))
 )(
   (( segid "    " and resid 1182 and name HA  ))
 )
      6.000     6.000     0.000 peak  8352 weight  0.10000E+01 volume  0.17600E+00 ppm1      0.600 ppm2      3.792
 ASSI (
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
 )(
   (( segid "    " and resid 1182 and name HA  ))
 )
      5.000     5.000     0.000 peak  6861 weight  0.10000E+01 volume  0.50000E+00 ppm1      0.776 ppm2      3.796
 ASSI (
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )(
   (( segid "    " and resid 1182 and name HA  ))
 )
      5.000     5.000     0.000 peak  8181 weight  0.10000E+01 volume  0.73600E+00 ppm1      0.611 ppm2      3.795
 ASSI (
   (( segid "    " and resid 1182 and name HD1 ))
 )(
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7537 weight  0.10000E+01 volume  0.11460E+01 ppm1      2.750 ppm2      1.175
 ASSI (
   (( segid "    " and resid 1182 and name HD2 ))
 )(
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8063 weight  0.10000E+01 volume  0.10740E+01 ppm1      2.556 ppm2      1.172
 ASSI (
   (( segid "    " and resid 1182 and name HG1 ))
 )(
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9389 weight  0.10000E+01 volume  0.52600E+00 ppm1      0.893 ppm2      1.171
 ASSI (
   (( segid "    " and resid 1182 and name HG2 ))
 )(
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9390 weight  0.10000E+01 volume  0.63300E+00 ppm1      0.606 ppm2      1.171
 ASSI (
   (( segid "    " and resid 1182 and name HD2 ))
 )(
   (( segid "    " and resid 1182 and name HD1 ))
 )
      2.700     2.700     0.000 peak  8054 weight  0.10000E+01 volume  0.64380E+01 ppm1      2.556 ppm2      2.753
 ASSI (
   (( segid "    " and resid 1182 and name HB1 ))
 )(
   (( segid "    " and resid 1182 and name HD2 ))
 )
      6.000     6.000     0.000 peak  8363 weight  0.10000E+01 volume  0.16000E+00 ppm1      1.175 ppm2      2.557
 ASSI (
   (( segid "    " and resid 1182 and name HD1 ))
 )(
   (( segid "    " and resid 1182 and name HE  ))
 )
      6.000     6.000     0.000 peak  8046 weight  0.10000E+01 volume  0.28500E+00 ppm1      2.745 ppm2      6.762
 ASSI (
   (( segid "    " and resid 1182 and name HD2 ))
 )(
   (( segid "    " and resid 1182 and name HE  ))
 )
      6.000     6.000     0.000 peak  8047 weight  0.10000E+01 volume  0.22300E+00 ppm1      2.567 ppm2      6.760
 ASSI (
   (( segid "    " and resid 1182 and name HD1 ))
 )(
   (( segid "    " and resid 1182 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8065 weight  0.10000E+01 volume  0.99000E+00 ppm1      2.751 ppm2      0.902
 ASSI (
   (( segid "    " and resid 1182 and name HD2 ))
 )(
   (( segid "    " and resid 1182 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8064 weight  0.10000E+01 volume  0.78400E+00 ppm1      2.559 ppm2      0.905
 ASSI (
   (( segid "    " and resid 1182 and name HD1 ))
 )(
   (( segid "    " and resid 1182 and name HG2 ))
 )
      5.000     5.000     0.000 peak  8068 weight  0.10000E+01 volume  0.96900E+00 ppm1      2.753 ppm2      0.623
 ASSI (
   (( segid "    " and resid 1182 and name HD2 ))
 )(
   (( segid "    " and resid 1182 and name HG2 ))
 )
      5.000     5.000     0.000 peak  8069 weight  0.10000E+01 volume  0.11500E+01 ppm1      2.559 ppm2      0.617
 ASSI (
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )(
   (( segid "    " and resid 1182 and name HN  ))
 )
      5.000     5.000     0.000 peak  8395 weight  0.10000E+01 volume  0.54500E+00 ppm1      0.492 ppm2      8.092
 ASSI (
   (( segid "    " and resid 1182 and name HA  ))
 )(
   (( segid "    " and resid 1182 and name HN  ))
 )
      5.000     5.000     0.000 peak  6857 weight  0.10000E+01 volume -0.57200E+00 ppm1      3.796 ppm2      8.100
 ASSI (
   (( segid "    " and resid 1182 and name HB1 ))
 )(
   (( segid "    " and resid 1182 and name HN  ))
 )
      5.000     5.000     0.000 peak  8367 weight  0.10000E+01 volume  0.54900E+00 ppm1      1.189 ppm2      8.102
 ASSI (
   (( segid "    " and resid 1199 and name HA  ))
 )(
   (( segid "    " and resid 1182 and name HN  ))
 )
      5.000     5.000     0.000 peak  6309 weight  0.10000E+01 volume -0.56000E+00 ppm1      5.275 ppm2      8.097
 ASSI (
   (( segid "    " and resid 1183 and name HA  ))
 )(
   (( segid "    " and resid 1183 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6516 weight  0.10000E+01 volume -0.17110E+01 ppm1      4.864 ppm2      3.273
 ASSI (
   (( segid "    " and resid 1183 and name HE3 ))
 )(
   (( segid "    " and resid 1183 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8339 weight  0.10000E+01 volume -0.39100E+00 ppm1      7.650 ppm2      3.272
 ASSI (
   (( segid "    " and resid 1183 and name HE3 ))
 )(
   (( segid "    " and resid 1183 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8342 weight  0.10000E+01 volume -0.47300E+00 ppm1      7.650 ppm2      3.233
 ASSI (
   (( segid "    " and resid 1182 and name HA  ))
 )(
   (( segid "    " and resid 1183 and name HN  ))
 )
      5.000     5.000     0.000 peak  2875 weight  0.10000E+01 volume -0.72400E+00 ppm1      3.794 ppm2      8.466
 ASSI (
   (( segid "    " and resid 1183 and name HA  ))
 )(
   (( segid "    " and resid 1183 and name HN  ))
 )
      5.000     5.000     0.000 peak  6511 weight  0.10000E+01 volume -0.49200E+00 ppm1      4.864 ppm2      8.467
 ASSI (
   (( segid "    " and resid 1183 and name HD1 ))
 )(
   (( segid "    " and resid 1183 and name HN  ))
 )
      6.000     6.000     0.000 peak  9448 weight  0.10000E+01 volume -0.10500E+00 ppm1      7.308 ppm2      8.485
 ASSI (
   (( segid "    " and resid 1184 and name HG23))
  OR 
   (( segid "    " and resid 1184 and name HG22))
  OR 
   (( segid "    " and resid 1184 and name HG21))
 )(
   (( segid "    " and resid 1184 and name HA  ))
 )
      5.000     5.000     0.000 peak  6855 weight  0.10000E+01 volume  0.12130E+01 ppm1      1.112 ppm2      3.977
 ASSI (
   (( segid "    " and resid 1184 and name HA  ))
 )(
   (( segid "    " and resid 1184 and name HB  ))
 )
      2.700     2.700     0.000 peak  6850 weight  0.10000E+01 volume -0.31150E+01 ppm1      3.975 ppm2      4.180
 ASSI (
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
 )(
   (( segid "    " and resid 1184 and name HG23))
  OR 
   (( segid "    " and resid 1184 and name HG22))
  OR 
   (( segid "    " and resid 1184 and name HG21))
 )
      3.300     3.300     0.000 peak  8176 weight  0.10000E+01 volume  0.29700E+01 ppm1      0.785 ppm2      1.124
 ASSI (
   (( segid "    " and resid 1183 and name HA  ))
 )(
   (( segid "    " and resid 1184 and name HN  ))
 )
      5.000     5.000     0.000 peak  6513 weight  0.10000E+01 volume -0.14200E+01 ppm1      4.864 ppm2      7.580
 ASSI (
   (( segid "    " and resid 1185 and name HB3 ))
  OR 
   (( segid "    " and resid 1185 and name HB2 ))
  OR 
   (( segid "    " and resid 1185 and name HB1 ))
 )(
   (( segid "    " and resid 1185 and name HN  ))
 )
      3.300     3.300     0.000 peak  8330 weight  0.10000E+01 volume  0.25020E+01 ppm1      1.419 ppm2      8.251
 ASSI (
   (( segid "    " and resid 1185 and name HB3 ))
  OR 
   (( segid "    " and resid 1185 and name HB2 ))
  OR 
   (( segid "    " and resid 1185 and name HB1 ))
 )(
   (( segid "    " and resid 1186 and name HN  ))
 )
      5.000     5.000     0.000 peak  8329 weight  0.10000E+01 volume  0.11270E+01 ppm1      1.417 ppm2      7.735
 ASSI (
   (( segid "    " and resid 1175 and name HB1 ))
 )(
   (( segid "    " and resid 1187 and name HA  ))
 )
      5.000     5.000     0.000 peak  8293 weight  0.10000E+01 volume  0.13470E+01 ppm1      2.046 ppm2      4.147
 ASSI (
   (( segid "    " and resid 1187 and name HG1 ))
 )(
   (( segid "    " and resid 1187 and name HA  ))
 )
      5.000     5.000     0.000 peak  9374 weight  0.10000E+01 volume  0.78100E+00 ppm1      2.312 ppm2      4.137
 ASSI (
   (( segid "    " and resid 1187 and name HG2 ))
 )(
   (( segid "    " and resid 1187 and name HA  ))
 )
      5.000     5.000     0.000 peak  9375 weight  0.10000E+01 volume  0.54500E+00 ppm1      2.227 ppm2      4.141
 ASSI (
   (( segid "    " and resid 1171 and name HA  ))
 )(
   (( segid "    " and resid 1187 and name HG2 ))
 )
      5.000     5.000     0.000 peak  3485 weight  0.10000E+01 volume -0.11770E+01 ppm1      4.091 ppm2      2.231
 ASSI (
   (( segid "    " and resid 1188 and name HB1 ))
 )(
   (( segid "    " and resid 1187 and name HN  ))
 )
      5.000     5.000     0.000 peak  8301 weight  0.10000E+01 volume  0.78000E+00 ppm1      1.737 ppm2      8.049
 ASSI (
   (( segid "    " and resid 1188 and name HB2 ))
 )(
   (( segid "    " and resid 1187 and name HN  ))
 )
      5.000     5.000     0.000 peak  8906 weight  0.10000E+01 volume  0.54500E+00 ppm1      1.622 ppm2      8.043
 ASSI (
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )(
   (( segid "    " and resid 1189 and name HA  ))
 )
      5.000     5.000     0.000 peak  8583 weight  0.10000E+01 volume  0.44500E+00 ppm1      0.704 ppm2      4.346
 ASSI (
   (( segid "    " and resid 1189 and name HD13))
  OR 
   (( segid "    " and resid 1189 and name HD12))
  OR 
   (( segid "    " and resid 1189 and name HD11))
 )(
   (( segid "    " and resid 1189 and name HA  ))
 )
      5.000     5.000     0.000 peak  8256 weight  0.10000E+01 volume  0.43400E+00 ppm1      0.915 ppm2      4.351
 ASSI (
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
 )(
   (( segid "    " and resid 1189 and name HB1 ))
 )
      3.300     3.300     0.000 peak  9299 weight  0.10000E+01 volume  0.16140E+01 ppm1      0.763 ppm2      1.750
 ASSI (
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )(
   (( segid "    " and resid 1189 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7679 weight  0.10000E+01 volume -0.31400E+00 ppm1      6.844 ppm2      1.770
 ASSI (
   (( segid "    " and resid 1189 and name HB1 ))
 )(
   (( segid "    " and resid 1189 and name HD13))
  OR 
   (( segid "    " and resid 1189 and name HD12))
  OR 
   (( segid "    " and resid 1189 and name HD11))
 )
      5.000     5.000     0.000 peak  8265 weight  0.10000E+01 volume  0.12180E+01 ppm1      1.765 ppm2      0.922
 ASSI (
   (( segid "    " and resid 1189 and name HB2 ))
 )(
   (( segid "    " and resid 1189 and name HD13))
  OR 
   (( segid "    " and resid 1189 and name HD12))
  OR 
   (( segid "    " and resid 1189 and name HD11))
 )
      5.000     5.000     0.000 peak  8264 weight  0.10000E+01 volume  0.13880E+01 ppm1      1.561 ppm2      0.917
 ASSI (
   (( segid "    " and resid 1189 and name HG  ))
 )(
   (( segid "    " and resid 1189 and name HD13))
  OR 
   (( segid "    " and resid 1189 and name HD12))
  OR 
   (( segid "    " and resid 1189 and name HD11))
 )
      3.300     3.300     0.000 peak  9370 weight  0.10000E+01 volume  0.23360E+01 ppm1      1.513 ppm2      0.923
 ASSI (
   (( segid "    " and resid 1189 and name HA  ))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
 )
      3.300     3.300     0.000 peak  6960 weight  0.10000E+01 volume -0.28390E+01 ppm1      4.340 ppm2      0.773
 ASSI (
   (( segid "    " and resid 1189 and name HB2 ))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
 )
      5.000     5.000     0.000 peak  8258 weight  0.10000E+01 volume  0.88200E+00 ppm1      1.561 ppm2      0.773
 ASSI (
   (( segid "    " and resid 1189 and name HD13))
  OR 
   (( segid "    " and resid 1189 and name HD12))
  OR 
   (( segid "    " and resid 1189 and name HD11))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
 )
      2.700     2.700     0.000 peak  9613 weight  0.10000E+01 volume  0.35300E+01 ppm1      0.912 ppm2      0.760
 ASSI (
   (( segid "    " and resid 1189 and name HG  ))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
 )
      3.300     3.300     0.000 peak  9369 weight  0.10000E+01 volume  0.28250E+01 ppm1      1.513 ppm2      0.779
 ASSI (
   (( segid "    " and resid 1189 and name HB1 ))
 )(
   (( segid "    " and resid 1189 and name HN  ))
 )
      5.000     5.000     0.000 peak  8261 weight  0.10000E+01 volume  0.66900E+00 ppm1      1.766 ppm2      8.436
 ASSI (
   (( segid "    " and resid 1189 and name HB2 ))
 )(
   (( segid "    " and resid 1189 and name HN  ))
 )
      5.000     5.000     0.000 peak  8260 weight  0.10000E+01 volume  0.72100E+00 ppm1      1.561 ppm2      8.443
 ASSI (
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )(
   (( segid "    " and resid 1190 and name HA  ))
 )
      6.000     6.000     0.000 peak  7681 weight  0.10000E+01 volume -0.13600E+00 ppm1      6.850 ppm2      5.369
 ASSI (
   (( segid "    " and resid 1190 and name HA  ))
 )(
   (( segid "    " and resid 1190 and name HB2 ))
  OR 
   (( segid "    " and resid 1190 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6290 weight  0.10000E+01 volume -0.16210E+01 ppm1      5.355 ppm2      2.793
 ASSI (
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )(
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7687 weight  0.10000E+01 volume  0.54200E+00 ppm1      0.432 ppm2      6.846
 ASSI (
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7688 weight  0.10000E+01 volume  0.33700E+00 ppm1      0.629 ppm2      6.842
 ASSI (
   (( segid "    " and resid 1189 and name HB1 ))
 )(
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9608 weight  0.10000E+01 volume  0.21000E+00 ppm1      1.765 ppm2      6.852
 ASSI (
   (( segid "    " and resid 1190 and name HB2 ))
  OR 
   (( segid "    " and resid 1190 and name HB1 ))
 )(
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8252 weight  0.10000E+01 volume  0.65700E+00 ppm1      2.763 ppm2      6.845
 ASSI (
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )(
   (( segid "    " and resid 1190 and name HE2 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )
      6.000     6.000     0.000 peak  7849 weight  0.10000E+01 volume  0.37700E+00 ppm1      0.431 ppm2      6.699
 ASSI (
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
 )(
   (( segid "    " and resid 1190 and name HE2 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )
      6.000     6.000     0.000 peak  9297 weight  0.10000E+01 volume  0.19900E+00 ppm1      0.767 ppm2      6.738
 ASSI (
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )(
   (( segid "    " and resid 1190 and name HE2 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )
      2.700     2.700     0.000 peak  7683 weight  0.10000E+01 volume -0.31000E+01 ppm1      6.848 ppm2      6.735
 ASSI (
   (( segid "    " and resid 1189 and name HA  ))
 )(
   (( segid "    " and resid 1190 and name HN  ))
 )
      5.000     5.000     0.000 peak  8254 weight  0.10000E+01 volume -0.90500E+00 ppm1      4.337 ppm2      7.385
 ASSI (
   (( segid "    " and resid 1189 and name HD13))
  OR 
   (( segid "    " and resid 1189 and name HD12))
  OR 
   (( segid "    " and resid 1189 and name HD11))
 )(
   (( segid "    " and resid 1190 and name HN  ))
 )
      6.000     6.000     0.000 peak  7454 weight  0.10000E+01 volume  0.24400E+00 ppm1      0.913 ppm2      7.368
 ASSI (
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
 )(
   (( segid "    " and resid 1190 and name HN  ))
 )
      6.000     6.000     0.000 peak  9296 weight  0.10000E+01 volume  0.18700E+00 ppm1      0.767 ppm2      7.375
 ASSI (
   (( segid "    " and resid 1190 and name HB2 ))
  OR 
   (( segid "    " and resid 1190 and name HB1 ))
 )(
   (( segid "    " and resid 1190 and name HN  ))
 )
      5.000     5.000     0.000 peak  8250 weight  0.10000E+01 volume  0.56900E+00 ppm1      2.763 ppm2      7.384
 ASSI (
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )(
   (( segid "    " and resid 1190 and name HN  ))
 )
      6.000     6.000     0.000 peak  7682 weight  0.10000E+01 volume -0.37300E+00 ppm1      6.848 ppm2      7.388
 ASSI (
   (( segid "    " and resid 1168 and name HA  ))
 )(
   (( segid "    " and resid 1191 and name HN  ))
 )
      6.000     6.000     0.000 peak  8617 weight  0.10000E+01 volume -0.22800E+00 ppm1      4.203 ppm2      8.839
 ASSI (
   (( segid "    " and resid 1190 and name HB2 ))
  OR 
   (( segid "    " and resid 1190 and name HB1 ))
 )(
   (( segid "    " and resid 1191 and name HN  ))
 )
      6.000     6.000     0.000 peak  8251 weight  0.10000E+01 volume  0.33500E+00 ppm1      2.766 ppm2      8.855
 ASSI (
   (( segid "    " and resid 1192 and name HA  ))
 )(
   (( segid "    " and resid 1192 and name HN  ))
 )
      5.000     5.000     0.000 peak  6832 weight  0.10000E+01 volume -0.59300E+00 ppm1      4.246 ppm2      8.797
 ASSI (
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )(
   (( segid "    " and resid 1193 and name HA  ))
 )
      5.000     5.000     0.000 peak  6825 weight  0.10000E+01 volume  0.82700E+00 ppm1      0.413 ppm2      3.665
 ASSI (
   (( segid "    " and resid 1143 and name HG2 ))
  OR 
   (( segid "    " and resid 1143 and name HG1 ))
 )(
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )
      5.000     5.000     0.000 peak  9310 weight  0.10000E+01 volume  0.41500E+00 ppm1      2.175 ppm2      0.416
 ASSI (
   (( segid "    " and resid 1145 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG1 ))
 )(
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )
      6.000     6.000     0.000 peak  8672 weight  0.10000E+01 volume  0.12200E+00 ppm1      2.262 ppm2      0.417
 ASSI (
   (( segid "    " and resid 1164 and name HG  ))
 )(
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )
      3.300     3.300     0.000 peak  8662 weight  0.10000E+01 volume  0.17720E+01 ppm1      0.636 ppm2      0.414
 ASSI (
   (( segid "    " and resid 1193 and name HB  ))
 )(
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )
      5.000     5.000     0.000 peak  8243 weight  0.10000E+01 volume -0.12830E+01 ppm1      3.564 ppm2      0.420
 ASSI (
   (( segid "    " and resid 1194 and name HA1 ))
 )(
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )
      6.000     6.000     0.000 peak  6820 weight  0.10000E+01 volume -0.23100E+00 ppm1      4.406 ppm2      0.422
 ASSI (
   (( segid "    " and resid 1194 and name HA2 ))
 )(
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )
      6.000     6.000     0.000 peak  6743 weight  0.10000E+01 volume -0.31600E+00 ppm1      3.586 ppm2      0.412
 ASSI (
   (( segid "    " and resid 1166 and name HA  ))
 )(
   (( segid "    " and resid 1193 and name HN  ))
 )
      6.000     6.000     0.000 peak  6518 weight  0.10000E+01 volume -0.29800E+00 ppm1      4.843 ppm2      9.062
 ASSI (
   (( segid "    " and resid 1192 and name HA  ))
 )(
   (( segid "    " and resid 1193 and name HN  ))
 )
      5.000     5.000     0.000 peak  6829 weight  0.10000E+01 volume -0.63700E+00 ppm1      4.248 ppm2      9.059
 ASSI (
   (( segid "    " and resid 1193 and name HB  ))
 )(
   (( segid "    " and resid 1193 and name HN  ))
 )
      5.000     5.000     0.000 peak  8238 weight  0.10000E+01 volume -0.54100E+00 ppm1      3.563 ppm2      9.058
 ASSI (
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
 )(
   (( segid "    " and resid 1194 and name HA1 ))
 )
      5.000     5.000     0.000 peak  9323 weight  0.10000E+01 volume  0.53800E+00 ppm1      1.046 ppm2      4.400
 ASSI (
   (( segid "    " and resid 1194 and name HA1 ))
 )(
   (( segid "    " and resid 1194 and name HA2 ))
 )
      2.700     2.700     0.000 peak  6745 weight  0.10000E+01 volume -0.33570E+01 ppm1      4.410 ppm2      3.590
 ASSI (
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
 )(
   (( segid "    " and resid 1194 and name HA2 ))
 )
      5.000     5.000     0.000 peak  8233 weight  0.10000E+01 volume  0.68400E+00 ppm1      1.045 ppm2      3.588
 ASSI (
   (( segid "    " and resid 1194 and name HA1 ))
 )(
   (( segid "    " and resid 1194 and name HN  ))
 )
      5.000     5.000     0.000 peak  6816 weight  0.10000E+01 volume -0.44600E+00 ppm1      4.412 ppm2      9.167
 ASSI (
   (( segid "    " and resid 1194 and name HA2 ))
 )(
   (( segid "    " and resid 1194 and name HN  ))
 )
      5.000     5.000     0.000 peak  6744 weight  0.10000E+01 volume -0.66200E+00 ppm1      3.588 ppm2      9.165
 ASSI (
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
 )(
   (( segid "    " and resid 1194 and name HN  ))
 )
      5.000     5.000     0.000 peak  9328 weight  0.10000E+01 volume  0.46700E+00 ppm1      1.045 ppm2      9.162
 ASSI (
   (( segid "    " and resid 1191 and name HB1 ))
 )(
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7800 weight  0.10000E+01 volume -0.91200E+00 ppm1      3.546 ppm2      2.144
 ASSI (
   (( segid "    " and resid 1191 and name HB2 ))
 )(
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7801 weight  0.10000E+01 volume -0.93100E+00 ppm1      3.439 ppm2      2.143
 ASSI (
   (( segid "    " and resid 1192 and name HB2 ))
 )(
   (( segid "    " and resid 1195 and name HG1 ))
 )
      5.000     5.000     0.000 peak  9714 weight  0.10000E+01 volume  0.44500E+00 ppm1      1.468 ppm2      2.243
 ASSI (
   (( segid "    " and resid 1192 and name HB2 ))
 )(
   (( segid "    " and resid 1195 and name HG2 ))
 )
      5.000     5.000     0.000 peak  9712 weight  0.10000E+01 volume  0.59500E+00 ppm1      1.468 ppm2      2.156
 ASSI (
   (( segid "    " and resid 1196 and name HB2 ))
  OR 
   (( segid "    " and resid 1196 and name HB1 ))
 )(
   (( segid "    " and resid 1196 and name HA  ))
 )
      3.300     3.300     0.000 peak  7985 weight  0.10000E+01 volume -0.26540E+01 ppm1      3.653 ppm2      5.150
 ASSI (
   (( segid "    " and resid 1217 and name HA  ))
 )(
   (( segid "    " and resid 1196 and name HA  ))
 )
      3.300     3.300     0.000 peak  6336 weight  0.10000E+01 volume -0.16850E+01 ppm1      4.807 ppm2      5.149
 ASSI (
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
 )(
   (( segid "    " and resid 1196 and name HA  ))
 )
      6.000     6.000     0.000 peak  6339 weight  0.10000E+01 volume  0.36500E+00 ppm1      1.046 ppm2      5.154
 ASSI (
   (( segid "    " and resid 1217 and name HA  ))
 )(
   (( segid "    " and resid 1196 and name HB2 ))
  OR 
   (( segid "    " and resid 1196 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6530 weight  0.10000E+01 volume -0.69500E+00 ppm1      4.805 ppm2      3.657
 ASSI (
   (( segid "    " and resid 1195 and name HA  ))
 )(
   (( segid "    " and resid 1196 and name HN  ))
 )
      2.700     2.700     0.000 peak  6813 weight  0.10000E+01 volume -0.38440E+01 ppm1      4.427 ppm2      8.478
 ASSI (
   (( segid "    " and resid 1196 and name HA  ))
 )(
   (( segid "    " and resid 1196 and name HN  ))
 )
      5.000     5.000     0.000 peak  6332 weight  0.10000E+01 volume -0.49900E+00 ppm1      5.148 ppm2      8.477
 ASSI (
   (( segid "    " and resid 1196 and name HB2 ))
  OR 
   (( segid "    " and resid 1196 and name HB1 ))
 )(
   (( segid "    " and resid 1196 and name HN  ))
 )
      2.700     2.700     0.000 peak  7984 weight  0.10000E+01 volume -0.32210E+01 ppm1      3.654 ppm2      8.483
 ASSI (
   (( segid "    " and resid 1197 and name HB  ))
 )(
   (( segid "    " and resid 1197 and name HA  ))
 )
      5.000     5.000     0.000 peak  6807 weight  0.10000E+01 volume  0.44000E+00 ppm1      1.548 ppm2      4.036
 ASSI (
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
 )(
   (( segid "    " and resid 1197 and name HA  ))
 )
      5.000     5.000     0.000 peak  6808 weight  0.10000E+01 volume  0.91400E+00 ppm1      0.622 ppm2      4.041
 ASSI (
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )(
   (( segid "    " and resid 1197 and name HA  ))
 )
      5.000     5.000     0.000 peak  6809 weight  0.10000E+01 volume  0.97100E+00 ppm1      0.150 ppm2      4.040
 ASSI (
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
 )(
   (( segid "    " and resid 1197 and name HB  ))
 )
      3.300     3.300     0.000 peak  8225 weight  0.10000E+01 volume  0.26410E+01 ppm1      0.623 ppm2      1.545
 ASSI (
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )(
   (( segid "    " and resid 1197 and name HB  ))
 )
      5.000     5.000     0.000 peak  9293 weight  0.10000E+01 volume  0.45200E+00 ppm1      0.527 ppm2      1.546
 ASSI (
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )(
   (( segid "    " and resid 1197 and name HB  ))
 )
      5.000     5.000     0.000 peak  7857 weight  0.10000E+01 volume  0.52400E+00 ppm1      0.411 ppm2      1.547
 ASSI (
   (( segid "    " and resid 1191 and name HB1 ))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
 )
      5.000     5.000     0.000 peak  7798 weight  0.10000E+01 volume -0.15910E+01 ppm1      3.545 ppm2      0.633
 ASSI (
   (( segid "    " and resid 1191 and name HB2 ))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
 )
      5.000     5.000     0.000 peak  7799 weight  0.10000E+01 volume -0.14810E+01 ppm1      3.438 ppm2      0.631
 ASSI (
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
 )
      2.700     2.700     0.000 peak  7779 weight  0.10000E+01 volume  0.40690E+01 ppm1      0.146 ppm2      0.633
 ASSI (
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )(
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )
      5.000     5.000     0.000 peak  8592 weight  0.10000E+01 volume  0.11010E+01 ppm1      0.700 ppm2      0.151
 ASSI (
   (( segid "    " and resid 1197 and name HB  ))
 )(
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )
      3.300     3.300     0.000 peak  8216 weight  0.10000E+01 volume  0.17640E+01 ppm1      1.543 ppm2      0.147
 ASSI (
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )(
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )
      6.000     6.000     0.000 peak  7783 weight  0.10000E+01 volume -0.26900E+00 ppm1      7.173 ppm2      0.137
 ASSI (
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
 )(
   (( segid "    " and resid 1197 and name HN  ))
 )
      5.000     5.000     0.000 peak  8229 weight  0.10000E+01 volume  0.44700E+00 ppm1      0.618 ppm2      8.971
 ASSI (
   (( segid "    " and resid 1217 and name HA  ))
 )(
   (( segid "    " and resid 1197 and name HN  ))
 )
      5.000     5.000     0.000 peak  6527 weight  0.10000E+01 volume -0.69800E+00 ppm1      4.806 ppm2      8.969
 ASSI (
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )(
   (( segid "    " and resid 1197 and name HN  ))
 )
      5.000     5.000     0.000 peak  7837 weight  0.10000E+01 volume  0.43200E+00 ppm1      0.527 ppm2      8.961
 ASSI (
   (( segid "    " and resid 1198 and name HB2 ))
 )(
   (( segid "    " and resid 1198 and name HA  ))
 )
      5.000     5.000     0.000 peak  8209 weight  0.10000E+01 volume  0.59800E+00 ppm1      1.788 ppm2      4.788
 ASSI (
   (( segid "    " and resid 1198 and name HG1 ))
 )(
   (( segid "    " and resid 1198 and name HA  ))
 )
      5.000     5.000     0.000 peak  9361 weight  0.10000E+01 volume  0.42800E+00 ppm1      2.172 ppm2      4.791
 ASSI (
   (( segid "    " and resid 1198 and name HG2 ))
 )(
   (( segid "    " and resid 1198 and name HA  ))
 )
      6.000     6.000     0.000 peak  5470 weight  0.10000E+01 volume  0.38700E+00 ppm1      2.048 ppm2      4.791
 ASSI (
   (( segid "    " and resid 1182 and name HB2 ))
 )(
   (( segid "    " and resid 1198 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8361 weight  0.10000E+01 volume  0.18900E+00 ppm1      1.160 ppm2      1.885
 ASSI (
   (( segid "    " and resid 1182 and name HD1 ))
 )(
   (( segid "    " and resid 1198 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8059 weight  0.10000E+01 volume  0.46800E+00 ppm1      2.750 ppm2      1.890
 ASSI (
   (( segid "    " and resid 1182 and name HD2 ))
 )(
   (( segid "    " and resid 1198 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8061 weight  0.10000E+01 volume  0.34500E+00 ppm1      2.556 ppm2      1.884
 ASSI (
   (( segid "    " and resid 1182 and name HD1 ))
 )(
   (( segid "    " and resid 1198 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8060 weight  0.10000E+01 volume  0.37300E+00 ppm1      2.751 ppm2      1.783
 ASSI (
   (( segid "    " and resid 1215 and name HG2 ))
  OR 
   (( segid "    " and resid 1215 and name HG1 ))
 )(
   (( segid "    " and resid 1198 and name HG1 ))
 )
      5.000     5.000     0.000 peak  9273 weight  0.10000E+01 volume  0.47200E+00 ppm1      1.454 ppm2      2.177
 ASSI (
   (( segid "    " and resid 1215 and name HG2 ))
  OR 
   (( segid "    " and resid 1215 and name HG1 ))
 )(
   (( segid "    " and resid 1198 and name HG2 ))
 )
      5.000     5.000     0.000 peak  9274 weight  0.10000E+01 volume  0.48300E+00 ppm1      1.455 ppm2      2.040
 ASSI (
   (( segid "    " and resid 1197 and name HA  ))
 )(
   (( segid "    " and resid 1198 and name HN  ))
 )
      2.700     2.700     0.000 peak  6800 weight  0.10000E+01 volume -0.36600E+01 ppm1      4.039 ppm2      7.957
 ASSI (
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
 )(
   (( segid "    " and resid 1198 and name HN  ))
 )
      5.000     5.000     0.000 peak  8228 weight  0.10000E+01 volume  0.40000E+00 ppm1      0.621 ppm2      7.958
 ASSI (
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )(
   (( segid "    " and resid 1198 and name HN  ))
 )
      5.000     5.000     0.000 peak  7775 weight  0.10000E+01 volume  0.63800E+00 ppm1      0.147 ppm2      7.957
 ASSI (
   (( segid "    " and resid 1198 and name HB1 ))
 )(
   (( segid "    " and resid 1198 and name HN  ))
 )
      5.000     5.000     0.000 peak  8212 weight  0.10000E+01 volume  0.59900E+00 ppm1      1.886 ppm2      7.958
 ASSI (
   (( segid "    " and resid 1198 and name HB2 ))
 )(
   (( segid "    " and resid 1198 and name HN  ))
 )
      5.000     5.000     0.000 peak  8213 weight  0.10000E+01 volume  0.64000E+00 ppm1      1.792 ppm2      7.956
 ASSI (
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )(
   (( segid "    " and resid 1199 and name HA  ))
 )
      6.000     6.000     0.000 peak  6311 weight  0.10000E+01 volume -0.26200E+00 ppm1      7.162 ppm2      5.276
 ASSI (
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )(
   (( segid "    " and resid 1199 and name HA  ))
 )
      6.000     6.000     0.000 peak  8187 weight  0.10000E+01 volume  0.33200E+00 ppm1      0.612 ppm2      5.262
 ASSI (
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )(
   (( segid "    " and resid 1199 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8195 weight  0.10000E+01 volume -0.30300E+00 ppm1      7.159 ppm2      3.141
 ASSI (
   (( segid "    " and resid 1199 and name HB2 ))
 )(
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8191 weight  0.10000E+01 volume  0.59500E+00 ppm1      2.911 ppm2      7.157
 ASSI (
   (( segid "    " and resid 1226 and name HG1 ))
 )(
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8197 weight  0.10000E+01 volume  0.24800E+00 ppm1      2.061 ppm2      7.157
 ASSI (
   (( segid "    " and resid 1226 and name HG2 ))
 )(
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8199 weight  0.10000E+01 volume  0.25600E+00 ppm1      1.684 ppm2      7.151
 ASSI (
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )
      5.000     5.000     0.000 peak  8605 weight  0.10000E+01 volume  0.70500E+00 ppm1      1.027 ppm2      7.169
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )
      5.000     5.000     0.000 peak  7443 weight  0.10000E+01 volume  0.71200E+00 ppm1      0.371 ppm2      7.163
 ASSI (
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )
      5.000     5.000     0.000 peak  8394 weight  0.10000E+01 volume  0.12530E+01 ppm1      0.491 ppm2      7.166
 ASSI (
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
 )
      3.300     3.300     0.000 peak  7880 weight  0.10000E+01 volume  0.29630E+01 ppm1      1.136 ppm2      7.165
 ASSI (
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )
      5.000     5.000     0.000 peak  7835 weight  0.10000E+01 volume  0.59400E+00 ppm1      0.529 ppm2      7.170
 ASSI (
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )
      5.000     5.000     0.000 peak  7846 weight  0.10000E+01 volume  0.50900E+00 ppm1      0.409 ppm2      7.169
 ASSI (
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
 )(
   (( segid "    " and resid 1199 and name HN  ))
 )
      6.000     6.000     0.000 peak  8354 weight  0.10000E+01 volume  0.25200E+00 ppm1      1.176 ppm2      8.463
 ASSI (
   (( segid "    " and resid 1198 and name HG1 ))
 )(
   (( segid "    " and resid 1199 and name HN  ))
 )
      5.000     5.000     0.000 peak  9446 weight  0.10000E+01 volume  0.69700E+00 ppm1      2.173 ppm2      8.460
 ASSI (
   (( segid "    " and resid 1198 and name HG2 ))
 )(
   (( segid "    " and resid 1199 and name HN  ))
 )
      5.000     5.000     0.000 peak  9365 weight  0.10000E+01 volume  0.40600E+00 ppm1      2.051 ppm2      8.460
 ASSI (
   (( segid "    " and resid 1199 and name HA  ))
 )(
   (( segid "    " and resid 1199 and name HN  ))
 )
      5.000     5.000     0.000 peak  6308 weight  0.10000E+01 volume -0.42600E+00 ppm1      5.272 ppm2      8.460
 ASSI (
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )(
   (( segid "    " and resid 1199 and name HN  ))
 )
      5.000     5.000     0.000 peak  7914 weight  0.10000E+01 volume  0.65500E+00 ppm1      0.687 ppm2      8.458
 ASSI (
   (( segid "    " and resid 1215 and name HA  ))
 )(
   (( segid "    " and resid 1199 and name HN  ))
 )
      5.000     5.000     0.000 peak  6294 weight  0.10000E+01 volume -0.45400E+00 ppm1      5.275 ppm2      8.463
 ASSI (
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )(
   (( segid "    " and resid 1200 and name HA  ))
 )
      5.000     5.000     0.000 peak  8182 weight  0.10000E+01 volume  0.63700E+00 ppm1      0.609 ppm2      4.582
 ASSI (
   (( segid "    " and resid 1200 and name HA  ))
 )(
   (( segid "    " and resid 1200 and name HB  ))
 )
      3.300     3.300     0.000 peak  2463 weight  0.10000E+01 volume -0.16710E+01 ppm1      4.582 ppm2      2.109
 ASSI (
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
 )(
   (( segid "    " and resid 1200 and name HB  ))
 )
      3.300     3.300     0.000 peak  8174 weight  0.10000E+01 volume  0.24610E+01 ppm1      0.783 ppm2      2.111
 ASSI (
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )(
   (( segid "    " and resid 1200 and name HB  ))
 )
      2.700     2.700     0.000 peak  8178 weight  0.10000E+01 volume  0.33700E+01 ppm1      0.614 ppm2      2.110
 ASSI (
   (( segid "    " and resid 1200 and name HA  ))
 )(
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
 )
      3.300     3.300     0.000 peak  6768 weight  0.10000E+01 volume -0.17370E+01 ppm1      4.582 ppm2      0.780
 ASSI (
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )(
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
 )
      2.700     2.700     0.000 peak  8180 weight  0.10000E+01 volume  0.70580E+01 ppm1      0.609 ppm2      0.784
 ASSI (
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
 )(
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )
      2.700     2.700     0.000 peak  8419 weight  0.10000E+01 volume  0.31290E+01 ppm1      1.222 ppm2      0.620
 ASSI (
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )(
   (( segid "    " and resid 1201 and name HA  ))
 )
      6.000     6.000     0.000 peak  8188 weight  0.10000E+01 volume  0.12800E+00 ppm1      0.611 ppm2      5.108
 ASSI (
   (( segid "    " and resid 1201 and name HB2 ))
 )(
   (( segid "    " and resid 1201 and name HA  ))
 )
      5.000     5.000     0.000 peak  6358 weight  0.10000E+01 volume  0.72300E+00 ppm1      2.680 ppm2      5.106
 ASSI (
   (( segid "    " and resid 1201 and name HA  ))
 )(
   (( segid "    " and resid 1201 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6355 weight  0.10000E+01 volume -0.10870E+01 ppm1      5.103 ppm2      3.031
 ASSI (
   (( segid "    " and resid 1228 and name HB1 ))
 )(
   (( segid "    " and resid 1201 and name HB2 ))
 )
      3.300     3.300     0.000 peak  8165 weight  0.10000E+01 volume -0.16710E+01 ppm1      3.712 ppm2      2.675
 ASSI (
   (( segid "    " and resid 1201 and name HA  ))
 )(
   (( segid "    " and resid 1201 and name HN  ))
 )
      5.000     5.000     0.000 peak  6353 weight  0.10000E+01 volume -0.62900E+00 ppm1      5.104 ppm2      8.457
 ASSI (
   (( segid "    " and resid 1201 and name HB1 ))
 )(
   (( segid "    " and resid 1201 and name HN  ))
 )
      5.000     5.000     0.000 peak  8154 weight  0.10000E+01 volume  0.41900E+00 ppm1      3.020 ppm2      8.460
 ASSI (
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
 )(
   (( segid "    " and resid 1202 and name HA  ))
 )
      6.000     6.000     0.000 peak  8416 weight  0.10000E+01 volume  0.39300E+00 ppm1      1.222 ppm2      3.959
 ASSI (
   (( segid "    " and resid 1202 and name HB2 ))
 )(
   (( segid "    " and resid 1202 and name HA  ))
 )
      5.000     5.000     0.000 peak  6763 weight  0.10000E+01 volume  0.59900E+00 ppm1      1.059 ppm2      3.967
 ASSI (
   (( segid "    " and resid 1202 and name HG1 ))
 )(
   (( segid "    " and resid 1202 and name HA  ))
 )
      5.000     5.000     0.000 peak  9344 weight  0.10000E+01 volume  0.62800E+00 ppm1      1.180 ppm2      3.959
 ASSI (
   (( segid "    " and resid 1202 and name HG2 ))
 )(
   (( segid "    " and resid 1202 and name HA  ))
 )
      6.000     6.000     0.000 peak  9353 weight  0.10000E+01 volume  0.28300E+00 ppm1      1.013 ppm2      3.955
 ASSI (
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )(
   (( segid "    " and resid 1202 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8096 weight  0.10000E+01 volume -0.41400E+00 ppm1      6.651 ppm2      1.060
 ASSI (
   (( segid "    " and resid 1231 and name HB2 ))
 )(
   (( segid "    " and resid 1202 and name HD2 ))
 )
      5.000     5.000     0.000 peak  7332 weight  0.10000E+01 volume  0.48000E+00 ppm1      1.545 ppm2      1.309
 ASSI (
   (( segid "    " and resid 1202 and name HD1 ))
 )(
   (( segid "    " and resid 1202 and name HE2 ))
  OR 
   (( segid "    " and resid 1202 and name HE1 ))
 )
      5.000     5.000     0.000 peak  9592 weight  0.10000E+01 volume  0.84000E+00 ppm1      1.392 ppm2      2.855
 ASSI (
   (( segid "    " and resid 1202 and name HD2 ))
 )(
   (( segid "    " and resid 1202 and name HE2 ))
  OR 
   (( segid "    " and resid 1202 and name HE1 ))
 )
      5.000     5.000     0.000 peak  9593 weight  0.10000E+01 volume  0.66300E+00 ppm1      1.301 ppm2      2.855
 ASSI (
   (( segid "    " and resid 1202 and name HG1 ))
 )(
   (( segid "    " and resid 1202 and name HE2 ))
  OR 
   (( segid "    " and resid 1202 and name HE1 ))
 )
      6.000     6.000     0.000 peak  9357 weight  0.10000E+01 volume  0.37500E+00 ppm1      1.187 ppm2      2.845
 ASSI (
   (( segid "    " and resid 1202 and name HG2 ))
 )(
   (( segid "    " and resid 1202 and name HE2 ))
  OR 
   (( segid "    " and resid 1202 and name HE1 ))
 )
      6.000     6.000     0.000 peak  9358 weight  0.10000E+01 volume  0.38700E+00 ppm1      1.024 ppm2      2.845
 ASSI (
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
 )(
   (( segid "    " and resid 1202 and name HE1 ))
 )
      6.000     6.000     0.000 peak  8417 weight  0.10000E+01 volume  0.31400E+00 ppm1      1.223 ppm2      2.866
 ASSI (
   (( segid "    " and resid 1202 and name HD1 ))
 )(
   (( segid "    " and resid 1202 and name HG1 ))
 )
      5.000     5.000     0.000 peak  9590 weight  0.10000E+01 volume  0.98700E+00 ppm1      1.395 ppm2      1.186
 ASSI (
   (( segid "    " and resid 1202 and name HD2 ))
 )(
   (( segid "    " and resid 1202 and name HG1 ))
 )
      5.000     5.000     0.000 peak  9591 weight  0.10000E+01 volume  0.10290E+01 ppm1      1.297 ppm2      1.186
 ASSI (
   (( segid "    " and resid 1179 and name HA  ))
 )(
   (( segid "    " and resid 1202 and name HN  ))
 )
      5.000     5.000     0.000 peak  6329 weight  0.10000E+01 volume -0.88700E+00 ppm1      5.227 ppm2      7.935
 ASSI (
   (( segid "    " and resid 1201 and name HA  ))
 )(
   (( segid "    " and resid 1202 and name HN  ))
 )
      3.300     3.300     0.000 peak  6352 weight  0.10000E+01 volume -0.19650E+01 ppm1      5.102 ppm2      7.941
 ASSI (
   (( segid "    " and resid 1202 and name HA  ))
 )(
   (( segid "    " and resid 1202 and name HN  ))
 )
      5.000     5.000     0.000 peak  6755 weight  0.10000E+01 volume -0.58300E+00 ppm1      3.962 ppm2      7.941
 ASSI (
   (( segid "    " and resid 1202 and name HB2 ))
 )(
   (( segid "    " and resid 1202 and name HN  ))
 )
      5.000     5.000     0.000 peak  8139 weight  0.10000E+01 volume  0.52200E+00 ppm1      1.063 ppm2      7.943
 ASSI (
   (( segid "    " and resid 1202 and name HG1 ))
 )(
   (( segid "    " and resid 1202 and name HN  ))
 )
      6.000     6.000     0.000 peak  9355 weight  0.10000E+01 volume  0.26800E+00 ppm1      1.186 ppm2      7.934
 ASSI (
   (( segid "    " and resid 1202 and name HG2 ))
 )(
   (( segid "    " and resid 1202 and name HN  ))
 )
      6.000     6.000     0.000 peak  9354 weight  0.10000E+01 volume  0.36200E+00 ppm1      1.017 ppm2      7.936
 ASSI (
   (( segid "    " and resid 1203 and name HG1 ))
 )(
   (( segid "    " and resid 1203 and name HA  ))
 )
      5.000     5.000     0.000 peak  9350 weight  0.10000E+01 volume  0.81000E+00 ppm1      1.755 ppm2      4.102
 ASSI (
   (( segid "    " and resid 1231 and name HB2 ))
 )(
   (( segid "    " and resid 1203 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7330 weight  0.10000E+01 volume  0.39200E+00 ppm1      1.546 ppm2      1.861
 ASSI (
   (( segid "    " and resid 1203 and name HA  ))
 )(
   (( segid "    " and resid 1203 and name HB2 ))
 )
      3.300     3.300     0.000 peak  6752 weight  0.10000E+01 volume -0.21620E+01 ppm1      4.095 ppm2      1.757
 ASSI (
   (( segid "    " and resid 1203 and name HA  ))
 )(
   (( segid "    " and resid 1203 and name HD2 ))
  OR 
   (( segid "    " and resid 1203 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6750 weight  0.10000E+01 volume -0.30900E+00 ppm1      4.096 ppm2      3.244
 ASSI (
   (( segid "    " and resid 1203 and name HG1 ))
 )(
   (( segid "    " and resid 1203 and name HD2 ))
  OR 
   (( segid "    " and resid 1203 and name HD1 ))
 )
      3.300     3.300     0.000 peak  9347 weight  0.10000E+01 volume  0.21560E+01 ppm1      1.755 ppm2      3.237
 ASSI (
   (( segid "    " and resid 1203 and name HG2 ))
 )(
   (( segid "    " and resid 1203 and name HD2 ))
  OR 
   (( segid "    " and resid 1203 and name HD1 ))
 )
      3.300     3.300     0.000 peak  9348 weight  0.10000E+01 volume  0.20260E+01 ppm1      1.624 ppm2      3.237
 ASSI (
   (( segid "    " and resid 1204 and name HA2 ))
 )(
   (( segid "    " and resid 1204 and name HA1 ))
 )
      2.700     2.700     0.000 peak  6738 weight  0.10000E+01 volume -0.49650E+01 ppm1      3.611 ppm2      4.238
 ASSI (
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )(
   (( segid "    " and resid 1205 and name HA  ))
 )
      6.000     6.000     0.000 peak  8088 weight  0.10000E+01 volume -0.20100E+00 ppm1      6.651 ppm2      4.801
 ASSI (
   (( segid "    " and resid 1228 and name HB1 ))
 )(
   (( segid "    " and resid 1205 and name HA  ))
 )
      6.000     6.000     0.000 peak  7384 weight  0.10000E+01 volume -0.20000E+00 ppm1      3.722 ppm2      4.796
 ASSI (
   (( segid "    " and resid 1230 and name HA  ))
 )(
   (( segid "    " and resid 1205 and name HA  ))
 )
      5.000     5.000     0.000 peak  3143 weight  0.10000E+01 volume -0.14900E+01 ppm1      3.720 ppm2      4.802
 ASSI (
   (( segid "    " and resid 1205 and name HA  ))
 )(
   (( segid "    " and resid 1205 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6484 weight  0.10000E+01 volume -0.74100E+00 ppm1      4.797 ppm2      3.209
 ASSI (
   (( segid "    " and resid 1205 and name HB2 ))
 )(
   (( segid "    " and resid 1205 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8075 weight  0.10000E+01 volume  0.77100E+00 ppm1      2.671 ppm2      3.207
 ASSI (
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )(
   (( segid "    " and resid 1205 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8090 weight  0.10000E+01 volume -0.40800E+00 ppm1      6.649 ppm2      3.204
 ASSI (
   (( segid "    " and resid 1228 and name HB1 ))
 )(
   (( segid "    " and resid 1205 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7382 weight  0.10000E+01 volume -0.40200E+00 ppm1      3.710 ppm2      3.201
 ASSI (
   (( segid "    " and resid 1230 and name HA  ))
 )(
   (( segid "    " and resid 1205 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8102 weight  0.10000E+01 volume -0.20500E+00 ppm1      3.726 ppm2      3.199
 ASSI (
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )(
   (( segid "    " and resid 1205 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8085 weight  0.10000E+01 volume -0.55800E+00 ppm1      6.650 ppm2      2.689
 ASSI (
   (( segid "    " and resid 1230 and name HA  ))
 )(
   (( segid "    " and resid 1205 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6604 weight  0.10000E+01 volume -0.25600E+00 ppm1      3.721 ppm2      2.671
 ASSI (
   (( segid "    " and resid 1178 and name HB1 ))
 )(
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8429 weight  0.10000E+01 volume  0.25700E+00 ppm1      2.816 ppm2      6.656
 ASSI (
   (( segid "    " and resid 1178 and name HB2 ))
 )(
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8431 weight  0.10000E+01 volume  0.33300E+00 ppm1      1.197 ppm2      6.659
 ASSI (
   (( segid "    " and resid 1202 and name HB1 ))
 )(
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8137 weight  0.10000E+01 volume  0.29800E+00 ppm1      1.654 ppm2      6.665
 ASSI (
   (( segid "    " and resid 1228 and name HB1 ))
 )(
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7385 weight  0.10000E+01 volume -0.17300E+00 ppm1      3.709 ppm2      6.659
 ASSI (
   (( segid "    " and resid 1228 and name HB2 ))
 )(
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7386 weight  0.10000E+01 volume -0.18900E+00 ppm1      2.723 ppm2      6.659
 ASSI (
   (( segid "    " and resid 1229 and name HA  ))
 )(
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      5.000     5.000     0.000 peak  6493 weight  0.10000E+01 volume -0.15710E+01 ppm1      4.966 ppm2      6.658
 ASSI (
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )(
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7360 weight  0.10000E+01 volume  0.23000E+00 ppm1      1.445 ppm2      6.656
 ASSI (
   (( segid "    " and resid 1230 and name HA  ))
 )(
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      5.000     5.000     0.000 peak  3101 weight  0.10000E+01 volume -0.64000E+00 ppm1      3.720 ppm2      6.664
 ASSI (
   (( segid "    " and resid 1230 and name HG2 ))
 )(
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      6.000     6.000     0.000 peak  9279 weight  0.10000E+01 volume  0.38500E+00 ppm1      1.099 ppm2      6.668
 ASSI (
   (( segid "    " and resid 1204 and name HA1 ))
 )(
   (( segid "    " and resid 1205 and name HN  ))
 )
      5.000     5.000     0.000 peak  6734 weight  0.10000E+01 volume -0.10000E+01 ppm1      4.230 ppm2      8.313
 ASSI (
   (( segid "    " and resid 1204 and name HA2 ))
 )(
   (( segid "    " and resid 1205 and name HN  ))
 )
      5.000     5.000     0.000 peak  6733 weight  0.10000E+01 volume -0.82100E+00 ppm1      3.607 ppm2      8.308
 ASSI (
   (( segid "    " and resid 1207 and name HA  ))
 )(
   (( segid "    " and resid 1206 and name HA  ))
 )
      6.000     6.000     0.000 peak  6487 weight  0.10000E+01 volume -0.27700E+00 ppm1      4.408 ppm2      4.959
 ASSI (
   (( segid "    " and resid 1206 and name HA  ))
 )(
   (( segid "    " and resid 1206 and name HB2 ))
  OR 
   (( segid "    " and resid 1206 and name HB1 ))
 )
      2.700     2.700     0.000 peak  6473 weight  0.10000E+01 volume -0.33480E+01 ppm1      4.963 ppm2      1.826
 ASSI (
   (( segid "    " and resid 1229 and name HA  ))
 )(
   (( segid "    " and resid 1206 and name HG1 ))
 )
      5.000     5.000     0.000 peak  6495 weight  0.10000E+01 volume -0.46500E+00 ppm1      4.965 ppm2      1.618
 ASSI (
   (( segid "    " and resid 1205 and name HB1 ))
 )(
   (( segid "    " and resid 1206 and name HN  ))
 )
      6.000     6.000     0.000 peak  8083 weight  0.10000E+01 volume  0.11100E+00 ppm1      3.202 ppm2      9.351
 ASSI (
   (( segid "    " and resid 1205 and name HB2 ))
 )(
   (( segid "    " and resid 1206 and name HN  ))
 )
      6.000     6.000     0.000 peak  8082 weight  0.10000E+01 volume  0.34600E+00 ppm1      2.666 ppm2      9.350
 ASSI (
   (( segid "    " and resid 1206 and name HA  ))
 )(
   (( segid "    " and resid 1206 and name HN  ))
 )
      5.000     5.000     0.000 peak  6468 weight  0.10000E+01 volume -0.44700E+00 ppm1      4.965 ppm2      9.352
 ASSI (
   (( segid "    " and resid 1206 and name HG1 ))
 )(
   (( segid "    " and resid 1206 and name HN  ))
 )
      5.000     5.000     0.000 peak  9341 weight  0.10000E+01 volume  0.42500E+00 ppm1      1.617 ppm2      9.346
 ASSI (
   (( segid "    " and resid 1228 and name HB2 ))
 )(
   (( segid "    " and resid 1206 and name HN  ))
 )
      6.000     6.000     0.000 peak  7391 weight  0.10000E+01 volume -0.22100E+00 ppm1      2.731 ppm2      9.345
 ASSI (
   (( segid "    " and resid 1230 and name HA  ))
 )(
   (( segid "    " and resid 1206 and name HN  ))
 )
      6.000     6.000     0.000 peak  2462 weight  0.10000E+01 volume -0.29200E+00 ppm1      3.724 ppm2      9.341
 ASSI (
   (( segid "    " and resid 1207 and name HG  ))
 )(
   (( segid "    " and resid 1207 and name HA  ))
 )
      5.000     5.000     0.000 peak  8019 weight  0.10000E+01 volume  0.49500E+00 ppm1      1.792 ppm2      4.407
 ASSI (
   (( segid "    " and resid 1228 and name HA  ))
 )(
   (( segid "    " and resid 1207 and name HA  ))
 )
      5.000     5.000     0.000 peak  6246 weight  0.10000E+01 volume -0.88100E+00 ppm1      5.533 ppm2      4.411
 ASSI (
   (( segid "    " and resid 1207 and name HD13))
  OR 
   (( segid "    " and resid 1207 and name HD12))
  OR 
   (( segid "    " and resid 1207 and name HD11))
 )(
   (( segid "    " and resid 1207 and name HB1 ))
 )
      3.300     3.300     0.000 peak  8420 weight  0.10000E+01 volume  0.29760E+01 ppm1      0.854 ppm2      1.791
 ASSI (
   (( segid "    " and resid 1206 and name HA  ))
 )(
   (( segid "    " and resid 1207 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6475 weight  0.10000E+01 volume -0.51500E+00 ppm1      4.964 ppm2      1.477
 ASSI (
   (( segid "    " and resid 1207 and name HD13))
  OR 
   (( segid "    " and resid 1207 and name HD12))
  OR 
   (( segid "    " and resid 1207 and name HD11))
 )(
   (( segid "    " and resid 1207 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8423 weight  0.10000E+01 volume  0.11920E+01 ppm1      0.856 ppm2      1.465
 ASSI (
   (( segid "    " and resid 1207 and name HA  ))
 )(
   (( segid "    " and resid 1207 and name HD13))
  OR 
   (( segid "    " and resid 1207 and name HD12))
  OR 
   (( segid "    " and resid 1207 and name HD11))
 )
      5.000     5.000     0.000 peak  6729 weight  0.10000E+01 volume -0.53700E+00 ppm1      4.414 ppm2      0.850
 ASSI (
   (( segid "    " and resid 1207 and name HG  ))
 )(
   (( segid "    " and resid 1207 and name HD13))
  OR 
   (( segid "    " and resid 1207 and name HD12))
  OR 
   (( segid "    " and resid 1207 and name HD11))
 )
      5.000     5.000     0.000 peak  8022 weight  0.10000E+01 volume  0.13710E+01 ppm1      1.794 ppm2      0.850
 ASSI (
   (( segid "    " and resid 1213 and name HA  ))
 )(
   (( segid "    " and resid 1207 and name HD13))
  OR 
   (( segid "    " and resid 1207 and name HD12))
  OR 
   (( segid "    " and resid 1207 and name HD11))
 )
      5.000     5.000     0.000 peak  6688 weight  0.10000E+01 volume -0.68300E+00 ppm1      4.419 ppm2      0.845
 ASSI (
   (( segid "    " and resid 1207 and name HA  ))
 )(
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )
      3.300     3.300     0.000 peak  6728 weight  0.10000E+01 volume -0.20840E+01 ppm1      4.413 ppm2      0.950
 ASSI (
   (( segid "    " and resid 1207 and name HB1 ))
 )(
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )
      5.000     5.000     0.000 peak  8036 weight  0.10000E+01 volume  0.83600E+00 ppm1      1.791 ppm2      0.966
 ASSI (
   (( segid "    " and resid 1207 and name HB2 ))
 )(
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )
      5.000     5.000     0.000 peak  8033 weight  0.10000E+01 volume  0.13820E+01 ppm1      1.465 ppm2      0.959
 ASSI (
   (( segid "    " and resid 1207 and name HG  ))
 )(
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )
      5.000     5.000     0.000 peak  8021 weight  0.10000E+01 volume  0.13640E+01 ppm1      1.796 ppm2      0.953
 ASSI (
   (( segid "    " and resid 1213 and name HA  ))
 )(
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )
      6.000     6.000     0.000 peak  6691 weight  0.10000E+01 volume -0.30700E+00 ppm1      4.417 ppm2      0.935
 ASSI (
   (( segid "    " and resid 1206 and name HB2 ))
  OR 
   (( segid "    " and resid 1206 and name HB1 ))
 )(
   (( segid "    " and resid 1207 and name HN  ))
 )
      5.000     5.000     0.000 peak  8070 weight  0.10000E+01 volume  0.12040E+01 ppm1      1.829 ppm2      8.767
 ASSI (
   (( segid "    " and resid 1207 and name HA  ))
 )(
   (( segid "    " and resid 1207 and name HN  ))
 )
      5.000     5.000     0.000 peak  6725 weight  0.10000E+01 volume -0.80000E+00 ppm1      4.414 ppm2      8.765
 ASSI (
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )(
   (( segid "    " and resid 1207 and name HN  ))
 )
      5.000     5.000     0.000 peak  7422 weight  0.10000E+01 volume  0.50300E+00 ppm1      0.947 ppm2      8.761
 ASSI (
   (( segid "    " and resid 1207 and name HG  ))
 )(
   (( segid "    " and resid 1207 and name HN  ))
 )
      6.000     6.000     0.000 peak  8020 weight  0.10000E+01 volume  0.32000E+00 ppm1      1.794 ppm2      8.765
 ASSI (
   (( segid "    " and resid 1208 and name HB1 ))
 )(
   (( segid "    " and resid 1208 and name HA  ))
 )
      3.300     3.300     0.000 peak  8014 weight  0.10000E+01 volume -0.27840E+01 ppm1      3.921 ppm2      4.487
 ASSI (
   (( segid "    " and resid 1208 and name HB2 ))
 )(
   (( segid "    " and resid 1208 and name HA  ))
 )
      3.300     3.300     0.000 peak  6815 weight  0.10000E+01 volume -0.23950E+01 ppm1      3.675 ppm2      4.477
 ASSI (
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )(
   (( segid "    " and resid 1208 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7363 weight  0.10000E+01 volume  0.50100E+00 ppm1      1.444 ppm2      3.923
 ASSI (
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )(
   (( segid "    " and resid 1208 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7364 weight  0.10000E+01 volume  0.10560E+01 ppm1      1.444 ppm2      3.690
 ASSI (
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )(
   (( segid "    " and resid 1208 and name HN  ))
 )
      5.000     5.000     0.000 peak  7421 weight  0.10000E+01 volume  0.72800E+00 ppm1      0.949 ppm2      8.915
 ASSI (
   (( segid "    " and resid 1209 and name HB2 ))
 )(
   (( segid "    " and resid 1209 and name HA  ))
 )
      2.700     2.700     0.000 peak  6848 weight  0.10000E+01 volume -0.33290E+01 ppm1      3.936 ppm2      4.274
 ASSI (
   (( segid "    " and resid 1208 and name HA  ))
 )(
   (( segid "    " and resid 1209 and name HN  ))
 )
      5.000     5.000     0.000 peak  6982 weight  0.10000E+01 volume -0.11120E+01 ppm1      4.473 ppm2      8.402
 ASSI (
   (( segid "    " and resid 1209 and name HA  ))
 )(
   (( segid "    " and resid 1209 and name HN  ))
 )
      5.000     5.000     0.000 peak  6717 weight  0.10000E+01 volume -0.79600E+00 ppm1      4.273 ppm2      8.403
 ASSI (
   (( segid "    " and resid 1209 and name HB1 ))
 )(
   (( segid "    " and resid 1209 and name HN  ))
 )
      5.000     5.000     0.000 peak  6842 weight  0.10000E+01 volume -0.61400E+00 ppm1      3.987 ppm2      8.404
 ASSI (
   (( segid "    " and resid 1209 and name HB2 ))
 )(
   (( segid "    " and resid 1209 and name HN  ))
 )
      5.000     5.000     0.000 peak  6843 weight  0.10000E+01 volume -0.62500E+00 ppm1      3.941 ppm2      8.399
 ASSI (
   (( segid "    " and resid 1210 and name HB2 ))
 )(
   (( segid "    " and resid 1210 and name HA  ))
 )
      5.000     5.000     0.000 peak  7989 weight  0.10000E+01 volume  0.71500E+00 ppm1      1.705 ppm2      4.282
 ASSI (
   (( segid "    " and resid 1210 and name HB1 ))
 )(
   (( segid "    " and resid 1210 and name HD2 ))
  OR 
   (( segid "    " and resid 1210 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7994 weight  0.10000E+01 volume  0.73500E+00 ppm1      1.931 ppm2      3.164
 ASSI (
   (( segid "    " and resid 1210 and name HB2 ))
 )(
   (( segid "    " and resid 1210 and name HD2 ))
  OR 
   (( segid "    " and resid 1210 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7995 weight  0.10000E+01 volume  0.62900E+00 ppm1      1.705 ppm2      3.165
 ASSI (
   (( segid "    " and resid 1209 and name HA  ))
 )(
   (( segid "    " and resid 1210 and name HN  ))
 )
      5.000     5.000     0.000 peak  6718 weight  0.10000E+01 volume -0.13610E+01 ppm1      4.274 ppm2      8.075
 ASSI (
   (( segid "    " and resid 1209 and name HB1 ))
 )(
   (( segid "    " and resid 1210 and name HN  ))
 )
      5.000     5.000     0.000 peak  6845 weight  0.10000E+01 volume -0.50600E+00 ppm1      3.982 ppm2      8.076
 ASSI (
   (( segid "    " and resid 1209 and name HB2 ))
 )(
   (( segid "    " and resid 1210 and name HN  ))
 )
      5.000     5.000     0.000 peak  6844 weight  0.10000E+01 volume -0.53800E+00 ppm1      3.945 ppm2      8.078
 ASSI (
   (( segid "    " and resid 1213 and name HG23))
  OR 
   (( segid "    " and resid 1213 and name HG22))
  OR 
   (( segid "    " and resid 1213 and name HG21))
 )(
   (( segid "    " and resid 1213 and name HA  ))
 )
      3.300     3.300     0.000 peak  6682 weight  0.10000E+01 volume  0.27660E+01 ppm1      1.235 ppm2      4.411
 ASSI (
   (( segid "    " and resid 1213 and name HB  ))
 )(
   (( segid "    " and resid 1213 and name HN  ))
 )
      6.000     6.000     0.000 peak  7935 weight  0.10000E+01 volume -0.31700E+00 ppm1      4.482 ppm2      7.839
 ASSI (
   (( segid "    " and resid 1200 and name HA  ))
 )(
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
 )
      5.000     5.000     0.000 peak  3130 weight  0.10000E+01 volume -0.14140E+01 ppm1      4.587 ppm2      1.086
 ASSI (
   (( segid "    " and resid 1214 and name HB1 ))
 )(
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
 )
      5.000     5.000     0.000 peak  7897 weight  0.10000E+01 volume  0.97600E+00 ppm1      2.249 ppm2      1.089
 ASSI (
   (( segid "    " and resid 1214 and name HB2 ))
 )(
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
 )
      5.000     5.000     0.000 peak  7902 weight  0.10000E+01 volume  0.94400E+00 ppm1      1.666 ppm2      1.092
 ASSI (
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )(
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )
      6.000     6.000     0.000 peak  9574 weight  0.10000E+01 volume -0.14900E+00 ppm1      7.161 ppm2      0.679
 ASSI (
   (( segid "    " and resid 1214 and name HB1 ))
 )(
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )
      5.000     5.000     0.000 peak  7898 weight  0.10000E+01 volume  0.57200E+00 ppm1      2.250 ppm2      0.687
 ASSI (
   (( segid "    " and resid 1214 and name HB2 ))
 )(
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )
      5.000     5.000     0.000 peak  7903 weight  0.10000E+01 volume  0.56900E+00 ppm1      1.669 ppm2      0.675
 ASSI (
   (( segid "    " and resid 1226 and name HB1 ))
 )(
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )
      5.000     5.000     0.000 peak  7417 weight  0.10000E+01 volume  0.51100E+00 ppm1      2.261 ppm2      0.691
 ASSI (
   (( segid "    " and resid 1213 and name HG23))
  OR 
   (( segid "    " and resid 1213 and name HG22))
  OR 
   (( segid "    " and resid 1213 and name HG21))
 )(
   (( segid "    " and resid 1214 and name HN  ))
 )
      5.000     5.000     0.000 peak  6685 weight  0.10000E+01 volume  0.70100E+00 ppm1      1.237 ppm2      8.372
 ASSI (
   (( segid "    " and resid 1215 and name HB1 ))
 )(
   (( segid "    " and resid 1215 and name HA  ))
 )
      5.000     5.000     0.000 peak  6303 weight  0.10000E+01 volume  0.63400E+00 ppm1      1.769 ppm2      5.274
 ASSI (
   (( segid "    " and resid 1215 and name HB2 ))
 )(
   (( segid "    " and resid 1215 and name HA  ))
 )
      5.000     5.000     0.000 peak  6304 weight  0.10000E+01 volume  0.58500E+00 ppm1      1.662 ppm2      5.277
 ASSI (
   (( segid "    " and resid 1215 and name HG2 ))
  OR 
   (( segid "    " and resid 1215 and name HG1 ))
 )(
   (( segid "    " and resid 1215 and name HA  ))
 )
      5.000     5.000     0.000 peak  6305 weight  0.10000E+01 volume  0.60400E+00 ppm1      1.452 ppm2      5.283
 ASSI (
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )(
   (( segid "    " and resid 1215 and name HA  ))
 )
      6.000     6.000     0.000 peak  6306 weight  0.10000E+01 volume  0.36400E+00 ppm1      1.141 ppm2      5.281
 ASSI (
   (( segid "    " and resid 1196 and name HB2 ))
  OR 
   (( segid "    " and resid 1196 and name HB1 ))
 )(
   (( segid "    " and resid 1215 and name HD2 ))
  OR 
   (( segid "    " and resid 1215 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7981 weight  0.10000E+01 volume -0.68600E+00 ppm1      3.654 ppm2      3.172
 ASSI (
   (( segid "    " and resid 1215 and name HB1 ))
 )(
   (( segid "    " and resid 1215 and name HD2 ))
  OR 
   (( segid "    " and resid 1215 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7887 weight  0.10000E+01 volume  0.12090E+01 ppm1      1.766 ppm2      3.169
 ASSI (
   (( segid "    " and resid 1215 and name HB2 ))
 )(
   (( segid "    " and resid 1215 and name HD2 ))
  OR 
   (( segid "    " and resid 1215 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7888 weight  0.10000E+01 volume  0.12250E+01 ppm1      1.666 ppm2      3.167
 ASSI (
   (( segid "    " and resid 1196 and name HB2 ))
  OR 
   (( segid "    " and resid 1196 and name HB1 ))
 )(
   (( segid "    " and resid 1215 and name HG2 ))
  OR 
   (( segid "    " and resid 1215 and name HG1 ))
 )
      3.300     3.300     0.000 peak  7938 weight  0.10000E+01 volume -0.17670E+01 ppm1      3.652 ppm2      1.453
 ASSI (
   (( segid "    " and resid 1213 and name HB  ))
 )(
   (( segid "    " and resid 1215 and name HN  ))
 )
      5.000     5.000     0.000 peak  7934 weight  0.10000E+01 volume -0.69700E+00 ppm1      4.482 ppm2      7.718
 ASSI (
   (( segid "    " and resid 1213 and name HG23))
  OR 
   (( segid "    " and resid 1213 and name HG22))
  OR 
   (( segid "    " and resid 1213 and name HG21))
 )(
   (( segid "    " and resid 1215 and name HN  ))
 )
      5.000     5.000     0.000 peak  6687 weight  0.10000E+01 volume  0.73400E+00 ppm1      1.237 ppm2      7.711
 ASSI (
   (( segid "    " and resid 1215 and name HB2 ))
 )(
   (( segid "    " and resid 1215 and name HN  ))
 )
      5.000     5.000     0.000 peak  7886 weight  0.10000E+01 volume  0.67200E+00 ppm1      1.664 ppm2      7.715
 ASSI (
   (( segid "    " and resid 1216 and name HB  ))
 )(
   (( segid "    " and resid 1216 and name HA  ))
 )
      3.300     3.300     0.000 peak  6509 weight  0.10000E+01 volume -0.20100E+01 ppm1      4.066 ppm2      4.877
 ASSI (
   (( segid "    " and resid 1217 and name HB  ))
 )(
   (( segid "    " and resid 1216 and name HA  ))
 )
      5.000     5.000     0.000 peak  6500 weight  0.10000E+01 volume -0.78200E+00 ppm1      3.883 ppm2      4.873
 ASSI (
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )(
   (( segid "    " and resid 1216 and name HB  ))
 )
      3.300     3.300     0.000 peak  7872 weight  0.10000E+01 volume  0.19880E+01 ppm1      1.138 ppm2      4.067
 ASSI (
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )(
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )
      6.000     6.000     0.000 peak  7782 weight  0.10000E+01 volume  0.39200E+00 ppm1      0.144 ppm2      1.148
 ASSI (
   (( segid "    " and resid 1226 and name HD2 ))
 )(
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )
      5.000     5.000     0.000 peak  7287 weight  0.10000E+01 volume -0.41300E+00 ppm1      2.855 ppm2      1.145
 ASSI (
   (( segid "    " and resid 1198 and name HA  ))
 )(
   (( segid "    " and resid 1216 and name HN  ))
 )
      6.000     6.000     0.000 peak  6538 weight  0.10000E+01 volume -0.33200E+00 ppm1      4.791 ppm2      8.733
 ASSI (
   (( segid "    " and resid 1216 and name HA  ))
 )(
   (( segid "    " and resid 1216 and name HN  ))
 )
      5.000     5.000     0.000 peak  6501 weight  0.10000E+01 volume -0.66000E+00 ppm1      4.873 ppm2      8.759
 ASSI (
   (( segid "    " and resid 1216 and name HB  ))
 )(
   (( segid "    " and resid 1216 and name HN  ))
 )
      6.000     6.000     0.000 peak  7864 weight  0.10000E+01 volume -0.27600E+00 ppm1      4.064 ppm2      8.763
 ASSI (
   (( segid "    " and resid 1217 and name HB  ))
 )(
   (( segid "    " and resid 1217 and name HA  ))
 )
      5.000     5.000     0.000 peak  6532 weight  0.10000E+01 volume -0.10080E+01 ppm1      3.888 ppm2      4.806
 ASSI (
   (( segid "    " and resid 1196 and name HB2 ))
  OR 
   (( segid "    " and resid 1196 and name HB1 ))
 )(
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
 )
      5.000     5.000     0.000 peak  7978 weight  0.10000E+01 volume -0.41100E+00 ppm1      3.653 ppm2      1.056
 ASSI (
   (( segid "    " and resid 1217 and name HA  ))
 )(
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
 )
      3.300     3.300     0.000 peak  6529 weight  0.10000E+01 volume -0.16020E+01 ppm1      4.806 ppm2      1.054
 ASSI (
   (( segid "    " and resid 1196 and name HA  ))
 )(
   (( segid "    " and resid 1217 and name HN  ))
 )
      5.000     5.000     0.000 peak  6333 weight  0.10000E+01 volume -0.53200E+00 ppm1      5.148 ppm2      8.287
 ASSI (
   (( segid "    " and resid 1216 and name HA  ))
 )(
   (( segid "    " and resid 1217 and name HN  ))
 )
      2.700     2.700     0.000 peak  6503 weight  0.10000E+01 volume -0.33600E+01 ppm1      4.872 ppm2      8.249
 ASSI (
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )(
   (( segid "    " and resid 1218 and name HA  ))
 )
      3.300     3.300     0.000 peak  7832 weight  0.10000E+01 volume  0.17290E+01 ppm1      0.528 ppm2      4.630
 ASSI (
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )(
   (( segid "    " and resid 1218 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9306 weight  0.10000E+01 volume  0.35300E+00 ppm1      0.416 ppm2      3.081
 ASSI (
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )(
   (( segid "    " and resid 1218 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7830 weight  0.10000E+01 volume  0.41600E+00 ppm1      0.529 ppm2      3.082
 ASSI (
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )(
   (( segid "    " and resid 1218 and name HB1 ))
 )
      6.000     6.000     0.000 peak  7852 weight  0.10000E+01 volume  0.24600E+00 ppm1      0.411 ppm2      3.092
 ASSI (
   (( segid "    " and resid 1217 and name HA  ))
 )(
   (( segid "    " and resid 1218 and name HN  ))
 )
      3.300     3.300     0.000 peak  6528 weight  0.10000E+01 volume -0.20410E+01 ppm1      4.807 ppm2      8.291
 ASSI (
   (( segid "    " and resid 1219 and name HD1 ))
 )(
   (( segid "    " and resid 1219 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7608 weight  0.10000E+01 volume -0.53400E+00 ppm1      7.160 ppm2      3.375
 ASSI (
   (( segid "    " and resid 1219 and name HD1 ))
 )(
   (( segid "    " and resid 1219 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7611 weight  0.10000E+01 volume -0.72800E+00 ppm1      7.158 ppm2      3.078
 ASSI (
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )(
   (( segid "    " and resid 1219 and name HE3 ))
 )
      5.000     5.000     0.000 peak  7630 weight  0.10000E+01 volume  0.52200E+00 ppm1      0.412 ppm2      7.595
 ASSI (
   (( segid "    " and resid 1222 and name HB2 ))
  OR 
   (( segid "    " and resid 1222 and name HB1 ))
 )(
   (( segid "    " and resid 1219 and name HN  ))
 )
      6.000     6.000     0.000 peak  7552 weight  0.10000E+01 volume  0.26200E+00 ppm1      1.951 ppm2      8.949
 ASSI (
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )(
   (( segid "    " and resid 1220 and name HN  ))
 )
      5.000     5.000     0.000 peak  9303 weight  0.10000E+01 volume  0.78700E+00 ppm1      0.414 ppm2      8.922
 ASSI (
   (( segid "    " and resid 1221 and name HA2 ))
 )(
   (( segid "    " and resid 1221 and name HA1 ))
 )
      3.300     3.300     0.000 peak  6672 weight  0.10000E+01 volume -0.20550E+01 ppm1      3.737 ppm2      4.059
 ASSI (
   (( segid "    " and resid 1220 and name HA  ))
 )(
   (( segid "    " and resid 1221 and name HN  ))
 )
      5.000     5.000     0.000 peak  6676 weight  0.10000E+01 volume -0.68000E+00 ppm1      4.489 ppm2      6.373
 ASSI (
   (( segid "    " and resid 1222 and name HB1 ))
 )(
   (( segid "    " and resid 1222 and name HA  ))
 )
      3.300     3.300     0.000 peak  7557 weight  0.10000E+01 volume  0.19100E+01 ppm1      1.961 ppm2      4.485
 ASSI (
   (( segid "    " and resid 1222 and name HB2 ))
 )(
   (( segid "    " and resid 1222 and name HA  ))
 )
      3.300     3.300     0.000 peak  6665 weight  0.10000E+01 volume  0.25080E+01 ppm1      1.930 ppm2      4.486
 ASSI (
   (( segid "    " and resid 1222 and name HA  ))
 )(
   (( segid "    " and resid 1222 and name HB2 ))
  OR 
   (( segid "    " and resid 1222 and name HB1 ))
 )
      3.300     3.300     0.000 peak  2654 weight  0.10000E+01 volume -0.28190E+01 ppm1      4.488 ppm2      1.942
 ASSI (
   (( segid "    " and resid 1222 and name HD2 ))
  OR 
   (( segid "    " and resid 1222 and name HD1 ))
 )(
   (( segid "    " and resid 1222 and name HE2 ))
  OR 
   (( segid "    " and resid 1222 and name HE1 ))
 )
      3.300     3.300     0.000 peak  9550 weight  0.10000E+01 volume  0.25370E+01 ppm1      1.750 ppm2      3.049
 ASSI (
   (( segid "    " and resid 1222 and name HA  ))
 )(
   (( segid "    " and resid 1222 and name HN  ))
 )
      5.000     5.000     0.000 peak  6664 weight  0.10000E+01 volume -0.79600E+00 ppm1      4.490 ppm2      7.790
 ASSI (
   (( segid "    " and resid 1222 and name HB1 ))
 )(
   (( segid "    " and resid 1222 and name HN  ))
 )
      3.300     3.300     0.000 peak  7556 weight  0.10000E+01 volume  0.18840E+01 ppm1      1.967 ppm2      7.789
 ASSI (
   (( segid "    " and resid 1222 and name HB2 ))
 )(
   (( segid "    " and resid 1222 and name HN  ))
 )
      3.300     3.300     0.000 peak  7555 weight  0.10000E+01 volume  0.21000E+01 ppm1      1.933 ppm2      7.789
 ASSI (
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )(
   (( segid "    " and resid 1223 and name HA  ))
 )
      5.000     5.000     0.000 peak  7873 weight  0.10000E+01 volume  0.59100E+00 ppm1      1.137 ppm2      4.477
 ASSI (
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )(
   (( segid "    " and resid 1223 and name HA  ))
 )
      3.300     3.300     0.000 peak  7834 weight  0.10000E+01 volume  0.16410E+01 ppm1      0.529 ppm2      4.475
 ASSI (
   (( segid "    " and resid 1167 and name HB1 ))
 )(
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )
      6.000     6.000     0.000 peak  8633 weight  0.10000E+01 volume  0.33700E+00 ppm1      2.784 ppm2      0.531
 ASSI (
   (( segid "    " and resid 1167 and name HB2 ))
 )(
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )
      6.000     6.000     0.000 peak  8634 weight  0.10000E+01 volume  0.35600E+00 ppm1      2.704 ppm2      0.544
 ASSI (
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )(
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )
      5.000     5.000     0.000 peak  8601 weight  0.10000E+01 volume  0.11380E+01 ppm1      1.030 ppm2      0.512
 ASSI (
   (( segid "    " and resid 1216 and name HB  ))
 )(
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )
      6.000     6.000     0.000 peak  7946 weight  0.10000E+01 volume -0.20600E+00 ppm1      4.069 ppm2      0.531
 ASSI (
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )(
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )
      5.000     5.000     0.000 peak  7879 weight  0.10000E+01 volume  0.14860E+01 ppm1      1.135 ppm2      0.534
 ASSI (
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
 )(
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )
      6.000     6.000     0.000 peak  7859 weight  0.10000E+01 volume  0.12200E+00 ppm1      1.046 ppm2      0.519
 ASSI (
   (( segid "    " and resid 1218 and name HB2 ))
 )(
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )
      6.000     6.000     0.000 peak  7826 weight  0.10000E+01 volume  0.34900E+00 ppm1      2.830 ppm2      0.534
 ASSI (
   (( segid "    " and resid 1167 and name HB1 ))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )
      6.000     6.000     0.000 peak  8626 weight  0.10000E+01 volume  0.22300E+00 ppm1      2.791 ppm2      0.414
 ASSI (
   (( segid "    " and resid 1169 and name HA  ))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )
      6.000     6.000     0.000 peak  6933 weight  0.10000E+01 volume -0.22900E+00 ppm1      4.163 ppm2      0.409
 ASSI (
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )
      5.000     5.000     0.000 peak  8602 weight  0.10000E+01 volume  0.77200E+00 ppm1      1.029 ppm2      0.428
 ASSI (
   (( segid "    " and resid 1197 and name HB  ))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )
      5.000     5.000     0.000 peak  8217 weight  0.10000E+01 volume  0.41400E+00 ppm1      1.543 ppm2      0.425
 ASSI (
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )
      6.000     6.000     0.000 peak  9597 weight  0.10000E+01 volume -0.13900E+00 ppm1      7.146 ppm2      0.418
 ASSI (
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )
      5.000     5.000     0.000 peak  7878 weight  0.10000E+01 volume  0.13570E+01 ppm1      1.135 ppm2      0.410
 ASSI (
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )
      6.000     6.000     0.000 peak  7841 weight  0.10000E+01 volume  0.26500E+00 ppm1      1.048 ppm2      0.401
 ASSI (
   (( segid "    " and resid 1218 and name HB2 ))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
 )
      6.000     6.000     0.000 peak  7827 weight  0.10000E+01 volume  0.18600E+00 ppm1      2.834 ppm2      0.415
 ASSI (
   (( segid "    " and resid 1222 and name HA  ))
 )(
   (( segid "    " and resid 1223 and name HN  ))
 )
      2.700     2.700     0.000 peak  6663 weight  0.10000E+01 volume -0.37310E+01 ppm1      4.489 ppm2      8.147
 ASSI (
   (( segid "    " and resid 1222 and name HB1 ))
 )(
   (( segid "    " and resid 1223 and name HN  ))
 )
      5.000     5.000     0.000 peak  7553 weight  0.10000E+01 volume  0.91300E+00 ppm1      1.964 ppm2      8.145
 ASSI (
   (( segid "    " and resid 1222 and name HB2 ))
 )(
   (( segid "    " and resid 1223 and name HN  ))
 )
      5.000     5.000     0.000 peak  7554 weight  0.10000E+01 volume  0.97200E+00 ppm1      1.933 ppm2      8.145
 ASSI (
   (( segid "    " and resid 1223 and name HA  ))
 )(
   (( segid "    " and resid 1223 and name HN  ))
 )
      5.000     5.000     0.000 peak  6657 weight  0.10000E+01 volume -0.40100E+00 ppm1      4.480 ppm2      8.141
 ASSI (
   (( segid "    " and resid 1223 and name HB1 ))
 )(
   (( segid "    " and resid 1223 and name HN  ))
 )
      5.000     5.000     0.000 peak  7532 weight  0.10000E+01 volume -0.64400E+00 ppm1      1.223 ppm2      8.149
 ASSI (
   (( segid "    " and resid 1223 and name HB2 ))
 )(
   (( segid "    " and resid 1223 and name HN  ))
 )
      5.000     5.000     0.000 peak  7535 weight  0.10000E+01 volume -0.56900E+00 ppm1      1.134 ppm2      8.151
 ASSI (
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )(
   (( segid "    " and resid 1223 and name HN  ))
 )
      6.000     6.000     0.000 peak  7839 weight  0.10000E+01 volume  0.30100E+00 ppm1      0.527 ppm2      8.140
 ASSI (
   (( segid "    " and resid 1224 and name HB2 ))
  OR 
   (( segid "    " and resid 1224 and name HB1 ))
 )(
   (( segid "    " and resid 1224 and name HA  ))
 )
      3.300     3.300     0.000 peak  6655 weight  0.10000E+01 volume  0.23350E+01 ppm1      1.686 ppm2      4.443
 ASSI (
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )(
   (( segid "    " and resid 1224 and name HA  ))
 )
      6.000     6.000     0.000 peak  7715 weight  0.10000E+01 volume -0.20500E+00 ppm1      6.788 ppm2      4.455
 ASSI (
   (( segid "    " and resid 1213 and name HA  ))
 )(
   (( segid "    " and resid 1224 and name HB2 ))
  OR 
   (( segid "    " and resid 1224 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6689 weight  0.10000E+01 volume -0.47200E+00 ppm1      4.417 ppm2      1.686
 ASSI (
   (( segid "    " and resid 1224 and name HG1 ))
 )(
   (( segid "    " and resid 1224 and name HB2 ))
  OR 
   (( segid "    " and resid 1224 and name HB1 ))
 )
      2.700     2.700     0.000 peak  7515 weight  0.10000E+01 volume  0.37860E+01 ppm1      2.202 ppm2      1.690
 ASSI (
   (( segid "    " and resid 1224 and name HG2 ))
 )(
   (( segid "    " and resid 1224 and name HB2 ))
  OR 
   (( segid "    " and resid 1224 and name HB1 ))
 )
      2.700     2.700     0.000 peak  7516 weight  0.10000E+01 volume  0.42220E+01 ppm1      2.052 ppm2      1.688
 ASSI (
   (( segid "    " and resid 1223 and name HA  ))
 )(
   (( segid "    " and resid 1224 and name HN  ))
 )
      3.300     3.300     0.000 peak  6656 weight  0.10000E+01 volume -0.22400E+01 ppm1      4.479 ppm2      8.289
 ASSI (
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )(
   (( segid "    " and resid 1224 and name HN  ))
 )
      5.000     5.000     0.000 peak  7838 weight  0.10000E+01 volume  0.12870E+01 ppm1      0.529 ppm2      8.293
 ASSI (
   (( segid "    " and resid 1224 and name HA  ))
 )(
   (( segid "    " and resid 1224 and name HN  ))
 )
      5.000     5.000     0.000 peak  6650 weight  0.10000E+01 volume -0.14560E+01 ppm1      4.440 ppm2      8.280
 ASSI (
   (( segid "    " and resid 1225 and name HB1 ))
 )(
   (( segid "    " and resid 1225 and name HA  ))
 )
      6.000     6.000     0.000 peak  7486 weight  0.10000E+01 volume  0.34400E+00 ppm1      2.532 ppm2      4.160
 ASSI (
   (( segid "    " and resid 1226 and name HD1 ))
 )(
   (( segid "    " and resid 1225 and name HA  ))
 )
      5.000     5.000     0.000 peak  6646 weight  0.10000E+01 volume -0.12480E+01 ppm1      3.465 ppm2      4.160
 ASSI (
   (( segid "    " and resid 1226 and name HD2 ))
 )(
   (( segid "    " and resid 1225 and name HA  ))
 )
      5.000     5.000     0.000 peak  6647 weight  0.10000E+01 volume -0.11660E+01 ppm1      2.851 ppm2      4.161
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1225 and name HB2 ))
  OR 
   (( segid "    " and resid 1225 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7439 weight  0.10000E+01 volume  0.55200E+00 ppm1      0.372 ppm2      2.529
 ASSI (
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )(
   (( segid "    " and resid 1225 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7499 weight  0.10000E+01 volume -0.57800E+00 ppm1      6.787 ppm2      2.548
 ASSI (
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )(
   (( segid "    " and resid 1225 and name HB2 ))
 )
      5.000     5.000     0.000 peak  7500 weight  0.10000E+01 volume -0.59300E+00 ppm1      6.788 ppm2      2.498
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )
      3.300     3.300     0.000 peak  7444 weight  0.10000E+01 volume  0.16020E+01 ppm1      0.370 ppm2      6.790
 ASSI (
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
 )(
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8194 weight  0.10000E+01 volume -0.22700E+00 ppm1      7.152 ppm2      6.787
 ASSI (
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )(
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7719 weight  0.10000E+01 volume -0.72000E+00 ppm1      7.168 ppm2      6.811
 ASSI (
   (( segid "    " and resid 1226 and name HD2 ))
 )(
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7292 weight  0.10000E+01 volume -0.23100E+00 ppm1      2.851 ppm2      6.783
 ASSI (
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )(
   (( segid "    " and resid 1225 and name HE2 ))
  OR 
   (( segid "    " and resid 1225 and name HE1 ))
 )
      5.000     5.000     0.000 peak  7739 weight  0.10000E+01 volume  0.96800E+00 ppm1     -0.388 ppm2      6.738
 ASSI (
   (( segid "    " and resid 1224 and name HA  ))
 )(
   (( segid "    " and resid 1225 and name HN  ))
 )
      2.700     2.700     0.000 peak  6649 weight  0.10000E+01 volume -0.40390E+01 ppm1      4.440 ppm2      8.223
 ASSI (
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )(
   (( segid "    " and resid 1225 and name HN  ))
 )
      5.000     5.000     0.000 peak  7718 weight  0.10000E+01 volume -0.53500E+00 ppm1      6.788 ppm2      8.217
 ASSI (
   (( segid "    " and resid 1212 and name HB2 ))
 )(
   (( segid "    " and resid 1226 and name HA  ))
 )
      6.000     6.000     0.000 peak  6624 weight  0.10000E+01 volume  0.17500E+00 ppm1      3.076 ppm2      4.489
 ASSI (
   (( segid "    " and resid 1226 and name HB1 ))
 )(
   (( segid "    " and resid 1226 and name HA  ))
 )
      5.000     5.000     0.000 peak  6628 weight  0.10000E+01 volume  0.47100E+00 ppm1      2.257 ppm2      4.490
 ASSI (
   (( segid "    " and resid 1226 and name HB2 ))
 )(
   (( segid "    " and resid 1226 and name HA  ))
 )
      5.000     5.000     0.000 peak  6630 weight  0.10000E+01 volume  0.43600E+00 ppm1      1.629 ppm2      4.491
 ASSI (
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )(
   (( segid "    " and resid 1226 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7412 weight  0.10000E+01 volume  0.77800E+00 ppm1      0.948 ppm2      2.253
 ASSI (
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )(
   (( segid "    " and resid 1226 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7875 weight  0.10000E+01 volume  0.33300E+00 ppm1      1.135 ppm2      3.478
 ASSI (
   (( segid "    " and resid 1226 and name HD1 ))
 )(
   (( segid "    " and resid 1226 and name HD2 ))
 )
      3.300     3.300     0.000 peak  7297 weight  0.10000E+01 volume -0.16330E+01 ppm1      3.462 ppm2      2.859
 ASSI (
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
 )
      6.000     6.000     0.000 peak  8587 weight  0.10000E+01 volume  0.21000E+00 ppm1      0.703 ppm2      2.078
 ASSI (
   (( segid "    " and resid 1177 and name HB1 ))
 )(
   (( segid "    " and resid 1227 and name HA  ))
 )
      6.000     6.000     0.000 peak  8462 weight  0.10000E+01 volume  0.37800E+00 ppm1      3.712 ppm2      4.550
 ASSI (
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )(
   (( segid "    " and resid 1227 and name HA  ))
 )
      6.000     6.000     0.000 peak  6367 weight  0.10000E+01 volume  0.29400E+00 ppm1      0.741 ppm2      4.546
 ASSI (
   (( segid "    " and resid 1227 and name HB  ))
 )(
   (( segid "    " and resid 1227 and name HA  ))
 )
      5.000     5.000     0.000 peak  7404 weight  0.10000E+01 volume -0.12460E+01 ppm1      3.692 ppm2      4.531
 ASSI (
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )(
   (( segid "    " and resid 1227 and name HG23))
  OR 
   (( segid "    " and resid 1227 and name HG22))
  OR 
   (( segid "    " and resid 1227 and name HG21))
 )
      6.000     6.000     0.000 peak  7712 weight  0.10000E+01 volume -0.18200E+00 ppm1      6.784 ppm2      0.651
 ASSI (
   (( segid "    " and resid 1226 and name HA  ))
 )(
   (( segid "    " and resid 1227 and name HN  ))
 )
      3.300     3.300     0.000 peak  2563 weight  0.10000E+01 volume -0.16160E+01 ppm1      4.491 ppm2      7.944
 ASSI (
   (( segid "    " and resid 1227 and name HB  ))
 )(
   (( segid "    " and resid 1227 and name HN  ))
 )
      5.000     5.000     0.000 peak  7405 weight  0.10000E+01 volume -0.75300E+00 ppm1      3.694 ppm2      7.945
 ASSI (
   (( segid "    " and resid 1228 and name HB1 ))
 )(
   (( segid "    " and resid 1228 and name HA  ))
 )
      5.000     5.000     0.000 peak  6249 weight  0.10000E+01 volume -0.54900E+00 ppm1      3.713 ppm2      5.532
 ASSI (
   (( segid "    " and resid 1228 and name HB2 ))
 )(
   (( segid "    " and resid 1228 and name HA  ))
 )
      5.000     5.000     0.000 peak  6252 weight  0.10000E+01 volume -0.44900E+00 ppm1      2.721 ppm2      5.538
 ASSI (
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )(
   (( segid "    " and resid 1228 and name HA  ))
 )
      6.000     6.000     0.000 peak  6254 weight  0.10000E+01 volume  0.22000E+00 ppm1      1.445 ppm2      5.527
 ASSI (
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )(
   (( segid "    " and resid 1228 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6368 weight  0.10000E+01 volume  0.46800E+00 ppm1      0.743 ppm2      3.712
 ASSI (
   (( segid "    " and resid 1227 and name HB  ))
 )(
   (( segid "    " and resid 1228 and name HN  ))
 )
      5.000     5.000     0.000 peak  7406 weight  0.10000E+01 volume -0.85000E+00 ppm1      3.693 ppm2      8.369
 ASSI (
   (( segid "    " and resid 1228 and name HA  ))
 )(
   (( segid "    " and resid 1228 and name HN  ))
 )
      6.000     6.000     0.000 peak  6245 weight  0.10000E+01 volume -0.23100E+00 ppm1      5.529 ppm2      8.369
 ASSI (
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )(
   (( segid "    " and resid 1229 and name HA  ))
 )
      5.000     5.000     0.000 peak  6499 weight  0.10000E+01 volume -0.56100E+00 ppm1      6.651 ppm2      4.967
 ASSI (
   (( segid "    " and resid 1230 and name HB2 ))
 )(
   (( segid "    " and resid 1229 and name HA  ))
 )
      6.000     6.000     0.000 peak  6591 weight  0.10000E+01 volume  0.24000E+00 ppm1      1.444 ppm2      4.967
 ASSI (
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )(
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7372 weight  0.10000E+01 volume -0.47100E+00 ppm1      6.653 ppm2      1.430
 ASSI (
   (( segid "    " and resid 1208 and name HA  ))
 )(
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )
      5.000     5.000     0.000 peak  2864 weight  0.10000E+01 volume -0.50000E+00 ppm1      4.474 ppm2      1.440
 ASSI (
   (( segid "    " and resid 1208 and name HB1 ))
 )(
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7373 weight  0.10000E+01 volume -0.10660E+01 ppm1      3.922 ppm2      1.443
 ASSI (
   (( segid "    " and resid 1208 and name HB2 ))
 )(
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7374 weight  0.10000E+01 volume -0.12330E+01 ppm1      3.678 ppm2      1.445
 ASSI (
   (( segid "    " and resid 1205 and name HB2 ))
 )(
   (( segid "    " and resid 1229 and name HN  ))
 )
      6.000     6.000     0.000 peak  8084 weight  0.10000E+01 volume  0.24300E+00 ppm1      2.679 ppm2      9.842
 ASSI (
   (( segid "    " and resid 1208 and name HB1 ))
 )(
   (( segid "    " and resid 1229 and name HN  ))
 )
      6.000     6.000     0.000 peak  8018 weight  0.10000E+01 volume -0.27600E+00 ppm1      3.911 ppm2      9.824
 ASSI (
   (( segid "    " and resid 1208 and name HB2 ))
 )(
   (( segid "    " and resid 1229 and name HN  ))
 )
      6.000     6.000     0.000 peak  8017 weight  0.10000E+01 volume -0.28200E+00 ppm1      3.674 ppm2      9.821
 ASSI (
   (( segid "    " and resid 1228 and name HB1 ))
 )(
   (( segid "    " and resid 1229 and name HN  ))
 )
      6.000     6.000     0.000 peak  7389 weight  0.10000E+01 volume -0.34400E+00 ppm1      3.715 ppm2      9.824
 ASSI (
   (( segid "    " and resid 1228 and name HB2 ))
 )(
   (( segid "    " and resid 1229 and name HN  ))
 )
      6.000     6.000     0.000 peak  7390 weight  0.10000E+01 volume -0.34400E+00 ppm1      2.717 ppm2      9.822
 ASSI (
   (( segid "    " and resid 1229 and name HA  ))
 )(
   (( segid "    " and resid 1229 and name HN  ))
 )
      5.000     5.000     0.000 peak  6489 weight  0.10000E+01 volume -0.61700E+00 ppm1      4.966 ppm2      9.824
 ASSI (
   (( segid "    " and resid 1229 and name HA  ))
 )(
   (( segid "    " and resid 1230 and name HA  ))
 )
      5.000     5.000     0.000 peak  6494 weight  0.10000E+01 volume -0.51300E+00 ppm1      4.965 ppm2      3.714
 ASSI (
   (( segid "    " and resid 1230 and name HB1 ))
 )(
   (( segid "    " and resid 1230 and name HA  ))
 )
      5.000     5.000     0.000 peak  6605 weight  0.10000E+01 volume  0.78700E+00 ppm1      1.631 ppm2      3.726
 ASSI (
   (( segid "    " and resid 1230 and name HB2 ))
 )(
   (( segid "    " and resid 1230 and name HA  ))
 )
      5.000     5.000     0.000 peak  6606 weight  0.10000E+01 volume  0.85600E+00 ppm1      1.447 ppm2      3.725
 ASSI (
   (( segid "    " and resid 1230 and name HD2 ))
  OR 
   (( segid "    " and resid 1230 and name HD1 ))
 )(
   (( segid "    " and resid 1230 and name HA  ))
 )
      6.000     6.000     0.000 peak  6607 weight  0.10000E+01 volume  0.35900E+00 ppm1      1.400 ppm2      3.723
 ASSI (
   (( segid "    " and resid 1230 and name HG2 ))
 )(
   (( segid "    " and resid 1230 and name HA  ))
 )
      5.000     5.000     0.000 peak  6609 weight  0.10000E+01 volume  0.58100E+00 ppm1      1.101 ppm2      3.722
 ASSI (
   (( segid "    " and resid 1230 and name HD2 ))
  OR 
   (( segid "    " and resid 1230 and name HD1 ))
 )(
   (( segid "    " and resid 1230 and name HE2 ))
  OR 
   (( segid "    " and resid 1230 and name HE1 ))
 )
      5.000     5.000     0.000 peak  9536 weight  0.10000E+01 volume  0.94100E+00 ppm1      1.398 ppm2      2.803
 ASSI (
   (( segid "    " and resid 1230 and name HG2 ))
 )(
   (( segid "    " and resid 1230 and name HE2 ))
  OR 
   (( segid "    " and resid 1230 and name HE1 ))
 )
      5.000     5.000     0.000 peak  9277 weight  0.10000E+01 volume  0.80900E+00 ppm1      1.101 ppm2      2.813
 ASSI (
   (( segid "    " and resid 1230 and name HD2 ))
  OR 
   (( segid "    " and resid 1230 and name HD1 ))
 )(
   (( segid "    " and resid 1230 and name HG1 ))
 )
      2.700     2.700     0.000 peak  7341 weight  0.10000E+01 volume  0.33120E+01 ppm1      1.398 ppm2      1.216
 ASSI (
   (( segid "    " and resid 1230 and name HD2 ))
  OR 
   (( segid "    " and resid 1230 and name HD1 ))
 )(
   (( segid "    " and resid 1230 and name HG2 ))
 )
      5.000     5.000     0.000 peak  9506 weight  0.10000E+01 volume  0.10600E+01 ppm1      1.396 ppm2      1.104
 ASSI (
   (( segid "    " and resid 1229 and name HA  ))
 )(
   (( segid "    " and resid 1230 and name HN  ))
 )
      2.700     2.700     0.000 peak  6490 weight  0.10000E+01 volume -0.41480E+01 ppm1      4.965 ppm2      8.789
 ASSI (
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )(
   (( segid "    " and resid 1230 and name HN  ))
 )
      3.300     3.300     0.000 peak  7358 weight  0.10000E+01 volume  0.19870E+01 ppm1      1.444 ppm2      8.788
 ASSI (
   (( segid "    " and resid 1230 and name HB1 ))
 )(
   (( segid "    " and resid 1230 and name HN  ))
 )
      5.000     5.000     0.000 peak  7344 weight  0.10000E+01 volume  0.11120E+01 ppm1      1.631 ppm2      8.788
 ASSI (
   (( segid "    " and resid 1230 and name HB2 ))
 )(
   (( segid "    " and resid 1230 and name HN  ))
 )
      5.000     5.000     0.000 peak  7345 weight  0.10000E+01 volume  0.13280E+01 ppm1      1.444 ppm2      8.790
 ASSI (
   (( segid "    " and resid 1231 and name HB1 ))
 )(
   (( segid "    " and resid 1231 and name HA  ))
 )
      5.000     5.000     0.000 peak  6599 weight  0.10000E+01 volume  0.11690E+01 ppm1      1.714 ppm2      4.015
 ASSI (
   (( segid "    " and resid 1231 and name HG2 ))
  OR 
   (( segid "    " and resid 1231 and name HG1 ))
 )(
   (( segid "    " and resid 1231 and name HA  ))
 )
      5.000     5.000     0.000 peak  7326 weight  0.10000E+01 volume  0.60100E+00 ppm1      1.466 ppm2      4.016
 ASSI (
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
 )(
   (( segid "    " and resid 1231 and name HN  ))
 )
      6.000     6.000     0.000 peak  7359 weight  0.10000E+01 volume  0.25800E+00 ppm1      1.444 ppm2      7.766
 ASSI (
   (( segid "    " and resid 1230 and name HA  ))
 )(
   (( segid "    " and resid 1231 and name HN  ))
 )
      2.700     2.700     0.000 peak  2939 weight  0.10000E+01 volume -0.37790E+01 ppm1      3.721 ppm2      7.763
 ASSI (
   (( segid "    " and resid 1231 and name HG2 ))
  OR 
   (( segid "    " and resid 1231 and name HG1 ))
 )(
   (( segid "    " and resid 1231 and name HN  ))
 )
      5.000     5.000     0.000 peak  9272 weight  0.10000E+01 volume  0.81800E+00 ppm1      1.467 ppm2      7.753
 ASSI (
   (( segid "    " and resid 1118 and name HA1 ))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      6.000     6.000     0.000 peak  7108 weight  0.10000E+01 volume -0.15700E+00 ppm1      4.531 ppm2      0.204
 ASSI (
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )(
   (( segid "    " and resid 1118 and name HA2 ))
 )
      6.000     6.000     0.000 peak  9681 weight  0.10000E+01 volume  0.33800E+00 ppm1      0.195 ppm2      3.836
 ASSI (
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )(
   (( segid "    " and resid 1120 and name HG12))
 )
      5.000     5.000     0.000 peak  6410 weight  0.10000E+01 volume  0.97900E+00 ppm1      0.107 ppm2      0.760
 ASSI (
   (( segid "    " and resid 1120 and name HA  ))
 )(
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      5.000     5.000     0.000 peak  6578 weight  0.10000E+01 volume -0.14050E+01 ppm1      4.738 ppm2      0.100
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      2.700     2.700     0.000 peak  7085 weight  0.10000E+01 volume  0.44180E+01 ppm1      0.500 ppm2      0.104
 ASSI (
   (( segid "    " and resid 1136 and name HA  ))
 )(
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      5.000     5.000     0.000 peak  6440 weight  0.10000E+01 volume -0.52200E+00 ppm1      4.993 ppm2      0.107
 ASSI (
   (( segid "    " and resid 1121 and name HB  ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      2.700     2.700     0.000 peak  7100 weight  0.10000E+01 volume -0.34180E+01 ppm1      4.430 ppm2      0.976
 ASSI (
   (( segid "    " and resid 1135 and name HG2 ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      6.000     6.000     0.000 peak  9493 weight  0.10000E+01 volume  0.22800E+00 ppm1      2.063 ppm2      0.962
 ASSI (
   (( segid "    " and resid 1136 and name HA  ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      5.000     5.000     0.000 peak  6441 weight  0.10000E+01 volume -0.43500E+00 ppm1      4.992 ppm2      0.978
 ASSI (
   (( segid "    " and resid 1137 and name HG2 ))
  OR 
   (( segid "    " and resid 1137 and name HG1 ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      5.000     5.000     0.000 peak  9176 weight  0.10000E+01 volume  0.53300E+00 ppm1      2.240 ppm2      0.973
 ASSI (
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )(
   (( segid "    " and resid 1121 and name HN  ))
 )
      5.000     5.000     0.000 peak  6402 weight  0.10000E+01 volume  0.78400E+00 ppm1      0.106 ppm2      8.273
 ASSI (
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )(
   (( segid "    " and resid 1124 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7078 weight  0.10000E+01 volume  0.64000E+00 ppm1      0.501 ppm2      2.109
 ASSI (
   (( segid "    " and resid 1124 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG1 ))
 )(
   (( segid "    " and resid 1124 and name HB1 ))
 )
      3.300     3.300     0.000 peak  7091 weight  0.10000E+01 volume  0.27330E+01 ppm1      1.870 ppm2      2.107
 ASSI (
   (( segid "    " and resid 1124 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG1 ))
 )(
   (( segid "    " and resid 1124 and name HD2 ))
 )
      3.300     3.300     0.000 peak  9477 weight  0.10000E+01 volume  0.26780E+01 ppm1      1.873 ppm2      2.970
 ASSI (
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
 )(
   (( segid "    " and resid 1125 and name HA  ))
 )
      3.300     3.300     0.000 peak  9481 weight  0.10000E+01 volume  0.22460E+01 ppm1      0.880 ppm2      4.583
 ASSI (
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )(
   (( segid "    " and resid 1125 and name HD13))
  OR 
   (( segid "    " and resid 1125 and name HD12))
  OR 
   (( segid "    " and resid 1125 and name HD11))
 )
      6.000     6.000     0.000 peak  9118 weight  0.10000E+01 volume -0.34700E+00 ppm1      6.820 ppm2      0.701
 ASSI (
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )(
   (( segid "    " and resid 1126 and name HB2 ))
  OR 
   (( segid "    " and resid 1126 and name HB1 ))
 )
      6.000     6.000     0.000 peak  9462 weight  0.10000E+01 volume  0.28500E+00 ppm1      0.849 ppm2      3.906
 ASSI (
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )(
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
  OR 
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )
      3.300     3.300     0.000 peak  9147 weight  0.10000E+01 volume  0.22330E+01 ppm1      1.551 ppm2      0.827
 ASSI (
   (( segid "    " and resid 1127 and name HB  ))
 )(
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
  OR 
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )
      2.700     2.700     0.000 peak  9125 weight  0.10000E+01 volume  0.38880E+01 ppm1      1.877 ppm2      0.829
 ASSI (
   (( segid "    " and resid 1126 and name HB2 ))
  OR 
   (( segid "    " and resid 1126 and name HB1 ))
 )(
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )
      5.000     5.000     0.000 peak  7968 weight  0.10000E+01 volume -0.15090E+01 ppm1      3.901 ppm2      0.844
 ASSI (
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8108 weight  0.10000E+01 volume -0.12000E+01 ppm1      6.820 ppm2      7.123
 ASSI (
   (( segid "    " and resid 1112 and name HD1 ))
 )(
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )
      5.000     5.000     0.000 peak  7294 weight  0.10000E+01 volume -0.10310E+01 ppm1      3.537 ppm2      6.817
 ASSI (
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )(
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )
      5.000     5.000     0.000 peak  9109 weight  0.10000E+01 volume -0.63800E+00 ppm1      7.114 ppm2      6.818
 ASSI (
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )(
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )
      5.000     5.000     0.000 peak  9052 weight  0.10000E+01 volume  0.10500E+01 ppm1      0.578 ppm2      6.818
 ASSI (
   (( segid "    " and resid 1130 and name HD2 ))
 )(
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9102 weight  0.10000E+01 volume -0.13470E+01 ppm1      3.404 ppm2      1.389
 ASSI (
   (( segid "    " and resid 1130 and name HG1 ))
 )(
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9103 weight  0.10000E+01 volume  0.48400E+00 ppm1      2.029 ppm2      1.383
 ASSI (
   (( segid "    " and resid 1130 and name HG2 ))
 )(
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9104 weight  0.10000E+01 volume  0.76700E+00 ppm1      1.905 ppm2      1.383
 ASSI (
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )(
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )
      5.000     5.000     0.000 peak  9117 weight  0.10000E+01 volume -0.52100E+00 ppm1      6.817 ppm2      0.574
 ASSI (
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )(
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )
      2.700     2.700     0.000 peak  7770 weight  0.10000E+01 volume  0.36750E+01 ppm1      0.099 ppm2      0.584
 ASSI (
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )
      6.000     6.000     0.000 peak  8858 weight  0.10000E+01 volume  0.20500E+00 ppm1      0.755 ppm2      0.101
 ASSI (
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )(
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9048 weight  0.10000E+01 volume  0.12560E+01 ppm1      0.195 ppm2      2.459
 ASSI (
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )(
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7694 weight  0.10000E+01 volume -0.13640E+01 ppm1      6.599 ppm2      2.455
 ASSI (
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7703 weight  0.10000E+01 volume  0.10270E+01 ppm1      0.199 ppm2      6.598
 ASSI (
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7705 weight  0.10000E+01 volume  0.34200E+00 ppm1      0.438 ppm2      6.599
 ASSI (
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6404 weight  0.10000E+01 volume  0.34700E+00 ppm1      0.106 ppm2      6.585
 ASSI (
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      3.300     3.300     0.000 peak  7709 weight  0.10000E+01 volume -0.17910E+01 ppm1      6.434 ppm2      6.599
 ASSI (
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )(
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )
      5.000     5.000     0.000 peak  8893 weight  0.10000E+01 volume  0.55800E+00 ppm1      0.435 ppm2      6.437
 ASSI (
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )(
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )
      5.000     5.000     0.000 peak  7692 weight  0.10000E+01 volume -0.14010E+01 ppm1      6.601 ppm2      6.441
 ASSI (
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )(
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )
      6.000     6.000     0.000 peak  7675 weight  0.10000E+01 volume -0.21700E+00 ppm1      6.846 ppm2      0.430
 ASSI (
   (( segid "    " and resid 1141 and name HB1 ))
 )(
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )
      6.000     6.000     0.000 peak  9000 weight  0.10000E+01 volume  0.32700E+00 ppm1      2.071 ppm2      0.637
 ASSI (
   (( segid "    " and resid 1141 and name HB2 ))
 )(
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )
      5.000     5.000     0.000 peak  8999 weight  0.10000E+01 volume  0.91200E+00 ppm1      1.192 ppm2      0.637
 ASSI (
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )(
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )
      6.000     6.000     0.000 peak  7676 weight  0.10000E+01 volume -0.19200E+00 ppm1      6.847 ppm2      0.636
 ASSI (
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1141 and name HG  ))
 )
      3.300     3.300     0.000 peak  9428 weight  0.10000E+01 volume  0.22740E+01 ppm1      0.630 ppm2      1.421
 ASSI (
   (( segid "    " and resid 1142 and name HE2 ))
  OR 
   (( segid "    " and resid 1142 and name HE1 ))
 )(
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7724 weight  0.10000E+01 volume -0.15220E+01 ppm1      6.196 ppm2      6.670
 ASSI (
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )(
   (( segid "    " and resid 1142 and name HE2 ))
  OR 
   (( segid "    " and resid 1142 and name HE1 ))
 )
      5.000     5.000     0.000 peak  8086 weight  0.10000E+01 volume -0.10600E+01 ppm1      6.668 ppm2      6.198
 ASSI (
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )(
   (( segid "    " and resid 1143 and name HG2 ))
  OR 
   (( segid "    " and resid 1143 and name HG1 ))
 )
      5.000     5.000     0.000 peak  9307 weight  0.10000E+01 volume  0.69000E+00 ppm1      0.418 ppm2      2.184
 ASSI (
   (( segid "    " and resid 1148 and name HG1 ))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      6.000     6.000     0.000 peak  3339 weight  0.10000E+01 volume  0.28700E+00 ppm1      1.579 ppm2      0.587
 ASSI (
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )(
   (( segid "    " and resid 1144 and name HN  ))
 )
      5.000     5.000     0.000 peak  8527 weight  0.10000E+01 volume  0.55100E+00 ppm1      0.758 ppm2      8.576
 ASSI (
   (( segid "    " and resid 1148 and name HG1 ))
 )(
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
 )
      3.300     3.300     0.000 peak  9060 weight  0.10000E+01 volume  0.24860E+01 ppm1      1.579 ppm2      1.769
 ASSI (
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )
      3.300     3.300     0.000 peak  7773 weight  0.10000E+01 volume  0.16020E+01 ppm1      0.099 ppm2      0.435
 ASSI (
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )
      3.300     3.300     0.000 peak  8859 weight  0.10000E+01 volume  0.23250E+01 ppm1      0.756 ppm2      0.441
 ASSI (
   (( segid "    " and resid 1157 and name HB1 ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )
      6.000     6.000     0.000 peak  8714 weight  0.10000E+01 volume  0.39700E+00 ppm1      3.490 ppm2      0.438
 ASSI (
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )(
   (( segid "    " and resid 1151 and name HA  ))
 )
      5.000     5.000     0.000 peak  6263 weight  0.10000E+01 volume  0.79900E+00 ppm1      1.050 ppm2      5.435
 ASSI (
   (( segid "    " and resid 1131 and name HA  ))
 )(
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )
      5.000     5.000     0.000 peak  7005 weight  0.10000E+01 volume -0.12430E+01 ppm1      3.808 ppm2      1.055
 ASSI (
   (( segid "    " and resid 1154 and name HB2 ))
 )(
   (( segid "    " and resid 1153 and name HB2 ))
  OR 
   (( segid "    " and resid 1153 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8819 weight  0.10000E+01 volume  0.23800E+00 ppm1      2.695 ppm2      1.717
 ASSI (
   (( segid "    " and resid 1159 and name HG2 ))
  OR 
   (( segid "    " and resid 1159 and name HG1 ))
 )(
   (( segid "    " and resid 1160 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8712 weight  0.10000E+01 volume  0.40800E+00 ppm1      2.414 ppm2      3.987
 ASSI (
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
 )(
   (( segid "    " and resid 1164 and name HA  ))
 )
      3.300     3.300     0.000 peak  7589 weight  0.10000E+01 volume  0.16030E+01 ppm1      0.664 ppm2      4.360
 ASSI (
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
 )
      5.000     5.000     0.000 peak  9322 weight  0.10000E+01 volume  0.11800E+01 ppm1      1.364 ppm2      0.662
 ASSI (
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )(
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )
      5.000     5.000     0.000 peak  7791 weight  0.10000E+01 volume -0.40200E+00 ppm1      7.164 ppm2      1.030
 ASSI (
   (( segid "    " and resid 1179 and name HA  ))
 )(
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )
      5.000     5.000     0.000 peak  6321 weight  0.10000E+01 volume -0.14650E+01 ppm1      5.227 ppm2      0.745
 ASSI (
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )(
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )
      5.000     5.000     0.000 peak  7789 weight  0.10000E+01 volume -0.41300E+00 ppm1      7.170 ppm2      0.503
 ASSI (
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )(
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )
      5.000     5.000     0.000 peak  7687 weight  0.10000E+01 volume  0.54200E+00 ppm1      0.432 ppm2      6.846
 ASSI (
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )
      6.000     6.000     0.000 peak  7688 weight  0.10000E+01 volume  0.33700E+00 ppm1      0.629 ppm2      6.842
 ASSI (
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )(
   (( segid "    " and resid 1190 and name HE2 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )
      6.000     6.000     0.000 peak  7849 weight  0.10000E+01 volume  0.37700E+00 ppm1      0.431 ppm2      6.699
 ASSI (
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )(
   (( segid "    " and resid 1190 and name HE2 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )
      6.000     6.000     0.000 peak  9639 weight  0.10000E+01 volume  0.26400E+00 ppm1      0.629 ppm2      6.740
 ASSI (
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
 )(
   (( segid "    " and resid 1190 and name HE2 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )
      6.000     6.000     0.000 peak  9297 weight  0.10000E+01 volume  0.19900E+00 ppm1      0.767 ppm2      6.738
 ASSI (
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )(
   (( segid "    " and resid 1190 and name HE2 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )
      2.700     2.700     0.000 peak  7683 weight  0.10000E+01 volume -0.31000E+01 ppm1      6.848 ppm2      6.735
 ASSI (
   (( segid "    " and resid 1189 and name HD13))
  OR 
   (( segid "    " and resid 1189 and name HD12))
  OR 
   (( segid "    " and resid 1189 and name HD11))
 )(
   (( segid "    " and resid 1190 and name HN  ))
 )
      6.000     6.000     0.000 peak  7454 weight  0.10000E+01 volume  0.24400E+00 ppm1      0.913 ppm2      7.368
 ASSI (
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )(
   (( segid "    " and resid 1197 and name HA  ))
 )
      5.000     5.000     0.000 peak  6809 weight  0.10000E+01 volume  0.97100E+00 ppm1      0.150 ppm2      4.040
 ASSI (
   (( segid "    " and resid 1191 and name HB2 ))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
 )
      5.000     5.000     0.000 peak  7799 weight  0.10000E+01 volume -0.14810E+01 ppm1      3.438 ppm2      0.631
 ASSI (
   (( segid "    " and resid 1197 and name HB  ))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
 )
      3.300     3.300     0.000 peak  8219 weight  0.10000E+01 volume  0.27650E+01 ppm1      1.547 ppm2      0.631
 ASSI (
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
 )
      2.700     2.700     0.000 peak  7779 weight  0.10000E+01 volume  0.40690E+01 ppm1      0.146 ppm2      0.633
 ASSI (
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )(
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )
      5.000     5.000     0.000 peak  8592 weight  0.10000E+01 volume  0.11010E+01 ppm1      0.700 ppm2      0.151
 ASSI (
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )(
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )
      3.300     3.300     0.000 peak  8385 weight  0.10000E+01 volume  0.26850E+01 ppm1      0.492 ppm2      0.147
 ASSI (
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )(
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )
      6.000     6.000     0.000 peak  7783 weight  0.10000E+01 volume -0.26900E+00 ppm1      7.173 ppm2      0.137
 ASSI (
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )
      5.000     5.000     0.000 peak  8605 weight  0.10000E+01 volume  0.70500E+00 ppm1      1.027 ppm2      7.169
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )
      5.000     5.000     0.000 peak  7443 weight  0.10000E+01 volume  0.71200E+00 ppm1      0.371 ppm2      7.163
 ASSI (
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )
      5.000     5.000     0.000 peak  8394 weight  0.10000E+01 volume  0.12530E+01 ppm1      0.491 ppm2      7.166
 ASSI (
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )
      5.000     5.000     0.000 peak  7835 weight  0.10000E+01 volume  0.59400E+00 ppm1      0.529 ppm2      7.170
 ASSI (
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
 )
      6.000     6.000     0.000 peak  7717 weight  0.10000E+01 volume -0.28400E+00 ppm1      6.787 ppm2      7.166
 ASSI (
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
 )(
   (( segid "    " and resid 1199 and name HN  ))
 )
      5.000     5.000     0.000 peak  7914 weight  0.10000E+01 volume  0.65500E+00 ppm1      0.687 ppm2      8.458
 ASSI (
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
 )(
   (( segid "    " and resid 1200 and name HA  ))
 )
      5.000     5.000     0.000 peak  6798 weight  0.10000E+01 volume  0.89000E+00 ppm1      0.779 ppm2      4.585
 ASSI (
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
 )(
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )
      2.700     2.700     0.000 peak  8419 weight  0.10000E+01 volume  0.31290E+01 ppm1      1.222 ppm2      0.620
 ASSI (
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
 )(
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )
      2.700     2.700     0.000 peak  8175 weight  0.10000E+01 volume  0.39390E+01 ppm1      0.784 ppm2      0.619
 ASSI (
   (( segid "    " and resid 1207 and name HB1 ))
 )(
   (( segid "    " and resid 1207 and name HD13))
  OR 
   (( segid "    " and resid 1207 and name HD12))
  OR 
   (( segid "    " and resid 1207 and name HD11))
 )
      3.300     3.300     0.000 peak  8037 weight  0.10000E+01 volume  0.22010E+01 ppm1      1.791 ppm2      0.853
 ASSI (
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
 )(
   (( segid "    " and resid 1217 and name HB  ))
 )
      2.700     2.700     0.000 peak  7200 weight  0.10000E+01 volume  0.31720E+01 ppm1      1.047 ppm2      3.890
 ASSI (
   (( segid "    " and resid 1194 and name HA2 ))
 )(
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
 )
      5.000     5.000     0.000 peak  6742 weight  0.10000E+01 volume -0.70800E+00 ppm1      3.587 ppm2      1.052
 ASSI (
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )(
   (( segid "    " and resid 1225 and name HB2 ))
  OR 
   (( segid "    " and resid 1225 and name HB1 ))
 )
      5.000     5.000     0.000 peak  7439 weight  0.10000E+01 volume  0.55200E+00 ppm1      0.372 ppm2      2.529
 ASSI (
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )(
   (( segid "    " and resid 1225 and name HE2 ))
  OR 
   (( segid "    " and resid 1225 and name HE1 ))
 )
      5.000     5.000     0.000 peak  7739 weight  0.10000E+01 volume  0.96800E+00 ppm1     -0.388 ppm2      6.738
 ASSI (
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )(
   (( segid "    " and resid 1226 and name HD2 ))
 )
      6.000     6.000     0.000 peak  6370 weight  0.10000E+01 volume  0.32600E+00 ppm1      0.742 ppm2      2.862
 ASSI (
   (( segid "    " and resid 1107 and name HN  ))
 )(
   (( segid "    " and resid 1106 and name HA  ))
 )
      2.700     2.700     0.000 peak  9251 weight  0.10000E+01 volume  0.60170E+01 ppm1      8.246 ppm2      4.532
 ASSI (
   (( segid "    " and resid 1137 and name HE22))
 )(
   (( segid "    " and resid 1137 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8781 weight  0.10000E+01 volume  0.20300E+00 ppm1      6.705 ppm2      1.768
 ASSI (
   (( segid "    " and resid 1137 and name HE21))
 )(
   (( segid "    " and resid 1137 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8786 weight  0.10000E+01 volume  0.19000E+00 ppm1      7.406 ppm2      1.775
 ASSI (
   (( segid "    " and resid 1137 and name HE21))
 )(
   (( segid "    " and resid 1137 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8787 weight  0.10000E+01 volume  0.14400E+00 ppm1      7.406 ppm2      1.873
 ASSI (
   (( segid "    " and resid 1137 and name HE21))
 )(
   (( segid "    " and resid 1139 and name HA  ))
  OR 
   (( segid "    " and resid 1121 and name HA  ))
 )
      6.000     6.000     0.000 peak  8791 weight  0.10000E+01 volume  0.17100E+00 ppm1      7.406 ppm2      4.135
 ASSI (
   (( segid "    " and resid 1137 and name HE22))
 )(
   (( segid "    " and resid 1139 and name HA  ))
  OR 
   (( segid "    " and resid 1121 and name HA  ))
 )
      6.000     6.000     0.000 peak  8780 weight  0.10000E+01 volume  0.15000E+00 ppm1      6.701 ppm2      4.144
 ASSI (
   (( segid "    " and resid 1213 and name HN  ))
  OR 
   (( segid "    " and resid 1147 and name HD21))
 )(
   (( segid "    " and resid 1226 and name HB2 ))
  OR 
   (( segid "    " and resid 1161 and name HB2 ))
  OR 
   (( segid "    " and resid 1149 and name HG1 ))
  OR 
   (( segid "    " and resid 1149 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
 )
      6.000     6.000     0.000 peak  4570 weight  0.10000E+01 volume  0.30600E+00 ppm1      7.823 ppm2      1.600
 ASSI (
   (( segid "    " and resid 1213 and name HN  ))
  OR 
   (( segid "    " and resid 1147 and name HD21))
 )(
   (( segid "    " and resid 1226 and name HG2 ))
  OR 
   (( segid "    " and resid 1224 and name HB2 ))
  OR 
   (( segid "    " and resid 1224 and name HB1 ))
  OR 
   (( segid "    " and resid 1214 and name HG  ))
  OR 
   (( segid "    " and resid 1149 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4569 weight  0.10000E+01 volume  0.34400E+00 ppm1      7.822 ppm2      1.691
 ASSI (
   (( segid "    " and resid 1213 and name HN  ))
  OR 
   (( segid "    " and resid 1147 and name HD21))
 )(
   (( segid "    " and resid 1215 and name HB1 ))
  OR 
   (( segid "    " and resid 1207 and name HG  ))
  OR 
   (( segid "    " and resid 1207 and name HB1 ))
  OR 
   (( segid "    " and resid 1161 and name HB1 ))
  OR 
   (( segid "    " and resid 1160 and name HG2 ))
  OR 
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
 )
      6.000     6.000     0.000 peak  4568 weight  0.10000E+01 volume  0.24300E+00 ppm1      7.823 ppm2      1.766
 ASSI (
   (( segid "    " and resid 1147 and name HD21))
 )(
   (( segid "    " and resid 1147 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4564 weight  0.10000E+01 volume  0.89200E+00 ppm1      7.824 ppm2      2.911
 ASSI (
   (( segid "    " and resid 1213 and name HN  ))
 )(
   (( segid "    " and resid 1212 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4563 weight  0.10000E+01 volume  0.68200E+00 ppm1      7.817 ppm2      3.041
 ASSI (
   (( segid "    " and resid 1213 and name HN  ))
 )(
   (( segid "    " and resid 1212 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4562 weight  0.10000E+01 volume  0.80100E+00 ppm1      7.817 ppm2      3.186
 ASSI (
   (( segid "    " and resid 1213 and name HN  ))
 )(
   (( segid "    " and resid 1213 and name HA  ))
 )
      3.300     3.300     0.000 peak  4561 weight  0.10000E+01 volume  0.17120E+01 ppm1      7.817 ppm2      4.395
 ASSI (
   (( segid "    " and resid 1213 and name HN  ))
 )(
   (( segid "    " and resid 1212 and name HN  ))
 )
      5.000     5.000     0.000 peak  4558 weight  0.10000E+01 volume  0.66300E+00 ppm1      7.816 ppm2      8.564
 ASSI (
   (( segid "    " and resid 1213 and name HN  ))
 )(
   (( segid "    " and resid 1214 and name HD23))
  OR 
   (( segid "    " and resid 1214 and name HD22))
  OR 
   (( segid "    " and resid 1214 and name HD21))
  OR 
   (( segid "    " and resid 1179 and name HG23))
 )
      6.000     6.000     0.000 peak  4575 weight  0.10000E+01 volume  0.25300E+00 ppm1      7.825 ppm2      0.699
 ASSI (
   (( segid "    " and resid 1213 and name HN  ))
 )(
   (( segid "    " and resid 1207 and name HD23))
  OR 
   (( segid "    " and resid 1207 and name HD22))
  OR 
   (( segid "    " and resid 1207 and name HD21))
 )
      5.000     5.000     0.000 peak  4574 weight  0.10000E+01 volume  0.55900E+00 ppm1      7.821 ppm2      0.942
 ASSI (
   (( segid "    " and resid 1213 and name HN  ))
 )(
   (( segid "    " and resid 1213 and name HG23))
  OR 
   (( segid "    " and resid 1213 and name HG22))
  OR 
   (( segid "    " and resid 1213 and name HG21))
 )
      2.700     2.700     0.000 peak  4572 weight  0.10000E+01 volume  0.61630E+01 ppm1      7.824 ppm2      1.220
 ASSI (
   (( segid "    " and resid 1147 and name HD21))
 )(
   (( segid "    " and resid 1149 and name HG2 ))
  OR 
   (( segid "    " and resid 1144 and name HG  ))
 )
      6.000     6.000     0.000 peak  4571 weight  0.10000E+01 volume  0.21200E+00 ppm1      7.825 ppm2      1.340
 ASSI (
   (( segid "    " and resid 1213 and name HN  ))
 )(
   (( segid "    " and resid 1211 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4576 weight  0.10000E+01 volume  0.27800E+00 ppm1      7.822 ppm2      3.766
 ASSI (
   (( segid "    " and resid 1213 and name HN  ))
  OR 
   (( segid "    " and resid 1147 and name HD21))
 )(
   (( segid "    " and resid 1211 and name HB1 ))
  OR 
   (( segid "    " and resid 1148 and name HA  ))
 )
      6.000     6.000     0.000 peak  4577 weight  0.10000E+01 volume  0.38900E+00 ppm1      7.822 ppm2      3.928
 ASSI (
   (( segid "    " and resid 1213 and name HN  ))
  OR 
   (( segid "    " and resid 1147 and name HD21))
 )(
   (( segid "    " and resid 1225 and name HA  ))
  OR 
   (( segid "    " and resid 1214 and name HA  ))
  OR 
   (( segid "    " and resid 1158 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4578 weight  0.10000E+01 volume  0.18400E+00 ppm1      7.826 ppm2      4.151
 ASSI (
   (( segid "    " and resid 1213 and name HN  ))
  OR 
   (( segid "    " and resid 1147 and name HD21))
 )(
   (( segid "    " and resid 1214 and name HN  ))
  OR 
   (( segid "    " and resid 1151 and name HN  ))
  OR 
   (( segid "    " and resid 1147 and name HN  ))
 )
      5.000     5.000     0.000 peak  4546 weight  0.10000E+01 volume  0.58500E+00 ppm1      7.818 ppm2      8.369
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )
      6.000     6.000     0.000 peak  5222 weight  0.10000E+01 volume  0.13200E+00 ppm1      7.786 ppm2     -0.422
 ASSI (
   (( segid "    " and resid 1134 and name HN  ))
 )(
   (( segid "    " and resid 1133 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5848 weight  0.10000E+01 volume  0.12020E+01 ppm1      8.244 ppm2      3.808
 ASSI (
   (( segid "    " and resid 1134 and name HN  ))
 )(
   (( segid "    " and resid 1134 and name HA  ))
 )
      5.000     5.000     0.000 peak  5851 weight  0.10000E+01 volume  0.80100E+00 ppm1      8.245 ppm2      4.371
 ASSI (
   (( segid "    " and resid 1228 and name HN  ))
  OR 
   (( segid "    " and resid 1205 and name HN  ))
  OR 
   (( segid "    " and resid 1172 and name HN  ))
  OR 
   (( segid "    " and resid 1147 and name HN  ))
 )(
   (( segid "    " and resid 1213 and name HN  ))
  OR 
   (( segid "    " and resid 1179 and name HN  ))
  OR 
   (( segid "    " and resid 1177 and name HN  ))
  OR 
   (( segid "    " and resid 1175 and name HN  ))
  OR 
   (( segid "    " and resid 1147 and name HD21))
 )
      5.000     5.000     0.000 peak   377 weight  0.10000E+01 volume  0.72400E+00 ppm1      8.344 ppm2      7.832
 ASSI (
   (( segid "    " and resid 1228 and name HN  ))
 )(
   (( segid "    " and resid 1227 and name HN  ))
 )
      5.000     5.000     0.000 peak   378 weight  0.10000E+01 volume  0.50500E+00 ppm1      8.340 ppm2      7.963
 ASSI (
   (( segid "    " and resid 1205 and name HN  ))
 )(
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      3.300     3.300     0.000 peak  2129 weight  0.10000E+01 volume  0.27780E+01 ppm1      8.297 ppm2      6.642
 ASSI (
   (( segid "    " and resid 1228 and name HN  ))
  OR 
   (( segid "    " and resid 1181 and name HN  ))
  OR 
   (( segid "    " and resid 1105 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1200 and name HB  ))
  OR 
   (( segid "    " and resid 1198 and name HG2 ))
  OR 
   (( segid "    " and resid 1186 and name HD2 ))
  OR 
   (( segid "    " and resid 1186 and name HD1 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
  OR 
   (( segid "    " and resid 1130 and name HG1 ))
 )
      5.000     5.000     0.000 peak  2557 weight  0.10000E+01 volume  0.10440E+01 ppm1      8.339 ppm2      2.078
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1183 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5082 weight  0.10000E+01 volume  0.96000E-01 ppm1      8.087 ppm2      7.282
 ASSI (
   (( segid "    " and resid 1107 and name HN  ))
 )(
   (( segid "    " and resid 1106 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5803 weight  0.10000E+01 volume  0.91000E+00 ppm1      8.246 ppm2      3.108
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
 )
      6.000     6.000     0.000 peak  6714 weight  0.10000E+01 volume  0.31500E+00 ppm1      7.491 ppm2      0.811
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )
      5.000     5.000     0.000 peak  6711 weight  0.10000E+01 volume  0.12890E+01 ppm1      7.492 ppm2      1.538
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1108 and name HB2 ))
 )
      3.300     3.300     0.000 peak  6710 weight  0.10000E+01 volume  0.22510E+01 ppm1      7.490 ppm2      1.653
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1108 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6709 weight  0.10000E+01 volume  0.15200E+01 ppm1      7.494 ppm2      1.787
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1130 and name HG2 ))
  OR 
   (( segid "    " and resid 1130 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6708 weight  0.10000E+01 volume  0.53100E+00 ppm1      7.492 ppm2      1.881
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1130 and name HG1 ))
 )
      6.000     6.000     0.000 peak  6707 weight  0.10000E+01 volume  0.17100E+00 ppm1      7.492 ppm2      2.017
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1109 and name HB1 ))
  OR 
   (( segid "    " and resid 1108 and name HE2 ))
  OR 
   (( segid "    " and resid 1108 and name HE1 ))
 )
      6.000     6.000     0.000 peak  6704 weight  0.10000E+01 volume  0.37800E+00 ppm1      7.490 ppm2      2.888
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1154 and name HB1 ))
  OR 
   (( segid "    " and resid 1128 and name HB1 ))
  OR 
   (( segid "    " and resid 1106 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6705 weight  0.10000E+01 volume  0.16500E+00 ppm1      7.491 ppm2      2.999
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1106 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6706 weight  0.10000E+01 volume  0.17400E+00 ppm1      7.492 ppm2      3.134
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1130 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6703 weight  0.10000E+01 volume  0.27800E+00 ppm1      7.492 ppm2      3.631
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1108 and name HA  ))
 )
      3.300     3.300     0.000 peak  6701 weight  0.10000E+01 volume  0.19390E+01 ppm1      7.491 ppm2      4.249
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1109 and name HA  ))
  OR 
   (( segid "    " and resid 1106 and name HA  ))
 )
      5.000     5.000     0.000 peak  6699 weight  0.10000E+01 volume  0.60500E+00 ppm1      7.491 ppm2      4.527
 ASSI (
   (( segid "    " and resid 1108 and name HN  ))
 )(
   (( segid "    " and resid 1107 and name HN  ))
 )
      3.300     3.300     0.000 peak  6150 weight  0.10000E+01 volume  0.20160E+01 ppm1      7.488 ppm2      8.244
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1155 and name HA1 ))
  OR 
   (( segid "    " and resid 1130 and name HA  ))
  OR 
   (( segid "    " and resid 1110 and name HA2 ))
 )
      6.000     6.000     0.000 peak  6137 weight  0.10000E+01 volume  0.17100E+00 ppm1      8.621 ppm2      3.926
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
  OR 
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
 )
      5.000     5.000     0.000 peak  6149 weight  0.10000E+01 volume  0.79300E+00 ppm1      8.619 ppm2      0.810
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1108 and name HG2 ))
 )
      5.000     5.000     0.000 peak  6148 weight  0.10000E+01 volume  0.73300E+00 ppm1      8.620 ppm2      1.273
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
  OR 
   (( segid "    " and resid 1108 and name HG1 ))
 )
      5.000     5.000     0.000 peak  6147 weight  0.10000E+01 volume  0.78200E+00 ppm1      8.618 ppm2      1.385
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )
      5.000     5.000     0.000 peak  6146 weight  0.10000E+01 volume  0.67300E+00 ppm1      8.618 ppm2      1.538
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1108 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6145 weight  0.10000E+01 volume  0.16420E+01 ppm1      8.618 ppm2      1.653
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1108 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6144 weight  0.10000E+01 volume  0.19350E+01 ppm1      8.617 ppm2      1.789
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HB2 ))
  OR 
   (( segid "    " and resid 1130 and name HG2 ))
  OR 
   (( segid "    " and resid 1130 and name HB2 ))
  OR 
   (( segid "    " and resid 1127 and name HB  ))
 )
      5.000     5.000     0.000 peak  6143 weight  0.10000E+01 volume  0.70700E+00 ppm1      8.617 ppm2      1.886
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6141 weight  0.10000E+01 volume  0.57400E+00 ppm1      8.618 ppm2      2.488
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1130 and name HD2 ))
 )
      5.000     5.000     0.000 peak  6139 weight  0.10000E+01 volume  0.45900E+00 ppm1      8.620 ppm2      3.386
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1108 and name HA  ))
 )
      2.700     2.700     0.000 peak  6136 weight  0.10000E+01 volume  0.51420E+01 ppm1      8.618 ppm2      4.259
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1129 and name HA  ))
 )
      5.000     5.000     0.000 peak  6135 weight  0.10000E+01 volume  0.70900E+00 ppm1      8.619 ppm2      4.347
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1127 and name HA  ))
  OR 
   (( segid "    " and resid 1110 and name HA1 ))
 )
      6.000     6.000     0.000 peak  6133 weight  0.10000E+01 volume  0.33300E+00 ppm1      8.618 ppm2      4.684
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HD1 ))
  OR 
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6132 weight  0.10000E+01 volume  0.27100E+00 ppm1      8.618 ppm2      7.104
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HN  ))
  OR 
   (( segid "    " and resid 1129 and name HN  ))
 )
      6.000     6.000     0.000 peak  6129 weight  0.10000E+01 volume  0.28700E+00 ppm1      8.615 ppm2      8.338
 ASSI (
   (( segid "    " and resid 1109 and name HN  ))
 )(
   (( segid "    " and resid 1130 and name HD1 ))
  OR 
   (( segid "    " and resid 1111 and name HD2 ))
 )
      6.000     6.000     0.000 peak  6138 weight  0.10000E+01 volume  0.12700E+00 ppm1      8.621 ppm2      3.630
 ASSI (
   (( segid "    " and resid 1110 and name HN  ))
 )(
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
  OR 
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
  OR 
   (( segid "    " and resid 1125 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6128 weight  0.10000E+01 volume -0.17100E+00 ppm1      8.117 ppm2      0.802
 ASSI (
   (( segid "    " and resid 1110 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HB2 ))
  OR 
   (( segid "    " and resid 1111 and name HB2 ))
  OR 
   (( segid "    " and resid 1108 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6127 weight  0.10000E+01 volume -0.24900E+00 ppm1      8.113 ppm2      1.812
 ASSI (
   (( segid "    " and resid 1110 and name HN  ))
 )(
   (( segid "    " and resid 1111 and name HG2 ))
  OR 
   (( segid "    " and resid 1111 and name HG1 ))
 )
      6.000     6.000     0.000 peak  6126 weight  0.10000E+01 volume -0.17900E+00 ppm1      8.111 ppm2      2.166
 ASSI (
   (( segid "    " and resid 1110 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HB2 ))
  OR 
   (( segid "    " and resid 1111 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6124 weight  0.10000E+01 volume -0.27000E+00 ppm1      8.112 ppm2      2.474
 ASSI (
   (( segid "    " and resid 1110 and name HN  ))
 )(
   (( segid "    " and resid 1111 and name HD2 ))
 )
      5.000     5.000     0.000 peak  6122 weight  0.10000E+01 volume -0.64700E+00 ppm1      8.114 ppm2      3.627
 ASSI (
   (( segid "    " and resid 1110 and name HN  ))
 )(
   (( segid "    " and resid 1155 and name HA1 ))
  OR 
   (( segid "    " and resid 1111 and name HD1 ))
 )
      5.000     5.000     0.000 peak  6121 weight  0.10000E+01 volume -0.10120E+01 ppm1      8.114 ppm2      3.859
 ASSI (
   (( segid "    " and resid 1110 and name HN  ))
 )(
   (( segid "    " and resid 1154 and name HA  ))
  OR 
   (( segid "    " and resid 1108 and name HA  ))
 )
      6.000     6.000     0.000 peak  6119 weight  0.10000E+01 volume -0.25900E+00 ppm1      8.112 ppm2      4.246
 ASSI (
   (( segid "    " and resid 1110 and name HN  ))
 )(
   (( segid "    " and resid 1109 and name HA  ))
 )
      2.700     2.700     0.000 peak  6118 weight  0.10000E+01 volume -0.60000E+01 ppm1      8.111 ppm2      4.514
 ASSI (
   (( segid "    " and resid 1110 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HZ2 ))
 )
      6.000     6.000     0.000 peak  6116 weight  0.10000E+01 volume -0.18900E+00 ppm1      8.117 ppm2      6.514
 ASSI (
   (( segid "    " and resid 1110 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HD1 ))
  OR 
   (( segid "    " and resid 1128 and name HD2 ))
 )
      5.000     5.000     0.000 peak  6115 weight  0.10000E+01 volume -0.44400E+00 ppm1      8.116 ppm2      7.110
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      5.000     5.000     0.000 peak  6111 weight  0.10000E+01 volume  0.11930E+01 ppm1      8.706 ppm2      0.174
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )
      3.300     3.300     0.000 peak  6110 weight  0.10000E+01 volume  0.19200E+01 ppm1      8.701 ppm2      0.418
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HG12))
 )
      3.300     3.300     0.000 peak  6109 weight  0.10000E+01 volume  0.17300E+01 ppm1      8.705 ppm2      0.659
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HG11))
 )
      3.300     3.300     0.000 peak  6108 weight  0.10000E+01 volume  0.17400E+01 ppm1      8.705 ppm2      0.857
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HB  ))
 )
      5.000     5.000     0.000 peak  6107 weight  0.10000E+01 volume  0.86100E+00 ppm1      8.703 ppm2      1.555
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1114 and name HG2 ))
  OR 
   (( segid "    " and resid 1114 and name HG1 ))
 )
      5.000     5.000     0.000 peak  6105 weight  0.10000E+01 volume  0.99900E+00 ppm1      8.705 ppm2      1.959
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1114 and name HD2 ))
 )
      6.000     6.000     0.000 peak  6102 weight  0.10000E+01 volume  0.21000E+00 ppm1      8.705 ppm2      3.620
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1118 and name HA2 ))
  OR 
   (( segid "    " and resid 1117 and name HA  ))
  OR 
   (( segid "    " and resid 1114 and name HD1 ))
 )
      5.000     5.000     0.000 peak  6101 weight  0.10000E+01 volume  0.40100E+00 ppm1      8.707 ppm2      3.795
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1118 and name HA1 ))
  OR 
   (( segid "    " and resid 1115 and name HA  ))
 )
      3.300     3.300     0.000 peak  6100 weight  0.10000E+01 volume  0.17860E+01 ppm1      8.705 ppm2      4.507
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HA  ))
  OR 
   (( segid "    " and resid 1119 and name HA  ))
 )
      6.000     6.000     0.000 peak  6098 weight  0.10000E+01 volume  0.29400E+00 ppm1      8.710 ppm2      4.984
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      5.000     5.000     0.000 peak  6097 weight  0.10000E+01 volume  0.41400E+00 ppm1      8.707 ppm2      6.577
 ASSI (
   (( segid "    " and resid 1115 and name HN  ))
 )(
   (( segid "    " and resid 1161 and name HD2 ))
  OR 
   (( segid "    " and resid 1159 and name HG2 ))
  OR 
   (( segid "    " and resid 1159 and name HG1 ))
  OR 
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6103 weight  0.10000E+01 volume  0.20400E+00 ppm1      8.704 ppm2      2.450
 ASSI (
   (( segid "    " and resid 1116 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      5.000     5.000     0.000 peak  6092 weight  0.10000E+01 volume  0.67800E+00 ppm1      8.171 ppm2      0.169
 ASSI (
   (( segid "    " and resid 1116 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HG12))
 )
      6.000     6.000     0.000 peak  6088 weight  0.10000E+01 volume  0.29900E+00 ppm1      8.170 ppm2      0.664
 ASSI (
   (( segid "    " and resid 1116 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HG11))
 )
      5.000     5.000     0.000 peak  6089 weight  0.10000E+01 volume  0.42000E+00 ppm1      8.172 ppm2      0.839
 ASSI (
   (( segid "    " and resid 1116 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HB  ))
 )
      3.300     3.300     0.000 peak  6087 weight  0.10000E+01 volume  0.29660E+01 ppm1      8.172 ppm2      1.547
 ASSI (
   (( segid "    " and resid 1116 and name HN  ))
 )(
   (( segid "    " and resid 1116 and name HB2 ))
  OR 
   (( segid "    " and resid 1116 and name HB1 ))
 )
      2.700     2.700     0.000 peak  6086 weight  0.10000E+01 volume  0.53400E+01 ppm1      8.167 ppm2      2.482
 ASSI (
   (( segid "    " and resid 1116 and name HN  ))
 )(
   (( segid "    " and resid 1116 and name HA  ))
 )
      3.300     3.300     0.000 peak  6083 weight  0.10000E+01 volume  0.20490E+01 ppm1      8.171 ppm2      4.347
 ASSI (
   (( segid "    " and resid 1116 and name HN  ))
 )(
   (( segid "    " and resid 1118 and name HN  ))
 )
      6.000     6.000     0.000 peak  6052 weight  0.10000E+01 volume  0.14700E+00 ppm1      8.168 ppm2      7.236
 ASSI (
   (( segid "    " and resid 1117 and name HN  ))
 )(
   (( segid "    " and resid 1117 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6081 weight  0.10000E+01 volume  0.69100E+00 ppm1      8.869 ppm2      1.255
 ASSI (
   (( segid "    " and resid 1117 and name HN  ))
 )(
   (( segid "    " and resid 1117 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6080 weight  0.10000E+01 volume  0.49700E+00 ppm1      8.870 ppm2      2.082
 ASSI (
   (( segid "    " and resid 1117 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HB2 ))
  OR 
   (( segid "    " and resid 1116 and name HB2 ))
  OR 
   (( segid "    " and resid 1116 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6079 weight  0.10000E+01 volume  0.16750E+01 ppm1      8.869 ppm2      2.482
 ASSI (
   (( segid "    " and resid 1117 and name HN  ))
 )(
   (( segid "    " and resid 1117 and name HA  ))
 )
      2.700     2.700     0.000 peak  6078 weight  0.10000E+01 volume  0.39430E+01 ppm1      8.866 ppm2      3.761
 ASSI (
   (( segid "    " and resid 1117 and name HN  ))
 )(
   (( segid "    " and resid 1118 and name HA1 ))
  OR 
   (( segid "    " and resid 1115 and name HA  ))
 )
      5.000     5.000     0.000 peak  6076 weight  0.10000E+01 volume  0.48400E+00 ppm1      8.871 ppm2      4.497
 ASSI (
   (( segid "    " and resid 1117 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1139 and name HE22))
  OR 
   (( segid "    " and resid 1117 and name HD22))
 )
      5.000     5.000     0.000 peak  6074 weight  0.10000E+01 volume  0.42400E+00 ppm1      8.870 ppm2      6.637
 ASSI (
   (( segid "    " and resid 1117 and name HN  ))
 )(
   (( segid "    " and resid 1117 and name HD21))
 )
      5.000     5.000     0.000 peak  6073 weight  0.10000E+01 volume  0.40600E+00 ppm1      8.870 ppm2      7.411
 ASSI (
   (( segid "    " and resid 1117 and name HD21))
 )(
   (( segid "    " and resid 1117 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9195 weight  0.10000E+01 volume  0.50800E+00 ppm1      7.409 ppm2      1.255
 ASSI (
   (( segid "    " and resid 1117 and name HD21))
 )(
   (( segid "    " and resid 1117 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9194 weight  0.10000E+01 volume  0.59500E+00 ppm1      7.409 ppm2      2.081
 ASSI (
   (( segid "    " and resid 1117 and name HD21))
 )(
   (( segid "    " and resid 1164 and name HA  ))
  OR 
   (( segid "    " and resid 1142 and name HA  ))
  OR 
   (( segid "    " and resid 1116 and name HA  ))
 )
      6.000     6.000     0.000 peak  9192 weight  0.10000E+01 volume  0.82000E-01 ppm1      7.409 ppm2      4.349
 ASSI (
   (( segid "    " and resid 1117 and name HD21))
 )(
   (( segid "    " and resid 1142 and name HE2 ))
  OR 
   (( segid "    " and resid 1142 and name HE1 ))
 )
      5.000     5.000     0.000 peak  9189 weight  0.10000E+01 volume  0.45700E+00 ppm1      7.410 ppm2      6.181
 ASSI (
   (( segid "    " and resid 1117 and name HD22))
 )(
   (( segid "    " and resid 1117 and name HB2 ))
 )
      5.000     5.000     0.000 peak  9196 weight  0.10000E+01 volume  0.48400E+00 ppm1      6.631 ppm2      1.253
 ASSI (
   (( segid "    " and resid 1117 and name HD22))
 )(
   (( segid "    " and resid 1117 and name HB1 ))
 )
      5.000     5.000     0.000 peak  9197 weight  0.10000E+01 volume  0.55700E+00 ppm1      6.632 ppm2      2.085
 ASSI (
   (( segid "    " and resid 1117 and name HD22))
 )(
   (( segid "    " and resid 1116 and name HA  ))
 )
      6.000     6.000     0.000 peak  9199 weight  0.10000E+01 volume  0.12600E+00 ppm1      6.632 ppm2      4.336
 ASSI (
   (( segid "    " and resid 1117 and name HD22))
 )(
   (( segid "    " and resid 1142 and name HE2 ))
 )
      6.000     6.000     0.000 peak  9188 weight  0.10000E+01 volume  0.32900E+00 ppm1      6.627 ppm2      6.185
 ASSI (
   (( segid "    " and resid 1117 and name HD22))
 )(
   (( segid "    " and resid 1117 and name HN  ))
 )
      6.000     6.000     0.000 peak  9201 weight  0.10000E+01 volume  0.20400E+00 ppm1      6.631 ppm2      8.869
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1138 and name HA  ))
 )
      5.000     5.000     0.000 peak  5277 weight  0.10000E+01 volume -0.48800E+00 ppm1      7.235 ppm2      5.124
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      5.000     5.000     0.000 peak  6070 weight  0.10000E+01 volume -0.88600E+00 ppm1      7.231 ppm2      0.176
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )
      6.000     6.000     0.000 peak  6069 weight  0.10000E+01 volume -0.35300E+00 ppm1      7.234 ppm2      0.417
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HG12))
 )
      5.000     5.000     0.000 peak  6068 weight  0.10000E+01 volume -0.61900E+00 ppm1      7.232 ppm2      0.653
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HG11))
 )
      5.000     5.000     0.000 peak  6067 weight  0.10000E+01 volume -0.93300E+00 ppm1      7.232 ppm2      0.854
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1139 and name HB2 ))
  OR 
   (( segid "    " and resid 1115 and name HB  ))
 )
      6.000     6.000     0.000 peak  6065 weight  0.10000E+01 volume -0.27000E+00 ppm1      7.232 ppm2      1.567
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1139 and name HG2 ))
  OR 
   (( segid "    " and resid 1117 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6063 weight  0.10000E+01 volume -0.29100E+00 ppm1      7.234 ppm2      2.147
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HB2 ))
  OR 
   (( segid "    " and resid 1139 and name HG1 ))
  OR 
   (( segid "    " and resid 1137 and name HG2 ))
  OR 
   (( segid "    " and resid 1137 and name HG1 ))
  OR 
   (( segid "    " and resid 1113 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6062 weight  0.10000E+01 volume -0.20600E+00 ppm1      7.233 ppm2      2.271
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HB2 ))
  OR 
   (( segid "    " and resid 1138 and name HB2 ))
  OR 
   (( segid "    " and resid 1119 and name HB2 ))
  OR 
   (( segid "    " and resid 1116 and name HB2 ))
  OR 
   (( segid "    " and resid 1116 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6061 weight  0.10000E+01 volume -0.46900E+00 ppm1      7.234 ppm2      2.506
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1117 and name HA  ))
 )
      3.300     3.300     0.000 peak  4346 weight  0.10000E+01 volume -0.27580E+01 ppm1      7.232 ppm2      3.767
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1116 and name HA  ))
 )
      5.000     5.000     0.000 peak  6057 weight  0.10000E+01 volume -0.88000E+00 ppm1      7.234 ppm2      4.347
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HA  ))
  OR 
   (( segid "    " and resid 1119 and name HA  ))
 )
      6.000     6.000     0.000 peak  6055 weight  0.10000E+01 volume -0.20800E+00 ppm1      7.234 ppm2      4.981
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1117 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6064 weight  0.10000E+01 volume -0.34600E+00 ppm1      7.234 ppm2      2.078
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1117 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6066 weight  0.10000E+01 volume -0.38600E+00 ppm1      7.233 ppm2      1.250
 ASSI (
   (( segid "    " and resid 1118 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
  OR 
   (( segid "    " and resid 1139 and name HE22))
  OR 
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
  OR 
   (( segid "    " and resid 1117 and name HD22))
 )
      6.000     6.000     0.000 peak  6054 weight  0.10000E+01 volume -0.25800E+00 ppm1      7.234 ppm2      6.645
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      6.000     6.000     0.000 peak  6046 weight  0.10000E+01 volume  0.16100E+00 ppm1      8.543 ppm2      0.054
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      5.000     5.000     0.000 peak  6045 weight  0.10000E+01 volume  0.87000E+00 ppm1      8.541 ppm2      0.172
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )
      6.000     6.000     0.000 peak  6044 weight  0.10000E+01 volume  0.15800E+00 ppm1      8.541 ppm2      0.420
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      6.000     6.000     0.000 peak  6042 weight  0.10000E+01 volume  0.13700E+00 ppm1      8.541 ppm2      0.952
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HB2 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
  OR 
   (( segid "    " and resid 1139 and name HB2 ))
  OR 
   (( segid "    " and resid 1115 and name HB  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )
      6.000     6.000     0.000 peak  6041 weight  0.10000E+01 volume  0.17800E+00 ppm1      8.541 ppm2      1.586
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1139 and name HG2 ))
  OR 
   (( segid "    " and resid 1114 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6038 weight  0.10000E+01 volume  0.53500E+00 ppm1      8.542 ppm2      2.180
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1139 and name HG1 ))
  OR 
   (( segid "    " and resid 1137 and name HG2 ))
  OR 
   (( segid "    " and resid 1137 and name HG1 ))
  OR 
   (( segid "    " and resid 1114 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6037 weight  0.10000E+01 volume  0.60800E+00 ppm1      8.541 ppm2      2.251
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6036 weight  0.10000E+01 volume  0.39000E+00 ppm1      8.542 ppm2      2.417
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1138 and name HB2 ))
  OR 
   (( segid "    " and resid 1119 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6035 weight  0.10000E+01 volume  0.13850E+01 ppm1      8.541 ppm2      2.529
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1119 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6034 weight  0.10000E+01 volume  0.10450E+01 ppm1      8.544 ppm2      2.642
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1118 and name HA2 ))
 )
      3.300     3.300     0.000 peak  6033 weight  0.10000E+01 volume  0.28800E+01 ppm1      8.544 ppm2      3.825
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1160 and name HD1 ))
  OR 
   (( segid "    " and resid 1148 and name HA  ))
 )
      6.000     6.000     0.000 peak  6032 weight  0.10000E+01 volume  0.36700E+00 ppm1      8.543 ppm2      3.936
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1118 and name HA1 ))
 )
      3.300     3.300     0.000 peak  6031 weight  0.10000E+01 volume  0.27360E+01 ppm1      8.542 ppm2      4.531
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HA  ))
  OR 
   (( segid "    " and resid 1119 and name HA  ))
 )
      3.300     3.300     0.000 peak  6029 weight  0.10000E+01 volume  0.20130E+01 ppm1      8.544 ppm2      4.980
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      5.000     5.000     0.000 peak  6026 weight  0.10000E+01 volume  0.51900E+00 ppm1      8.544 ppm2      6.583
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1160 and name HG1 ))
  OR 
   (( segid "    " and resid 1139 and name HB1 ))
  OR 
   (( segid "    " and resid 1137 and name HB1 ))
  OR 
   (( segid "    " and resid 1114 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6039 weight  0.10000E+01 volume  0.28500E+00 ppm1      8.542 ppm2      1.888
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1160 and name HG2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
  OR 
   (( segid "    " and resid 1137 and name HB2 ))
  OR 
   (( segid "    " and resid 1135 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6040 weight  0.10000E+01 volume  0.32700E+00 ppm1      8.541 ppm2      1.774
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HG11))
 )
      6.000     6.000     0.000 peak  6043 weight  0.10000E+01 volume  0.18700E+00 ppm1      8.543 ppm2      0.868
 ASSI (
   (( segid "    " and resid 1119 and name HN  ))
 )(
   (( segid "    " and resid 1120 and name HA  ))
 )
      5.000     5.000     0.000 peak  6030 weight  0.10000E+01 volume  0.44100E+00 ppm1      8.548 ppm2      4.725
 ASSI (
   (( segid "    " and resid 1120 and name HN  ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      3.300     3.300     0.000 peak  6022 weight  0.10000E+01 volume  0.26800E+01 ppm1      8.484 ppm2      0.078
 ASSI (
   (( segid "    " and resid 1120 and name HN  ))
 )(
   (( segid "    " and resid 1120 and name HB  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )
      5.000     5.000     0.000 peak  6018 weight  0.10000E+01 volume  0.14480E+01 ppm1      8.486 ppm2      1.501
 ASSI (
   (( segid "    " and resid 1120 and name HN  ))
 )(
   (( segid "    " and resid 1119 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6017 weight  0.10000E+01 volume  0.16340E+01 ppm1      8.488 ppm2      2.532
 ASSI (
   (( segid "    " and resid 1120 and name HN  ))
 )(
   (( segid "    " and resid 1119 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6016 weight  0.10000E+01 volume  0.21990E+01 ppm1      8.486 ppm2      2.639
 ASSI (
   (( segid "    " and resid 1120 and name HN  ))
 )(
   (( segid "    " and resid 1120 and name HA  ))
 )
      5.000     5.000     0.000 peak  6579 weight  0.10000E+01 volume  0.95100E+00 ppm1      8.492 ppm2      4.724
 ASSI (
   (( segid "    " and resid 1120 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HA  ))
  OR 
   (( segid "    " and resid 1119 and name HA  ))
 )
      2.700     2.700     0.000 peak  6015 weight  0.10000E+01 volume  0.62810E+01 ppm1      8.486 ppm2      4.988
 ASSI (
   (( segid "    " and resid 1120 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      6.000     6.000     0.000 peak  6013 weight  0.10000E+01 volume  0.22300E+00 ppm1      8.488 ppm2      6.580
 ASSI (
   (( segid "    " and resid 1120 and name HN  ))
 )(
   (( segid "    " and resid 1137 and name HN  ))
  OR 
   (( segid "    " and resid 1115 and name HN  ))
 )
      6.000     6.000     0.000 peak  6023 weight  0.10000E+01 volume  0.26400E+00 ppm1      8.485 ppm2      8.738
 ASSI (
   (( segid "    " and resid 1121 and name HN  ))
 )(
   (( segid "    " and resid 1120 and name HB  ))
 )
      3.300     3.300     0.000 peak  6012 weight  0.10000E+01 volume  0.19460E+01 ppm1      8.256 ppm2      1.488
 ASSI (
   (( segid "    " and resid 1121 and name HN  ))
 )(
   (( segid "    " and resid 1134 and name HA  ))
  OR 
   (( segid "    " and resid 1121 and name HB  ))
 )
      5.000     5.000     0.000 peak  6008 weight  0.10000E+01 volume  0.64300E+00 ppm1      8.255 ppm2      4.398
 ASSI (
   (( segid "    " and resid 1121 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HA  ))
  OR 
   (( segid "    " and resid 1119 and name HA  ))
 )
      5.000     5.000     0.000 peak  6007 weight  0.10000E+01 volume  0.83800E+00 ppm1      8.257 ppm2      4.976
 ASSI (
   (( segid "    " and resid 1122 and name HN  ))
 )(
   (( segid "    " and resid 1134 and name HA  ))
  OR 
   (( segid "    " and resid 1121 and name HB  ))
 )
      5.000     5.000     0.000 peak  5996 weight  0.10000E+01 volume  0.62900E+00 ppm1      7.058 ppm2      4.405
 ASSI (
   (( segid "    " and resid 1122 and name HN  ))
 )(
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )
      6.000     6.000     0.000 peak  6004 weight  0.10000E+01 volume  0.33800E+00 ppm1      7.057 ppm2      0.564
 ASSI (
   (( segid "    " and resid 1122 and name HN  ))
 )(
   (( segid "    " and resid 1120 and name HG12))
 )
      5.000     5.000     0.000 peak  6003 weight  0.10000E+01 volume  0.76900E+00 ppm1      7.057 ppm2      0.741
 ASSI (
   (( segid "    " and resid 1122 and name HN  ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      5.000     5.000     0.000 peak  6002 weight  0.10000E+01 volume  0.88600E+00 ppm1      7.057 ppm2      0.953
 ASSI (
   (( segid "    " and resid 1122 and name HN  ))
 )(
   (( segid "    " and resid 1120 and name HG11))
 )
      5.000     5.000     0.000 peak  6000 weight  0.10000E+01 volume  0.14570E+01 ppm1      7.055 ppm2      1.404
 ASSI (
   (( segid "    " and resid 1122 and name HN  ))
 )(
   (( segid "    " and resid 1120 and name HB  ))
 )
      5.000     5.000     0.000 peak  6001 weight  0.10000E+01 volume  0.15250E+01 ppm1      7.055 ppm2      1.497
 ASSI (
   (( segid "    " and resid 1122 and name HN  ))
 )(
   (( segid "    " and resid 1122 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5999 weight  0.10000E+01 volume  0.95700E+00 ppm1      7.056 ppm2      3.811
 ASSI (
   (( segid "    " and resid 1122 and name HN  ))
 )(
   (( segid "    " and resid 1122 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5998 weight  0.10000E+01 volume  0.87800E+00 ppm1      7.056 ppm2      3.958
 ASSI (
   (( segid "    " and resid 1122 and name HN  ))
 )(
   (( segid "    " and resid 1123 and name HA  ))
  OR 
   (( segid "    " and resid 1120 and name HA  ))
 )
      5.000     5.000     0.000 peak  5994 weight  0.10000E+01 volume  0.65000E+00 ppm1      7.057 ppm2      4.731
 ASSI (
   (( segid "    " and resid 1122 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HA  ))
  OR 
   (( segid "    " and resid 1119 and name HA  ))
 )
      6.000     6.000     0.000 peak  5993 weight  0.10000E+01 volume  0.19800E+00 ppm1      7.057 ppm2      4.976
 ASSI (
   (( segid "    " and resid 1123 and name HN  ))
 )(
   (( segid "    " and resid 1124 and name HD2 ))
  OR 
   (( segid "    " and resid 1123 and name HB2 ))
  OR 
   (( segid "    " and resid 1123 and name HB1 ))
 )
      2.700     2.700     0.000 peak  5989 weight  0.10000E+01 volume  0.90890E+01 ppm1      8.299 ppm2      3.024
 ASSI (
   (( segid "    " and resid 1123 and name HN  ))
 )(
   (( segid "    " and resid 1122 and name HB2 ))
 )
      3.300     3.300     0.000 peak  5987 weight  0.10000E+01 volume  0.20020E+01 ppm1      8.300 ppm2      3.811
 ASSI (
   (( segid "    " and resid 1123 and name HN  ))
 )(
   (( segid "    " and resid 1122 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5986 weight  0.10000E+01 volume  0.26830E+01 ppm1      8.299 ppm2      3.953
 ASSI (
   (( segid "    " and resid 1123 and name HN  ))
 )(
   (( segid "    " and resid 1120 and name HN  ))
 )
      6.000     6.000     0.000 peak  5497 weight  0.10000E+01 volume  0.11800E+00 ppm1      8.302 ppm2      8.536
 ASSI (
   (( segid "    " and resid 1123 and name HN  ))
 )(
   (( segid "    " and resid 1124 and name HD1 ))
 )
      5.000     5.000     0.000 peak  5988 weight  0.10000E+01 volume  0.61900E+00 ppm1      8.302 ppm2      3.712
 ASSI (
   (( segid "    " and resid 1123 and name HN  ))
 )(
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
 )
      6.000     6.000     0.000 peak  5990 weight  0.10000E+01 volume  0.27800E+00 ppm1      8.294 ppm2      0.854
 ASSI (
   (( segid "    " and resid 1125 and name HN  ))
 )(
   (( segid "    " and resid 1126 and name HA  ))
 )
      5.000     5.000     0.000 peak  5969 weight  0.10000E+01 volume  0.43900E+00 ppm1      7.726 ppm2      4.371
 ASSI (
   (( segid "    " and resid 1125 and name HN  ))
 )(
   (( segid "    " and resid 1120 and name HD13))
  OR 
   (( segid "    " and resid 1120 and name HD12))
  OR 
   (( segid "    " and resid 1120 and name HD11))
 )
      5.000     5.000     0.000 peak  5976 weight  0.10000E+01 volume  0.50100E+00 ppm1      7.723 ppm2      0.488
 ASSI (
   (( segid "    " and resid 1125 and name HN  ))
 )(
   (( segid "    " and resid 1125 and name HD13))
  OR 
   (( segid "    " and resid 1125 and name HD12))
  OR 
   (( segid "    " and resid 1125 and name HD11))
 )
      5.000     5.000     0.000 peak  5975 weight  0.10000E+01 volume  0.96900E+00 ppm1      7.722 ppm2      0.666
 ASSI (
   (( segid "    " and resid 1125 and name HN  ))
 )(
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HD21))
  OR 
   (( segid "    " and resid 1125 and name HB2 ))
 )
      3.300     3.300     0.000 peak  5974 weight  0.10000E+01 volume  0.26030E+01 ppm1      7.720 ppm2      0.833
 ASSI (
   (( segid "    " and resid 1125 and name HN  ))
 )(
   (( segid "    " and resid 1125 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5973 weight  0.10000E+01 volume  0.10690E+01 ppm1      7.721 ppm2      1.254
 ASSI (
   (( segid "    " and resid 1125 and name HN  ))
 )(
   (( segid "    " and resid 1125 and name HG  ))
  OR 
   (( segid "    " and resid 1120 and name HB  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )
      5.000     5.000     0.000 peak  5972 weight  0.10000E+01 volume  0.16380E+01 ppm1      7.723 ppm2      1.549
 ASSI (
   (( segid "    " and resid 1125 and name HN  ))
 )(
   (( segid "    " and resid 1124 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG1 ))
  OR 
   (( segid "    " and resid 1124 and name HB2 ))
  OR 
   (( segid "    " and resid 1111 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5971 weight  0.10000E+01 volume  0.88900E+00 ppm1      7.722 ppm2      1.874
 ASSI (
   (( segid "    " and resid 1125 and name HN  ))
 )(
   (( segid "    " and resid 1124 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5970 weight  0.10000E+01 volume  0.69700E+00 ppm1      7.722 ppm2      2.083
 ASSI (
   (( segid "    " and resid 1125 and name HN  ))
 )(
   (( segid "    " and resid 1124 and name HA  ))
 )
      2.700     2.700     0.000 peak  5968 weight  0.10000E+01 volume  0.49050E+01 ppm1      7.721 ppm2      4.248
 ASSI (
   (( segid "    " and resid 1125 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )
      5.000     5.000     0.000 peak  5964 weight  0.10000E+01 volume  0.72800E+00 ppm1      7.721 ppm2      6.809
 ASSI (
   (( segid "    " and resid 1125 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
  OR 
   (( segid "    " and resid 1122 and name HN  ))
 )
      6.000     6.000     0.000 peak  5965 weight  0.10000E+01 volume  0.19400E+00 ppm1      7.722 ppm2      7.103
 ASSI (
   (( segid "    " and resid 1126 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )
      6.000     6.000     0.000 peak  5953 weight  0.10000E+01 volume  0.16600E+00 ppm1      8.331 ppm2      6.804
 ASSI (
   (( segid "    " and resid 1126 and name HN  ))
 )(
   (( segid "    " and resid 1127 and name HB  ))
  OR 
   (( segid "    " and resid 1124 and name HG2 ))
  OR 
   (( segid "    " and resid 1124 and name HG1 ))
  OR 
   (( segid "    " and resid 1124 and name HB2 ))
  OR 
   (( segid "    " and resid 1111 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5958 weight  0.10000E+01 volume  0.41500E+00 ppm1      8.330 ppm2      1.856
 ASSI (
   (( segid "    " and resid 1126 and name HN  ))
 )(
   (( segid "    " and resid 1125 and name HD13))
  OR 
   (( segid "    " and resid 1125 and name HD12))
  OR 
   (( segid "    " and resid 1125 and name HD11))
 )
      5.000     5.000     0.000 peak  5962 weight  0.10000E+01 volume  0.71300E+00 ppm1      8.333 ppm2      0.664
 ASSI (
   (( segid "    " and resid 1126 and name HN  ))
 )(
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
  OR 
   (( segid "    " and resid 1125 and name HD23))
  OR 
   (( segid "    " and resid 1125 and name HD22))
  OR 
   (( segid "    " and resid 1125 and name HB2 ))
 )
      2.700     2.700     0.000 peak  5963 weight  0.10000E+01 volume  0.36080E+01 ppm1      8.332 ppm2      0.832
 ASSI (
   (( segid "    " and resid 1126 and name HN  ))
 )(
   (( segid "    " and resid 1125 and name HG  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )
      5.000     5.000     0.000 peak  5960 weight  0.10000E+01 volume  0.41300E+00 ppm1      8.333 ppm2      1.540
 ASSI (
   (( segid "    " and resid 1126 and name HN  ))
 )(
   (( segid "    " and resid 1111 and name HG2 ))
  OR 
   (( segid "    " and resid 1111 and name HG1 ))
 )
      6.000     6.000     0.000 peak  5959 weight  0.10000E+01 volume  0.11500E+00 ppm1      8.332 ppm2      2.167
 ASSI (
   (( segid "    " and resid 1126 and name HN  ))
 )(
   (( segid "    " and resid 1126 and name HB2 ))
  OR 
   (( segid "    " and resid 1126 and name HB1 ))
 )
      2.700     2.700     0.000 peak  5957 weight  0.10000E+01 volume  0.33390E+01 ppm1      8.332 ppm2      3.881
 ASSI (
   (( segid "    " and resid 1126 and name HN  ))
 )(
   (( segid "    " and resid 1126 and name HA  ))
 )
      3.300     3.300     0.000 peak  5956 weight  0.10000E+01 volume  0.17450E+01 ppm1      8.331 ppm2      4.373
 ASSI (
   (( segid "    " and resid 1126 and name HN  ))
 )(
   (( segid "    " and resid 1125 and name HA  ))
 )
      2.700     2.700     0.000 peak  5954 weight  0.10000E+01 volume  0.40910E+01 ppm1      8.333 ppm2      4.572
 ASSI (
   (( segid "    " and resid 1126 and name HN  ))
 )(
   (( segid "    " and resid 1127 and name HA  ))
  OR 
   (( segid "    " and resid 1110 and name HA1 ))
 )
      5.000     5.000     0.000 peak  5955 weight  0.10000E+01 volume  0.61100E+00 ppm1      8.332 ppm2      4.683
 ASSI (
   (( segid "    " and resid 1126 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5952 weight  0.10000E+01 volume  0.15700E+00 ppm1      8.332 ppm2      7.108
 ASSI (
   (( segid "    " and resid 1127 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HA  ))
  OR 
   (( segid "    " and resid 1125 and name HA  ))
 )
      5.000     5.000     0.000 peak  5941 weight  0.10000E+01 volume  0.12060E+01 ppm1      6.972 ppm2      4.571
 ASSI (
   (( segid "    " and resid 1127 and name HN  ))
 )(
   (( segid "    " and resid 1125 and name HD13))
  OR 
   (( segid "    " and resid 1125 and name HD12))
  OR 
   (( segid "    " and resid 1125 and name HD11))
 )
      5.000     5.000     0.000 peak  5949 weight  0.10000E+01 volume  0.78600E+00 ppm1      6.969 ppm2      0.663
 ASSI (
   (( segid "    " and resid 1127 and name HN  ))
 )(
   (( segid "    " and resid 1125 and name HG  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
  OR 
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5945 weight  0.10000E+01 volume  0.34900E+00 ppm1      6.968 ppm2      1.542
 ASSI (
   (( segid "    " and resid 1127 and name HN  ))
 )(
   (( segid "    " and resid 1127 and name HB  ))
 )
      3.300     3.300     0.000 peak  5944 weight  0.10000E+01 volume  0.20900E+01 ppm1      6.969 ppm2      1.860
 ASSI (
   (( segid "    " and resid 1127 and name HN  ))
 )(
   (( segid "    " and resid 1126 and name HB2 ))
  OR 
   (( segid "    " and resid 1126 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5943 weight  0.10000E+01 volume  0.18120E+01 ppm1      6.969 ppm2      3.882
 ASSI (
   (( segid "    " and resid 1128 and name HN  ))
 )(
   (( segid "    " and resid 1130 and name HG1 ))
  OR 
   (( segid "    " and resid 1109 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5930 weight  0.10000E+01 volume  0.31900E+00 ppm1      8.940 ppm2      2.033
 ASSI (
   (( segid "    " and resid 1128 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HA  ))
  OR 
   (( segid "    " and resid 1109 and name HA  ))
 )
      5.000     5.000     0.000 peak  5926 weight  0.10000E+01 volume  0.11430E+01 ppm1      8.944 ppm2      4.564
 ASSI (
   (( segid "    " and resid 1128 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      5.000     5.000     0.000 peak  5921 weight  0.10000E+01 volume  0.15520E+01 ppm1      8.944 ppm2      7.108
 ASSI (
   (( segid "    " and resid 1128 and name HN  ))
 )(
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
  OR 
   (( segid "    " and resid 1108 and name HG1 ))
 )
      6.000     6.000     0.000 peak  5934 weight  0.10000E+01 volume  0.17100E+00 ppm1      8.942 ppm2      1.381
 ASSI (
   (( segid "    " and resid 1128 and name HN  ))
 )(
   (( segid "    " and resid 1125 and name HG  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
  OR 
   (( segid "    " and resid 1108 and name HD2 ))
  OR 
   (( segid "    " and resid 1108 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5933 weight  0.10000E+01 volume  0.24800E+00 ppm1      8.942 ppm2      1.531
 ASSI (
   (( segid "    " and resid 1128 and name HN  ))
 )(
   (( segid "    " and resid 1108 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5932 weight  0.10000E+01 volume  0.22700E+00 ppm1      8.942 ppm2      1.636
 ASSI (
   (( segid "    " and resid 1128 and name HN  ))
 )(
   (( segid "    " and resid 1127 and name HB  ))
  OR 
   (( segid "    " and resid 1111 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5931 weight  0.10000E+01 volume  0.93400E+00 ppm1      8.944 ppm2      1.858
 ASSI (
   (( segid "    " and resid 1128 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5929 weight  0.10000E+01 volume  0.81700E+00 ppm1      8.943 ppm2      2.486
 ASSI (
   (( segid "    " and resid 1128 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5928 weight  0.10000E+01 volume  0.64400E+00 ppm1      8.942 ppm2      2.938
 ASSI (
   (( segid "    " and resid 1128 and name HN  ))
 )(
   (( segid "    " and resid 1127 and name HA  ))
 )
      2.700     2.700     0.000 peak  5927 weight  0.10000E+01 volume  0.32720E+01 ppm1      8.939 ppm2      4.706
 ASSI (
   (( segid "    " and resid 1128 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HZ2 ))
 )
      6.000     6.000     0.000 peak  5924 weight  0.10000E+01 volume  0.20600E+00 ppm1      8.940 ppm2      6.519
 ASSI (
   (( segid "    " and resid 1128 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )
      6.000     6.000     0.000 peak  5923 weight  0.10000E+01 volume  0.22200E+00 ppm1      8.942 ppm2      6.811
 ASSI (
   (( segid "    " and resid 1129 and name HN  ))
 )(
   (( segid "    " and resid 1132 and name HB2 ))
  OR 
   (( segid "    " and resid 1130 and name HA  ))
  OR 
   (( segid "    " and resid 1110 and name HA2 ))
 )
      6.000     6.000     0.000 peak  5909 weight  0.10000E+01 volume  0.33300E+00 ppm1      8.324 ppm2      3.991
 ASSI (
   (( segid "    " and resid 1129 and name HN  ))
 )(
   (( segid "    " and resid 1109 and name HN  ))
 )
      6.000     6.000     0.000 peak  5903 weight  0.10000E+01 volume  0.26700E+00 ppm1      8.325 ppm2      8.588
 ASSI (
   (( segid "    " and resid 1129 and name HN  ))
 )(
   (( segid "    " and resid 1130 and name HD1 ))
 )
      5.000     5.000     0.000 peak  5910 weight  0.10000E+01 volume  0.51900E+00 ppm1      8.324 ppm2      3.633
 ASSI (
   (( segid "    " and resid 1129 and name HN  ))
 )(
   (( segid "    " and resid 1127 and name HG23))
  OR 
   (( segid "    " and resid 1127 and name HG22))
  OR 
   (( segid "    " and resid 1127 and name HG21))
  OR 
   (( segid "    " and resid 1127 and name HG13))
  OR 
   (( segid "    " and resid 1127 and name HG12))
  OR 
   (( segid "    " and resid 1127 and name HG11))
  OR 
   (( segid "    " and resid 1125 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5918 weight  0.10000E+01 volume  0.42100E+00 ppm1      8.324 ppm2      0.801
 ASSI (
   (( segid "    " and resid 1129 and name HN  ))
 )(
   (( segid "    " and resid 1125 and name HD13))
  OR 
   (( segid "    " and resid 1125 and name HD12))
  OR 
   (( segid "    " and resid 1125 and name HD11))
 )
      6.000     6.000     0.000 peak  5919 weight  0.10000E+01 volume  0.24000E+00 ppm1      8.325 ppm2      0.663
 ASSI (
   (( segid "    " and resid 1129 and name HN  ))
 )(
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
 )
      2.700     2.700     0.000 peak  5916 weight  0.10000E+01 volume  0.58330E+01 ppm1      8.324 ppm2      1.365
 ASSI (
   (( segid "    " and resid 1129 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5913 weight  0.10000E+01 volume  0.49200E+00 ppm1      8.325 ppm2      2.482
 ASSI (
   (( segid "    " and resid 1129 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5912 weight  0.10000E+01 volume  0.84300E+00 ppm1      8.326 ppm2      2.935
 ASSI (
   (( segid "    " and resid 1129 and name HN  ))
 )(
   (( segid "    " and resid 1130 and name HD2 ))
 )
      6.000     6.000     0.000 peak  5911 weight  0.10000E+01 volume  0.26000E+00 ppm1      8.325 ppm2      3.373
 ASSI (
   (( segid "    " and resid 1129 and name HN  ))
 )(
   (( segid "    " and resid 1132 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5908 weight  0.10000E+01 volume  0.26000E+00 ppm1      8.325 ppm2      4.190
 ASSI (
   (( segid "    " and resid 1129 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HA  ))
 )
      2.700     2.700     0.000 peak  5906 weight  0.10000E+01 volume  0.48870E+01 ppm1      8.325 ppm2      4.563
 ASSI (
   (( segid "    " and resid 1129 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      5.000     5.000     0.000 peak  5904 weight  0.10000E+01 volume  0.54600E+00 ppm1      8.325 ppm2      7.108
 ASSI (
   (( segid "    " and resid 1131 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5901 weight  0.10000E+01 volume  0.31800E+00 ppm1      8.990 ppm2      0.909
 ASSI (
   (( segid "    " and resid 1131 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )
      5.000     5.000     0.000 peak  5900 weight  0.10000E+01 volume  0.11320E+01 ppm1      8.990 ppm2      1.032
 ASSI (
   (( segid "    " and resid 1131 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HB2 ))
  OR 
   (( segid "    " and resid 1153 and name HB1 ))
  OR 
   (( segid "    " and resid 1108 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5898 weight  0.10000E+01 volume  0.19800E+00 ppm1      8.988 ppm2      1.716
 ASSI (
   (( segid "    " and resid 1131 and name HN  ))
 )(
   (( segid "    " and resid 1130 and name HG2 ))
  OR 
   (( segid "    " and resid 1130 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5897 weight  0.10000E+01 volume  0.92500E+00 ppm1      8.988 ppm2      1.876
 ASSI (
   (( segid "    " and resid 1131 and name HN  ))
 )(
   (( segid "    " and resid 1130 and name HG1 ))
  OR 
   (( segid "    " and resid 1109 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5896 weight  0.10000E+01 volume  0.24200E+00 ppm1      8.988 ppm2      2.014
 ASSI (
   (( segid "    " and resid 1131 and name HN  ))
 )(
   (( segid "    " and resid 1131 and name HA  ))
 )
      3.300     3.300     0.000 peak  5894 weight  0.10000E+01 volume  0.31890E+01 ppm1      8.987 ppm2      3.789
 ASSI (
   (( segid "    " and resid 1131 and name HN  ))
 )(
   (( segid "    " and resid 1130 and name HA  ))
 )
      2.700     2.700     0.000 peak  5893 weight  0.10000E+01 volume  0.34910E+01 ppm1      8.988 ppm2      3.944
 ASSI (
   (( segid "    " and resid 1131 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HA  ))
  OR 
   (( segid "    " and resid 1132 and name HA  ))
  OR 
   (( segid "    " and resid 1109 and name HA  ))
 )
      5.000     5.000     0.000 peak  5892 weight  0.10000E+01 volume  0.53600E+00 ppm1      8.991 ppm2      4.518
 ASSI (
   (( segid "    " and resid 1131 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HN  ))
 )
      6.000     6.000     0.000 peak  5890 weight  0.10000E+01 volume  0.15000E+00 ppm1      8.993 ppm2      8.720
 ASSI (
   (( segid "    " and resid 1132 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5889 weight  0.10000E+01 volume  0.67000E+00 ppm1      7.839 ppm2      0.912
 ASSI (
   (( segid "    " and resid 1132 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )
      5.000     5.000     0.000 peak  5888 weight  0.10000E+01 volume  0.54900E+00 ppm1      7.836 ppm2      1.027
 ASSI (
   (( segid "    " and resid 1132 and name HN  ))
 )(
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5887 weight  0.10000E+01 volume  0.60900E+00 ppm1      7.836 ppm2      1.373
 ASSI (
   (( segid "    " and resid 1132 and name HN  ))
 )(
   (( segid "    " and resid 1131 and name HB3 ))
  OR 
   (( segid "    " and resid 1131 and name HB2 ))
  OR 
   (( segid "    " and resid 1131 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5886 weight  0.10000E+01 volume  0.99300E+00 ppm1      7.838 ppm2      1.601
 ASSI (
   (( segid "    " and resid 1132 and name HN  ))
 )(
   (( segid "    " and resid 1130 and name HG2 ))
  OR 
   (( segid "    " and resid 1130 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5885 weight  0.10000E+01 volume  0.37700E+00 ppm1      7.836 ppm2      1.870
 ASSI (
   (( segid "    " and resid 1132 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HB1 ))
  OR 
   (( segid "    " and resid 1130 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5884 weight  0.10000E+01 volume  0.12020E+01 ppm1      7.837 ppm2      2.304
 ASSI (
   (( segid "    " and resid 1132 and name HN  ))
 )(
   (( segid "    " and resid 1132 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5881 weight  0.10000E+01 volume  0.10790E+01 ppm1      7.836 ppm2      4.031
 ASSI (
   (( segid "    " and resid 1132 and name HN  ))
 )(
   (( segid "    " and resid 1154 and name HA  ))
  OR 
   (( segid "    " and resid 1108 and name HA  ))
 )
      6.000     6.000     0.000 peak  5879 weight  0.10000E+01 volume  0.25100E+00 ppm1      7.836 ppm2      4.286
 ASSI (
   (( segid "    " and resid 1132 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HA  ))
  OR 
   (( segid "    " and resid 1130 and name HA  ))
 )
      5.000     5.000     0.000 peak  5882 weight  0.10000E+01 volume  0.14420E+01 ppm1      7.839 ppm2      3.944
 ASSI (
   (( segid "    " and resid 1132 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HA  ))
 )
      6.000     6.000     0.000 peak  5876 weight  0.10000E+01 volume  0.14700E+00 ppm1      7.844 ppm2      5.415
 ASSI (
   (( segid "    " and resid 1133 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HA  ))
  OR 
   (( segid "    " and resid 1149 and name HA  ))
  OR 
   (( segid "    " and resid 1135 and name HA  ))
 )
      6.000     6.000     0.000 peak  5863 weight  0.10000E+01 volume  0.17100E+00 ppm1      8.478 ppm2      5.410
 ASSI (
   (( segid "    " and resid 1133 and name HN  ))
 )(
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )
      6.000     6.000     0.000 peak  5873 weight  0.10000E+01 volume  0.15100E+00 ppm1      8.477 ppm2      0.564
 ASSI (
   (( segid "    " and resid 1133 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HN  ))
  OR 
   (( segid "    " and resid 1129 and name HN  ))
 )
      6.000     6.000     0.000 peak  5861 weight  0.10000E+01 volume  0.36400E+00 ppm1      8.472 ppm2      8.346
 ASSI (
   (( segid "    " and resid 1133 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )
      6.000     6.000     0.000 peak  5872 weight  0.10000E+01 volume  0.17100E+00 ppm1      8.472 ppm2      1.042
 ASSI (
   (( segid "    " and resid 1133 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HG2 ))
  OR 
   (( segid "    " and resid 1129 and name HB3 ))
  OR 
   (( segid "    " and resid 1129 and name HB2 ))
  OR 
   (( segid "    " and resid 1129 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5871 weight  0.10000E+01 volume  0.17300E+00 ppm1      8.474 ppm2      1.381
 ASSI (
   (( segid "    " and resid 1133 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HG1 ))
  OR 
   (( segid "    " and resid 1149 and name HB2 ))
  OR 
   (( segid "    " and resid 1134 and name HB  ))
  OR 
   (( segid "    " and resid 1131 and name HB3 ))
  OR 
   (( segid "    " and resid 1131 and name HB2 ))
  OR 
   (( segid "    " and resid 1131 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5870 weight  0.10000E+01 volume  0.15500E+00 ppm1      8.473 ppm2      1.588
 ASSI (
   (( segid "    " and resid 1133 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HB  ))
  OR 
   (( segid "    " and resid 1133 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5869 weight  0.10000E+01 volume  0.12950E+01 ppm1      8.474 ppm2      3.739
 ASSI (
   (( segid "    " and resid 1133 and name HN  ))
 )(
   (( segid "    " and resid 1133 and name HA  ))
 )
      5.000     5.000     0.000 peak  5862 weight  0.10000E+01 volume  0.99000E+00 ppm1      8.473 ppm2      6.000
 ASSI (
   (( segid "    " and resid 1133 and name HN  ))
 )(
   (( segid "    " and resid 1128 and name HD2 ))
  OR 
   (( segid "    " and resid 1128 and name HD1 ))
 )
      6.000     6.000     0.000 peak  4852 weight  0.10000E+01 volume  0.19600E+00 ppm1      8.472 ppm2      7.101
 ASSI (
   (( segid "    " and resid 1134 and name HN  ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )
      3.300     3.300     0.000 peak  5838 weight  0.10000E+01 volume  0.17470E+01 ppm1      8.245 ppm2      0.072
 ASSI (
   (( segid "    " and resid 1134 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
  OR 
   (( segid "    " and resid 1112 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5839 weight  0.10000E+01 volume  0.39300E+00 ppm1      8.242 ppm2      0.421
 ASSI (
   (( segid "    " and resid 1134 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
  OR 
   (( segid "    " and resid 1150 and name HG12))
 )
      6.000     6.000     0.000 peak  5842 weight  0.10000E+01 volume  0.34800E+00 ppm1      8.244 ppm2      0.738
 ASSI (
   (( segid "    " and resid 1134 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HG11))
 )
      5.000     5.000     0.000 peak  5843 weight  0.10000E+01 volume  0.48300E+00 ppm1      8.242 ppm2      0.827
 ASSI (
   (( segid "    " and resid 1134 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )
      6.000     6.000     0.000 peak  5841 weight  0.10000E+01 volume  0.28400E+00 ppm1      8.246 ppm2      1.030
 ASSI (
   (( segid "    " and resid 1134 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5846 weight  0.10000E+01 volume  0.63200E+00 ppm1      8.245 ppm2      1.373
 ASSI (
   (( segid "    " and resid 1134 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HG1 ))
  OR 
   (( segid "    " and resid 1134 and name HB  ))
 )
      5.000     5.000     0.000 peak  5844 weight  0.10000E+01 volume  0.87600E+00 ppm1      8.243 ppm2      1.564
 ASSI (
   (( segid "    " and resid 1134 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HB  ))
  OR 
   (( segid "    " and resid 1135 and name HG2 ))
 )
      6.000     6.000     0.000 peak  5847 weight  0.10000E+01 volume  0.23300E+00 ppm1      8.239 ppm2      2.032
 ASSI (
   (( segid "    " and resid 1134 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HA  ))
  OR 
   (( segid "    " and resid 1149 and name HA  ))
  OR 
   (( segid "    " and resid 1135 and name HA  ))
 )
      5.000     5.000     0.000 peak  5852 weight  0.10000E+01 volume  0.11460E+01 ppm1      8.243 ppm2      5.403
 ASSI (
   (( segid "    " and resid 1134 and name HN  ))
 )(
   (( segid "    " and resid 1133 and name HA  ))
 )
      2.700     2.700     0.000 peak  5853 weight  0.10000E+01 volume  0.38350E+01 ppm1      8.243 ppm2      6.000
 ASSI (
   (( segid "    " and resid 1134 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HE2 ))
  OR 
   (( segid "    " and resid 1136 and name HE1 ))
 )
      6.000     6.000     0.000 peak  5854 weight  0.10000E+01 volume  0.24500E+00 ppm1      8.242 ppm2      6.424
 ASSI (
   (( segid "    " and resid 1134 and name HN  ))
 )(
   (( segid "    " and resid 1160 and name HG2 ))
  OR 
   (( segid "    " and resid 1149 and name HB1 ))
  OR 
   (( segid "    " and resid 1135 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5845 weight  0.10000E+01 volume  0.32000E+00 ppm1      8.242 ppm2      1.698
 ASSI (
   (( segid "    " and resid 1135 and name HN  ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      6.000     6.000     0.000 peak  5831 weight  0.10000E+01 volume  0.26600E+00 ppm1      8.286 ppm2      0.948
 ASSI (
   (( segid "    " and resid 1135 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HG2 ))
  OR 
   (( segid "    " and resid 1120 and name HG11))
 )
      6.000     6.000     0.000 peak  5834 weight  0.10000E+01 volume  0.24000E+00 ppm1      8.287 ppm2      1.383
 ASSI (
   (( segid "    " and resid 1135 and name HN  ))
 )(
   (( segid "    " and resid 1134 and name HB  ))
 )
      2.700     2.700     0.000 peak  5832 weight  0.10000E+01 volume  0.40090E+01 ppm1      8.285 ppm2      1.563
 ASSI (
   (( segid "    " and resid 1135 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HD1 ))
  OR 
   (( segid "    " and resid 1135 and name HB2 ))
 )
      3.300     3.300     0.000 peak  5833 weight  0.10000E+01 volume  0.19810E+01 ppm1      8.287 ppm2      1.721
 ASSI (
   (( segid "    " and resid 1135 and name HN  ))
 )(
   (( segid "    " and resid 1135 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5835 weight  0.10000E+01 volume  0.17690E+01 ppm1      8.286 ppm2      1.833
 ASSI (
   (( segid "    " and resid 1135 and name HN  ))
 )(
   (( segid "    " and resid 1135 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5836 weight  0.10000E+01 volume  0.59200E+00 ppm1      8.286 ppm2      2.040
 ASSI (
   (( segid "    " and resid 1135 and name HN  ))
 )(
   (( segid "    " and resid 1135 and name HG1 ))
 )
      5.000     5.000     0.000 peak  5837 weight  0.10000E+01 volume  0.64600E+00 ppm1      8.288 ppm2      2.167
 ASSI (
   (( segid "    " and resid 1135 and name HN  ))
 )(
   (( segid "    " and resid 1134 and name HA  ))
 )
      2.700     2.700     0.000 peak  5828 weight  0.10000E+01 volume  0.66820E+01 ppm1      8.287 ppm2      4.367
 ASSI (
   (( segid "    " and resid 1135 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HA  ))
  OR 
   (( segid "    " and resid 1135 and name HA  ))
 )
      5.000     5.000     0.000 peak  5826 weight  0.10000E+01 volume  0.15420E+01 ppm1      8.288 ppm2      5.350
 ASSI (
   (( segid "    " and resid 1136 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HA  ))
  OR 
   (( segid "    " and resid 1135 and name HA  ))
 )
      2.700     2.700     0.000 peak  6450 weight  0.10000E+01 volume  0.53020E+01 ppm1      8.358 ppm2      5.347
 ASSI (
   (( segid "    " and resid 1136 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HN  ))
  OR 
   (( segid "    " and resid 1137 and name HN  ))
 )
      5.000     5.000     0.000 peak  6175 weight  0.10000E+01 volume  0.50800E+00 ppm1      8.356 ppm2      8.752
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HA  ))
  OR 
   (( segid "    " and resid 1135 and name HA  ))
 )
      6.000     6.000     0.000 peak  5809 weight  0.10000E+01 volume  0.14800E+00 ppm1      8.770 ppm2      5.347
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      5.000     5.000     0.000 peak  5821 weight  0.10000E+01 volume  0.41000E+00 ppm1      8.770 ppm2      0.077
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1139 and name HN  ))
  OR 
   (( segid "    " and resid 1136 and name HN  ))
 )
      5.000     5.000     0.000 peak  5798 weight  0.10000E+01 volume  0.53800E+00 ppm1      8.769 ppm2      8.355
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      6.000     6.000     0.000 peak  5822 weight  0.10000E+01 volume  0.37800E+00 ppm1      8.769 ppm2      0.181
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
  OR 
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )
      6.000     6.000     0.000 peak  5820 weight  0.10000E+01 volume  0.15700E+00 ppm1      8.764 ppm2      0.440
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
  OR 
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )
      6.000     6.000     0.000 peak  5819 weight  0.10000E+01 volume  0.16300E+00 ppm1      8.769 ppm2      0.569
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
  OR 
   (( segid "    " and resid 1120 and name HG12))
 )
      5.000     5.000     0.000 peak  5818 weight  0.10000E+01 volume  0.48000E+00 ppm1      8.770 ppm2      0.742
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      5.000     5.000     0.000 peak  5817 weight  0.10000E+01 volume  0.10270E+01 ppm1      8.771 ppm2      0.948
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HG2 ))
  OR 
   (( segid "    " and resid 1120 and name HB  ))
 )
      6.000     6.000     0.000 peak  5816 weight  0.10000E+01 volume  0.28200E+00 ppm1      8.769 ppm2      1.489
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HG1 ))
  OR 
   (( segid "    " and resid 1144 and name HB2 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
  OR 
   (( segid "    " and resid 1139 and name HB2 ))
  OR 
   (( segid "    " and resid 1134 and name HB  ))
  OR 
   (( segid "    " and resid 1115 and name HB  ))
 )
      6.000     6.000     0.000 peak  5815 weight  0.10000E+01 volume  0.23500E+00 ppm1      8.768 ppm2      1.609
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HD1 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
  OR 
   (( segid "    " and resid 1137 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5814 weight  0.10000E+01 volume  0.11890E+01 ppm1      8.770 ppm2      1.778
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1160 and name HG1 ))
  OR 
   (( segid "    " and resid 1137 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5813 weight  0.10000E+01 volume  0.92300E+00 ppm1      8.770 ppm2      1.884
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1137 and name HG2 ))
  OR 
   (( segid "    " and resid 1137 and name HG1 ))
  OR 
   (( segid "    " and resid 1114 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5812 weight  0.10000E+01 volume  0.12200E+01 ppm1      8.772 ppm2      2.220
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HB2 ))
  OR 
   (( segid "    " and resid 1136 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5811 weight  0.10000E+01 volume  0.20490E+01 ppm1      8.768 ppm2      2.429
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1118 and name HA2 ))
  OR 
   (( segid "    " and resid 1114 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5810 weight  0.10000E+01 volume  0.20000E+00 ppm1      8.770 ppm2      3.816
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1137 and name HA  ))
  OR 
   (( segid "    " and resid 1118 and name HA1 ))
 )
      5.000     5.000     0.000 peak  5808 weight  0.10000E+01 volume  0.14160E+01 ppm1      8.769 ppm2      4.516
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HA  ))
 )
      2.700     2.700     0.000 peak  5806 weight  0.10000E+01 volume  0.38080E+01 ppm1      8.769 ppm2      4.972
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      5.000     5.000     0.000 peak  5804 weight  0.10000E+01 volume  0.86000E+00 ppm1      8.771 ppm2      6.578
 ASSI (
   (( segid "    " and resid 1137 and name HN  ))
 )(
   (( segid "    " and resid 1135 and name HN  ))
  OR 
   (( segid "    " and resid 1121 and name HN  ))
 )
      5.000     5.000     0.000 peak  5797 weight  0.10000E+01 volume  0.43000E+00 ppm1      8.770 ppm2      8.257
 ASSI (
   (( segid "    " and resid 1137 and name HE21))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      6.000     6.000     0.000 peak  8785 weight  0.10000E+01 volume  0.30200E+00 ppm1      7.406 ppm2      0.956
 ASSI (
   (( segid "    " and resid 1137 and name HE21))
 )(
   (( segid "    " and resid 1137 and name HG2 ))
  OR 
   (( segid "    " and resid 1137 and name HG1 ))
 )
      3.300     3.300     0.000 peak  8789 weight  0.10000E+01 volume  0.17820E+01 ppm1      7.406 ppm2      2.199
 ASSI (
   (( segid "    " and resid 1137 and name HE22))
 )(
   (( segid "    " and resid 1121 and name HG23))
  OR 
   (( segid "    " and resid 1121 and name HG22))
  OR 
   (( segid "    " and resid 1121 and name HG21))
 )
      6.000     6.000     0.000 peak  8784 weight  0.10000E+01 volume  0.28400E+00 ppm1      6.705 ppm2      0.945
 ASSI (
   (( segid "    " and resid 1137 and name HE22))
 )(
   (( segid "    " and resid 1137 and name HG2 ))
  OR 
   (( segid "    " and resid 1137 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8783 weight  0.10000E+01 volume  0.83200E+00 ppm1      6.705 ppm2      2.196
 ASSI (
   (( segid "    " and resid 1138 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5787 weight  0.10000E+01 volume  0.26100E+00 ppm1      8.867 ppm2      3.409
 ASSI (
   (( segid "    " and resid 1138 and name HN  ))
 )(
   (( segid "    " and resid 1118 and name HA2 ))
  OR 
   (( segid "    " and resid 1117 and name HA  ))
 )
      6.000     6.000     0.000 peak  5786 weight  0.10000E+01 volume  0.17800E+00 ppm1      8.864 ppm2      3.807
 ASSI (
   (( segid "    " and resid 1138 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )
      5.000     5.000     0.000 peak  5795 weight  0.10000E+01 volume  0.12730E+01 ppm1      8.864 ppm2      0.742
 ASSI (
   (( segid "    " and resid 1138 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HB2 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5794 weight  0.10000E+01 volume  0.56200E+00 ppm1      8.864 ppm2      1.596
 ASSI (
   (( segid "    " and resid 1138 and name HN  ))
 )(
   (( segid "    " and resid 1137 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5793 weight  0.10000E+01 volume  0.10230E+01 ppm1      8.865 ppm2      1.773
 ASSI (
   (( segid "    " and resid 1138 and name HN  ))
 )(
   (( segid "    " and resid 1137 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5792 weight  0.10000E+01 volume  0.14840E+01 ppm1      8.863 ppm2      1.891
 ASSI (
   (( segid "    " and resid 1138 and name HN  ))
 )(
   (( segid "    " and resid 1137 and name HG2 ))
  OR 
   (( segid "    " and resid 1137 and name HG1 ))
 )
      5.000     5.000     0.000 peak  5790 weight  0.10000E+01 volume  0.10820E+01 ppm1      8.865 ppm2      2.200
 ASSI (
   (( segid "    " and resid 1138 and name HN  ))
 )(
   (( segid "    " and resid 1138 and name HB2 ))
 )
      3.300     3.300     0.000 peak  5789 weight  0.10000E+01 volume  0.19740E+01 ppm1      8.864 ppm2      2.532
 ASSI (
   (( segid "    " and resid 1138 and name HN  ))
 )(
   (( segid "    " and resid 1138 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5788 weight  0.10000E+01 volume  0.78800E+00 ppm1      8.868 ppm2      2.956
 ASSI (
   (( segid "    " and resid 1138 and name HN  ))
 )(
   (( segid "    " and resid 1138 and name HA  ))
 )
      5.000     5.000     0.000 peak  5784 weight  0.10000E+01 volume  0.90000E+00 ppm1      8.865 ppm2      5.121
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1140 and name HB2 ))
  OR 
   (( segid "    " and resid 1119 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5776 weight  0.10000E+01 volume  0.23500E+00 ppm1      8.340 ppm2      2.644
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      6.000     6.000     0.000 peak  5781 weight  0.10000E+01 volume  0.15400E+00 ppm1      8.346 ppm2      0.172
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1139 and name HB2 ))
 )
      3.300     3.300     0.000 peak  5780 weight  0.10000E+01 volume  0.22210E+01 ppm1      8.344 ppm2      1.598
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1139 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5779 weight  0.10000E+01 volume  0.12170E+01 ppm1      8.343 ppm2      1.906
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1139 and name HG2 ))
  OR 
   (( segid "    " and resid 1117 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5778 weight  0.10000E+01 volume  0.10910E+01 ppm1      8.343 ppm2      2.147
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HB2 ))
  OR 
   (( segid "    " and resid 1139 and name HG1 ))
 )
      5.000     5.000     0.000 peak  5777 weight  0.10000E+01 volume  0.11060E+01 ppm1      8.343 ppm2      2.269
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HB2 ))
  OR 
   (( segid "    " and resid 1138 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5774 weight  0.10000E+01 volume  0.92600E+00 ppm1      8.344 ppm2      2.529
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1138 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5773 weight  0.10000E+01 volume  0.75300E+00 ppm1      8.343 ppm2      2.954
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5772 weight  0.10000E+01 volume  0.34500E+00 ppm1      8.345 ppm2      3.425
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1118 and name HA2 ))
  OR 
   (( segid "    " and resid 1117 and name HA  ))
 )
      5.000     5.000     0.000 peak  5771 weight  0.10000E+01 volume  0.94800E+00 ppm1      8.344 ppm2      3.827
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1137 and name HA  ))
  OR 
   (( segid "    " and resid 1118 and name HA1 ))
 )
      5.000     5.000     0.000 peak  5769 weight  0.10000E+01 volume  0.10590E+01 ppm1      8.343 ppm2      4.527
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1138 and name HA  ))
 )
      3.300     3.300     0.000 peak  5767 weight  0.10000E+01 volume  0.30140E+01 ppm1      8.342 ppm2      5.121
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1137 and name HN  ))
  OR 
   (( segid "    " and resid 1115 and name HN  ))
 )
      6.000     6.000     0.000 peak  5823 weight  0.10000E+01 volume  0.12300E+00 ppm1      8.340 ppm2      8.726
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HB1 ))
  OR 
   (( segid "    " and resid 1140 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5775 weight  0.10000E+01 volume  0.22700E+00 ppm1      8.337 ppm2      2.798
 ASSI (
   (( segid "    " and resid 1139 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HN  ))
  OR 
   (( segid "    " and resid 1119 and name HN  ))
 )
      5.000     5.000     0.000 peak  5824 weight  0.10000E+01 volume  0.57300E+00 ppm1      8.343 ppm2      8.559
 ASSI (
   (( segid "    " and resid 1139 and name HE21))
 )(
   (( segid "    " and resid 1139 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8773 weight  0.10000E+01 volume  0.18500E+00 ppm1      7.385 ppm2      1.608
 ASSI (
   (( segid "    " and resid 1139 and name HE21))
 )(
   (( segid "    " and resid 1139 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8772 weight  0.10000E+01 volume  0.24700E+00 ppm1      7.385 ppm2      1.911
 ASSI (
   (( segid "    " and resid 1139 and name HE21))
 )(
   (( segid "    " and resid 1139 and name HG2 ))
  OR 
   (( segid "    " and resid 1117 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8764 weight  0.10000E+01 volume  0.12850E+01 ppm1      7.386 ppm2      2.150
 ASSI (
   (( segid "    " and resid 1139 and name HE21))
 )(
   (( segid "    " and resid 1139 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8763 weight  0.10000E+01 volume  0.11090E+01 ppm1      7.384 ppm2      2.269
 ASSI (
   (( segid "    " and resid 1139 and name HE21))
 )(
   (( segid "    " and resid 1117 and name HA  ))
 )
      6.000     6.000     0.000 peak  8771 weight  0.10000E+01 volume  0.29500E+00 ppm1      7.385 ppm2      3.772
 ASSI (
   (( segid "    " and resid 1139 and name HE22))
 )(
   (( segid "    " and resid 1139 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8774 weight  0.10000E+01 volume  0.16000E+00 ppm1      6.674 ppm2      1.617
 ASSI (
   (( segid "    " and resid 1139 and name HE22))
 )(
   (( segid "    " and resid 1139 and name HG2 ))
  OR 
   (( segid "    " and resid 1117 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8765 weight  0.10000E+01 volume  0.94700E+00 ppm1      6.672 ppm2      2.149
 ASSI (
   (( segid "    " and resid 1139 and name HE22))
 )(
   (( segid "    " and resid 1139 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8766 weight  0.10000E+01 volume  0.71700E+00 ppm1      6.673 ppm2      2.264
 ASSI (
   (( segid "    " and resid 1139 and name HE22))
 )(
   (( segid "    " and resid 1117 and name HA  ))
 )
      6.000     6.000     0.000 peak  8776 weight  0.10000E+01 volume  0.33700E+00 ppm1      6.672 ppm2      3.770
 ASSI (
   (( segid "    " and resid 1140 and name HN  ))
 )(
   (( segid "    " and resid 1139 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5744 weight  0.10000E+01 volume  0.12700E+01 ppm1      8.458 ppm2      1.600
 ASSI (
   (( segid "    " and resid 1140 and name HD22))
 )(
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )
      5.000     5.000     0.000 peak  8817 weight  0.10000E+01 volume  0.51500E+00 ppm1      6.945 ppm2      0.405
 ASSI (
   (( segid "    " and resid 1140 and name HD22))
 )(
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )
      5.000     5.000     0.000 peak  8816 weight  0.10000E+01 volume  0.73100E+00 ppm1      6.945 ppm2      0.615
 ASSI (
   (( segid "    " and resid 1140 and name HD22))
 )(
   (( segid "    " and resid 1141 and name HG  ))
 )
      5.000     5.000     0.000 peak  8811 weight  0.10000E+01 volume  0.77100E+00 ppm1      6.946 ppm2      1.400
 ASSI (
   (( segid "    " and resid 1140 and name HD22))
 )(
   (( segid "    " and resid 1140 and name HB2 ))
 )
      3.300     3.300     0.000 peak  8805 weight  0.10000E+01 volume  0.17330E+01 ppm1      6.948 ppm2      2.655
 ASSI (
   (( segid "    " and resid 1140 and name HD22))
 )(
   (( segid "    " and resid 1140 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8804 weight  0.10000E+01 volume  0.81300E+00 ppm1      6.946 ppm2      2.799
 ASSI (
   (( segid "    " and resid 1140 and name HD22))
 )(
   (( segid "    " and resid 1140 and name HA  ))
 )
      6.000     6.000     0.000 peak  8803 weight  0.10000E+01 volume  0.16800E+00 ppm1      6.948 ppm2      4.363
 ASSI (
   (( segid "    " and resid 1140 and name HD22))
 )(
   (( segid "    " and resid 1142 and name HN  ))
  OR 
   (( segid "    " and resid 1140 and name HN  ))
 )
      6.000     6.000     0.000 peak  8800 weight  0.10000E+01 volume  0.20000E+00 ppm1      6.942 ppm2      8.456
 ASSI (
   (( segid "    " and resid 1141 and name HN  ))
 )(
   (( segid "    " and resid 1141 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5760 weight  0.10000E+01 volume  0.91000E+00 ppm1      8.279 ppm2      1.168
 ASSI (
   (( segid "    " and resid 1141 and name HN  ))
 )(
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )
      5.000     5.000     0.000 peak  5762 weight  0.10000E+01 volume  0.50400E+00 ppm1      8.278 ppm2      0.413
 ASSI (
   (( segid "    " and resid 1141 and name HN  ))
 )(
   (( segid "    " and resid 1141 and name HG  ))
 )
      5.000     5.000     0.000 peak  5759 weight  0.10000E+01 volume  0.11100E+01 ppm1      8.278 ppm2      1.399
 ASSI (
   (( segid "    " and resid 1141 and name HN  ))
 )(
   (( segid "    " and resid 1192 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HB2 ))
  OR 
   (( segid "    " and resid 1139 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5758 weight  0.10000E+01 volume  0.25300E+00 ppm1      8.278 ppm2      1.631
 ASSI (
   (( segid "    " and resid 1141 and name HN  ))
 )(
   (( segid "    " and resid 1141 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5757 weight  0.10000E+01 volume  0.60100E+00 ppm1      8.278 ppm2      2.063
 ASSI (
   (( segid "    " and resid 1141 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
  OR 
   (( segid "    " and resid 1139 and name HE22))
  OR 
   (( segid "    " and resid 1137 and name HE22))
 )
      6.000     6.000     0.000 peak  5751 weight  0.10000E+01 volume  0.30500E+00 ppm1      8.278 ppm2      6.661
 ASSI (
   (( segid "    " and resid 1141 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HN  ))
  OR 
   (( segid "    " and resid 1140 and name HN  ))
 )
      3.300     3.300     0.000 peak  5469 weight  0.10000E+01 volume  0.19190E+01 ppm1      8.279 ppm2      8.444
 ASSI (
   (( segid "    " and resid 1142 and name HN  ))
 )(
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )
      6.000     6.000     0.000 peak  5742 weight  0.10000E+01 volume  0.29100E+00 ppm1      8.430 ppm2      0.398
 ASSI (
   (( segid "    " and resid 1142 and name HN  ))
 )(
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )
      5.000     5.000     0.000 peak  5741 weight  0.10000E+01 volume  0.54600E+00 ppm1      8.430 ppm2      0.610
 ASSI (
   (( segid "    " and resid 1142 and name HN  ))
 )(
   (( segid "    " and resid 1141 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5740 weight  0.10000E+01 volume  0.48400E+00 ppm1      8.429 ppm2      1.173
 ASSI (
   (( segid "    " and resid 1142 and name HN  ))
 )(
   (( segid "    " and resid 1166 and name HG2 ))
  OR 
   (( segid "    " and resid 1141 and name HG  ))
 )
      5.000     5.000     0.000 peak  5739 weight  0.10000E+01 volume  0.46400E+00 ppm1      8.431 ppm2      1.392
 ASSI (
   (( segid "    " and resid 1142 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HB2 ))
  OR 
   (( segid "    " and resid 1138 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5738 weight  0.10000E+01 volume  0.11210E+01 ppm1      8.430 ppm2      2.522
 ASSI (
   (( segid "    " and resid 1142 and name HN  ))
 )(
   (( segid "    " and resid 1166 and name HD1 ))
  OR 
   (( segid "    " and resid 1138 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5737 weight  0.10000E+01 volume  0.71100E+00 ppm1      8.430 ppm2      2.942
 ASSI (
   (( segid "    " and resid 1142 and name HN  ))
 )(
   (( segid "    " and resid 1141 and name HA  ))
 )
      5.000     5.000     0.000 peak  5733 weight  0.10000E+01 volume  0.10290E+01 ppm1      8.430 ppm2      3.673
 ASSI (
   (( segid "    " and resid 1142 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )
      3.300     3.300     0.000 peak  5735 weight  0.10000E+01 volume  0.31340E+01 ppm1      8.427 ppm2      6.653
 ASSI (
   (( segid "    " and resid 1143 and name HN  ))
 )(
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )
      6.000     6.000     0.000 peak  6213 weight  0.10000E+01 volume  0.24400E+00 ppm1      7.868 ppm2      0.395
 ASSI (
   (( segid "    " and resid 1143 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )
      5.000     5.000     0.000 peak  6212 weight  0.10000E+01 volume  0.48900E+00 ppm1      7.870 ppm2      0.630
 ASSI (
   (( segid "    " and resid 1143 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6211 weight  0.10000E+01 volume  0.15660E+01 ppm1      7.872 ppm2      1.651
 ASSI (
   (( segid "    " and resid 1143 and name HN  ))
 )(
   (( segid "    " and resid 1143 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6210 weight  0.10000E+01 volume  0.11300E+01 ppm1      7.870 ppm2      1.804
 ASSI (
   (( segid "    " and resid 1143 and name HN  ))
 )(
   (( segid "    " and resid 1143 and name HG2 ))
  OR 
   (( segid "    " and resid 1143 and name HG1 ))
 )
      5.000     5.000     0.000 peak  6209 weight  0.10000E+01 volume  0.83000E+00 ppm1      7.870 ppm2      2.156
 ASSI (
   (( segid "    " and resid 1143 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6208 weight  0.10000E+01 volume  0.84100E+00 ppm1      7.874 ppm2      2.243
 ASSI (
   (( segid "    " and resid 1143 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HB2 ))
  OR 
   (( segid "    " and resid 1138 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6207 weight  0.10000E+01 volume  0.35800E+00 ppm1      7.870 ppm2      2.502
 ASSI (
   (( segid "    " and resid 1143 and name HN  ))
 )(
   (( segid "    " and resid 1166 and name HD1 ))
  OR 
   (( segid "    " and resid 1138 and name HB1 ))
 )
      6.000     6.000     0.000 peak  6206 weight  0.10000E+01 volume  0.27500E+00 ppm1      7.870 ppm2      2.940
 ASSI (
   (( segid "    " and resid 1143 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HB1 ))
 )
      5.000     5.000     0.000 peak  6205 weight  0.10000E+01 volume  0.42300E+00 ppm1      7.870 ppm2      3.411
 ASSI (
   (( segid "    " and resid 1143 and name HN  ))
 )(
   (( segid "    " and resid 1193 and name HB  ))
 )
      6.000     6.000     0.000 peak  6204 weight  0.10000E+01 volume  0.30700E+00 ppm1      7.870 ppm2      3.555
 ASSI (
   (( segid "    " and resid 1143 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HA  ))
 )
      5.000     5.000     0.000 peak  6201 weight  0.10000E+01 volume  0.46100E+00 ppm1      7.871 ppm2      5.033
 ASSI (
   (( segid "    " and resid 1143 and name HE21))
 )(
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )
      6.000     6.000     0.000 peak  8756 weight  0.10000E+01 volume  0.91000E-01 ppm1      7.450 ppm2      0.383
 ASSI (
   (( segid "    " and resid 1143 and name HE21))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      6.000     6.000     0.000 peak  8755 weight  0.10000E+01 volume  0.11300E+00 ppm1      7.450 ppm2      0.584
 ASSI (
   (( segid "    " and resid 1143 and name HE21))
 )(
   (( segid "    " and resid 1164 and name HB1 ))
  OR 
   (( segid "    " and resid 1144 and name HB2 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8754 weight  0.10000E+01 volume  0.39500E+00 ppm1      7.450 ppm2      1.597
 ASSI (
   (( segid "    " and resid 1143 and name HE21))
 )(
   (( segid "    " and resid 1164 and name HB1 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8753 weight  0.10000E+01 volume  0.36300E+00 ppm1      7.451 ppm2      1.661
 ASSI (
   (( segid "    " and resid 1143 and name HE21))
 )(
   (( segid "    " and resid 1145 and name HB2 ))
  OR 
   (( segid "    " and resid 1143 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8752 weight  0.10000E+01 volume  0.17400E+00 ppm1      7.450 ppm2      1.805
 ASSI (
   (( segid "    " and resid 1143 and name HE21))
 )(
   (( segid "    " and resid 1192 and name HD2 ))
  OR 
   (( segid "    " and resid 1192 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8744 weight  0.10000E+01 volume  0.10600E+00 ppm1      7.450 ppm2      3.110
 ASSI (
   (( segid "    " and resid 1143 and name HE22))
 )(
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )
      6.000     6.000     0.000 peak  8757 weight  0.10000E+01 volume  0.10900E+00 ppm1      6.741 ppm2      0.400
 ASSI (
   (( segid "    " and resid 1143 and name HE22))
 )(
   (( segid "    " and resid 1164 and name HG  ))
  OR 
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      6.000     6.000     0.000 peak  8758 weight  0.10000E+01 volume  0.10900E+00 ppm1      6.741 ppm2      0.598
 ASSI (
   (( segid "    " and resid 1143 and name HE22))
 )(
   (( segid "    " and resid 1144 and name HB2 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8750 weight  0.10000E+01 volume  0.30300E+00 ppm1      6.746 ppm2      1.574
 ASSI (
   (( segid "    " and resid 1143 and name HE22))
 )(
   (( segid "    " and resid 1192 and name HB1 ))
  OR 
   (( segid "    " and resid 1164 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8748 weight  0.10000E+01 volume  0.34400E+00 ppm1      6.747 ppm2      1.665
 ASSI (
   (( segid "    " and resid 1143 and name HE22))
 )(
   (( segid "    " and resid 1145 and name HB2 ))
  OR 
   (( segid "    " and resid 1143 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8749 weight  0.10000E+01 volume  0.15200E+00 ppm1      6.744 ppm2      1.803
 ASSI (
   (( segid "    " and resid 1143 and name HE22))
 )(
   (( segid "    " and resid 1143 and name HG2 ))
  OR 
   (( segid "    " and resid 1143 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8747 weight  0.10000E+01 volume  0.11120E+01 ppm1      6.746 ppm2      2.159
 ASSI (
   (( segid "    " and resid 1143 and name HE22))
 )(
   (( segid "    " and resid 1192 and name HD2 ))
  OR 
   (( segid "    " and resid 1192 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8745 weight  0.10000E+01 volume  0.12300E+00 ppm1      6.747 ppm2      3.110
 ASSI (
   (( segid "    " and resid 1144 and name HN  ))
 )(
   (( segid "    " and resid 1143 and name HE21))
 )
      6.000     6.000     0.000 peak  6185 weight  0.10000E+01 volume  0.13500E+00 ppm1      8.571 ppm2      7.430
 ASSI (
   (( segid "    " and resid 1144 and name HN  ))
 )(
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
  OR 
   (( segid "    " and resid 1115 and name HG23))
  OR 
   (( segid "    " and resid 1115 and name HG22))
  OR 
   (( segid "    " and resid 1115 and name HG21))
 )
      6.000     6.000     0.000 peak  6197 weight  0.10000E+01 volume  0.12200E+00 ppm1      8.563 ppm2      0.395
 ASSI (
   (( segid "    " and resid 1144 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      5.000     5.000     0.000 peak  6196 weight  0.10000E+01 volume  0.85700E+00 ppm1      8.564 ppm2      0.561
 ASSI (
   (( segid "    " and resid 1144 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HG  ))
 )
      5.000     5.000     0.000 peak  6194 weight  0.10000E+01 volume  0.69500E+00 ppm1      8.563 ppm2      1.313
 ASSI (
   (( segid "    " and resid 1144 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HB2 ))
 )
      2.700     2.700     0.000 peak  6193 weight  0.10000E+01 volume  0.45110E+01 ppm1      8.564 ppm2      1.564
 ASSI (
   (( segid "    " and resid 1144 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HB2 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HB2 ))
 )
      3.300     3.300     0.000 peak  6192 weight  0.10000E+01 volume  0.31140E+01 ppm1      8.563 ppm2      1.638
 ASSI (
   (( segid "    " and resid 1144 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HB2 ))
  OR 
   (( segid "    " and resid 1145 and name HB2 ))
  OR 
   (( segid "    " and resid 1143 and name HB1 ))
  OR 
   (( segid "    " and resid 1137 and name HB2 ))
 )
      5.000     5.000     0.000 peak  6191 weight  0.10000E+01 volume  0.97100E+00 ppm1      8.561 ppm2      1.800
 ASSI (
   (( segid "    " and resid 1144 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HG2 ))
  OR 
   (( segid "    " and resid 1143 and name HG1 ))
 )
      5.000     5.000     0.000 peak  6190 weight  0.10000E+01 volume  0.86100E+00 ppm1      8.563 ppm2      2.155
 ASSI (
   (( segid "    " and resid 1144 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HB2 ))
  OR 
   (( segid "    " and resid 1138 and name HB2 ))
 )
      6.000     6.000     0.000 peak  6189 weight  0.10000E+01 volume  0.22500E+00 ppm1      8.563 ppm2      2.540
 ASSI (
   (( segid "    " and resid 1144 and name HN  ))
 )(
   (( segid "    " and resid 1143 and name HE22))
 )
      6.000     6.000     0.000 peak  6187 weight  0.10000E+01 volume  0.23100E+00 ppm1      8.571 ppm2      6.740
 ASSI (
   (( segid "    " and resid 1145 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )
      5.000     5.000     0.000 peak  5730 weight  0.10000E+01 volume  0.89300E+00 ppm1      9.404 ppm2      0.747
 ASSI (
   (( segid "    " and resid 1145 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HG  ))
 )
      3.300     3.300     0.000 peak  5728 weight  0.10000E+01 volume  0.22100E+01 ppm1      9.403 ppm2      1.319
 ASSI (
   (( segid "    " and resid 1145 and name HN  ))
 )(
   (( segid "    " and resid 1162 and name HB2 ))
  OR 
   (( segid "    " and resid 1161 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
  OR 
   (( segid "    " and resid 1115 and name HB  ))
 )
      5.000     5.000     0.000 peak  5727 weight  0.10000E+01 volume  0.14400E+01 ppm1      9.402 ppm2      1.540
 ASSI (
   (( segid "    " and resid 1145 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HB1 ))
  OR 
   (( segid "    " and resid 1144 and name HB2 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5726 weight  0.10000E+01 volume  0.21920E+01 ppm1      9.403 ppm2      1.622
 ASSI (
   (( segid "    " and resid 1145 and name HN  ))
 )(
   (( segid "    " and resid 1161 and name HB1 ))
  OR 
   (( segid "    " and resid 1145 and name HB2 ))
 )
      3.300     3.300     0.000 peak  5725 weight  0.10000E+01 volume  0.19410E+01 ppm1      9.402 ppm2      1.777
 ASSI (
   (( segid "    " and resid 1145 and name HN  ))
 )(
   (( segid "    " and resid 1145 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5724 weight  0.10000E+01 volume  0.16780E+01 ppm1      9.401 ppm2      1.953
 ASSI (
   (( segid "    " and resid 1145 and name HN  ))
 )(
   (( segid "    " and resid 1145 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG1 ))
  OR 
   (( segid "    " and resid 1142 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5723 weight  0.10000E+01 volume  0.10220E+01 ppm1      9.403 ppm2      2.245
 ASSI (
   (( segid "    " and resid 1146 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      5.000     5.000     0.000 peak  5717 weight  0.10000E+01 volume  0.10320E+01 ppm1      8.528 ppm2      0.572
 ASSI (
   (( segid "    " and resid 1146 and name HN  ))
 )(
   (( segid "    " and resid 1161 and name HB1 ))
  OR 
   (( segid "    " and resid 1145 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5716 weight  0.10000E+01 volume  0.10000E+01 ppm1      8.528 ppm2      1.766
 ASSI (
   (( segid "    " and resid 1146 and name HN  ))
 )(
   (( segid "    " and resid 1145 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5715 weight  0.10000E+01 volume  0.81100E+00 ppm1      8.528 ppm2      1.949
 ASSI (
   (( segid "    " and resid 1146 and name HN  ))
 )(
   (( segid "    " and resid 1145 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG1 ))
 )
      3.300     3.300     0.000 peak  5714 weight  0.10000E+01 volume  0.27130E+01 ppm1      8.526 ppm2      2.251
 ASSI (
   (( segid "    " and resid 1146 and name HN  ))
 )(
   (( segid "    " and resid 1146 and name HA2 ))
 )
      2.700     2.700     0.000 peak  5713 weight  0.10000E+01 volume  0.41340E+01 ppm1      8.524 ppm2      3.607
 ASSI (
   (( segid "    " and resid 1146 and name HN  ))
 )(
   (( segid "    " and resid 1146 and name HA1 ))
 )
      3.300     3.300     0.000 peak  5711 weight  0.10000E+01 volume  0.27450E+01 ppm1      8.524 ppm2      4.433
 ASSI (
   (( segid "    " and resid 1146 and name HN  ))
 )(
   (( segid "    " and resid 1162 and name HN  ))
 )
      6.000     6.000     0.000 peak  5710 weight  0.10000E+01 volume  0.22000E+00 ppm1      8.527 ppm2      8.041
 ASSI (
   (( segid "    " and resid 1146 and name HN  ))
 )(
   (( segid "    " and resid 1147 and name HN  ))
 )
      5.000     5.000     0.000 peak  5709 weight  0.10000E+01 volume  0.11850E+01 ppm1      8.526 ppm2      8.346
 ASSI (
   (( segid "    " and resid 1146 and name HN  ))
 )(
   (( segid "    " and resid 1145 and name HN  ))
 )
      5.000     5.000     0.000 peak  5294 weight  0.10000E+01 volume  0.61000E+00 ppm1      8.527 ppm2      9.407
 ASSI (
   (( segid "    " and resid 1147 and name HD22))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
  OR 
   (( segid "    " and resid 1150 and name HG12))
 )
      6.000     6.000     0.000 peak  8935 weight  0.10000E+01 volume  0.16800E+00 ppm1      6.897 ppm2      0.744
 ASSI (
   (( segid "    " and resid 1147 and name HD22))
 )(
   (( segid "    " and resid 1150 and name HB  ))
 )
      6.000     6.000     0.000 peak  8934 weight  0.10000E+01 volume  0.17000E+00 ppm1      6.897 ppm2      2.025
 ASSI (
   (( segid "    " and resid 1147 and name HD22))
 )(
   (( segid "    " and resid 1147 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8931 weight  0.10000E+01 volume  0.12760E+01 ppm1      6.895 ppm2      2.736
 ASSI (
   (( segid "    " and resid 1147 and name HD22))
 )(
   (( segid "    " and resid 1147 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8930 weight  0.10000E+01 volume  0.65600E+00 ppm1      6.898 ppm2      2.922
 ASSI (
   (( segid "    " and resid 1147 and name HD22))
 )(
   (( segid "    " and resid 1160 and name HA  ))
  OR 
   (( segid "    " and resid 1158 and name HB1 ))
  OR 
   (( segid "    " and resid 1146 and name HA1 ))
 )
      6.000     6.000     0.000 peak  8937 weight  0.10000E+01 volume  0.12400E+00 ppm1      6.893 ppm2      4.405
 ASSI (
   (( segid "    " and resid 1147 and name HD22))
 )(
   (( segid "    " and resid 1147 and name HA  ))
 )
      6.000     6.000     0.000 peak  8929 weight  0.10000E+01 volume  0.19100E+00 ppm1      6.893 ppm2      4.526
 ASSI (
   (( segid "    " and resid 1147 and name HD22))
 )(
   (( segid "    " and resid 1147 and name HN  ))
 )
      6.000     6.000     0.000 peak  8928 weight  0.10000E+01 volume  0.22100E+00 ppm1      6.891 ppm2      8.342
 ASSI (
   (( segid "    " and resid 1148 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      5.000     5.000     0.000 peak  5708 weight  0.10000E+01 volume  0.13230E+01 ppm1      8.146 ppm2      0.562
 ASSI (
   (( segid "    " and resid 1148 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
  OR 
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )
      5.000     5.000     0.000 peak  5707 weight  0.10000E+01 volume  0.51600E+00 ppm1      8.146 ppm2      0.731
 ASSI (
   (( segid "    " and resid 1148 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HG1 ))
 )
      3.300     3.300     0.000 peak  5705 weight  0.10000E+01 volume  0.26350E+01 ppm1      8.146 ppm2      1.571
 ASSI (
   (( segid "    " and resid 1148 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HB1 ))
  OR 
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
 )
      5.000     5.000     0.000 peak  5704 weight  0.10000E+01 volume  0.10190E+01 ppm1      8.147 ppm2      1.719
 ASSI (
   (( segid "    " and resid 1148 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
 )
      3.300     3.300     0.000 peak  5703 weight  0.10000E+01 volume  0.25350E+01 ppm1      8.146 ppm2      1.807
 ASSI (
   (( segid "    " and resid 1148 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5701 weight  0.10000E+01 volume  0.20450E+01 ppm1      8.146 ppm2      2.094
 ASSI (
   (( segid "    " and resid 1148 and name HN  ))
 )(
   (( segid "    " and resid 1147 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5699 weight  0.10000E+01 volume  0.13640E+01 ppm1      8.147 ppm2      2.913
 ASSI (
   (( segid "    " and resid 1148 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HA  ))
 )
      3.300     3.300     0.000 peak  5697 weight  0.10000E+01 volume  0.18490E+01 ppm1      8.144 ppm2      3.951
 ASSI (
   (( segid "    " and resid 1148 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HA  ))
  OR 
   (( segid "    " and resid 1135 and name HA  ))
 )
      6.000     6.000     0.000 peak  5694 weight  0.10000E+01 volume  0.26300E+00 ppm1      8.144 ppm2      5.368
 ASSI (
   (( segid "    " and resid 1149 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      5.000     5.000     0.000 peak  5693 weight  0.10000E+01 volume  0.47400E+00 ppm1      7.719 ppm2      0.559
 ASSI (
   (( segid "    " and resid 1149 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
  OR 
   (( segid "    " and resid 1150 and name HG12))
  OR 
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )
      5.000     5.000     0.000 peak  5692 weight  0.10000E+01 volume  0.45000E+00 ppm1      7.718 ppm2      0.734
 ASSI (
   (( segid "    " and resid 1149 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HG2 ))
  OR 
   (( segid "    " and resid 1144 and name HG  ))
 )
      5.000     5.000     0.000 peak  5691 weight  0.10000E+01 volume  0.72300E+00 ppm1      7.718 ppm2      1.363
 ASSI (
   (( segid "    " and resid 1149 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HG1 ))
  OR 
   (( segid "    " and resid 1149 and name HB2 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
 )
      2.700     2.700     0.000 peak  5689 weight  0.10000E+01 volume  0.51390E+01 ppm1      7.718 ppm2      1.581
 ASSI (
   (( segid "    " and resid 1149 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
 )
      3.300     3.300     0.000 peak  5687 weight  0.10000E+01 volume  0.19500E+01 ppm1      7.718 ppm2      1.808
 ASSI (
   (( segid "    " and resid 1149 and name HN  ))
 )(
   (( segid "    " and resid 1147 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5684 weight  0.10000E+01 volume  0.76100E+00 ppm1      7.719 ppm2      2.731
 ASSI (
   (( segid "    " and resid 1149 and name HN  ))
 )(
   (( segid "    " and resid 1147 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5683 weight  0.10000E+01 volume  0.18760E+01 ppm1      7.717 ppm2      2.915
 ASSI (
   (( segid "    " and resid 1149 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HD2 ))
  OR 
   (( segid "    " and resid 1149 and name HD1 ))
 )
      5.000     5.000     0.000 peak  5682 weight  0.10000E+01 volume  0.86100E+00 ppm1      7.719 ppm2      3.124
 ASSI (
   (( segid "    " and resid 1149 and name HN  ))
 )(
   (( segid "    " and resid 1147 and name HA  ))
 )
      3.300     3.300     0.000 peak  5680 weight  0.10000E+01 volume  0.19090E+01 ppm1      7.715 ppm2      4.540
 ASSI (
   (( segid "    " and resid 1149 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HA  ))
  OR 
   (( segid "    " and resid 1135 and name HA  ))
 )
      3.300     3.300     0.000 peak  5679 weight  0.10000E+01 volume  0.19840E+01 ppm1      7.715 ppm2      5.379
 ASSI (
   (( segid "    " and resid 1149 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HN  ))
 )
      2.700     2.700     0.000 peak  5677 weight  0.10000E+01 volume  0.56180E+01 ppm1      7.715 ppm2      8.145
 ASSI (
   (( segid "    " and resid 1149 and name HN  ))
 )(
   (( segid "    " and resid 1147 and name HN  ))
  OR 
   (( segid "    " and resid 1136 and name HN  ))
 )
      6.000     6.000     0.000 peak  5676 weight  0.10000E+01 volume  0.36100E+00 ppm1      7.718 ppm2      8.346
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HN  ))
  OR 
   (( segid "    " and resid 1151 and name HN  ))
  OR 
   (( segid "    " and resid 1136 and name HN  ))
 )
      5.000     5.000     0.000 peak  5652 weight  0.10000E+01 volume  0.52000E+00 ppm1      8.718 ppm2      8.369
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      5.000     5.000     0.000 peak  5675 weight  0.10000E+01 volume  0.68900E+00 ppm1      8.720 ppm2      0.077
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )
      5.000     5.000     0.000 peak  5674 weight  0.10000E+01 volume  0.58900E+00 ppm1      8.722 ppm2      0.418
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
  OR 
   (( segid "    " and resid 1134 and name HG13))
  OR 
   (( segid "    " and resid 1134 and name HG12))
  OR 
   (( segid "    " and resid 1134 and name HG11))
 )
      6.000     6.000     0.000 peak  5673 weight  0.10000E+01 volume  0.15500E+00 ppm1      8.722 ppm2      0.574
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
  OR 
   (( segid "    " and resid 1150 and name HG12))
 )
      5.000     5.000     0.000 peak  5671 weight  0.10000E+01 volume  0.11840E+01 ppm1      8.721 ppm2      0.741
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HG11))
 )
      5.000     5.000     0.000 peak  5672 weight  0.10000E+01 volume  0.80000E+00 ppm1      8.722 ppm2      0.838
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5670 weight  0.10000E+01 volume  0.11200E+01 ppm1      8.720 ppm2      1.379
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HG1 ))
  OR 
   (( segid "    " and resid 1148 and name HG1 ))
  OR 
   (( segid "    " and resid 1134 and name HB  ))
 )
      5.000     5.000     0.000 peak  5669 weight  0.10000E+01 volume  0.16300E+01 ppm1      8.724 ppm2      1.569
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HB1 ))
  OR 
   (( segid "    " and resid 1135 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5668 weight  0.10000E+01 volume  0.78000E+00 ppm1      8.722 ppm2      1.695
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1160 and name HG1 ))
  OR 
   (( segid "    " and resid 1148 and name HD2 ))
  OR 
   (( segid "    " and resid 1148 and name HD1 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
  OR 
   (( segid "    " and resid 1135 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5667 weight  0.10000E+01 volume  0.22600E+00 ppm1      8.722 ppm2      1.815
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HB  ))
  OR 
   (( segid "    " and resid 1135 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5666 weight  0.10000E+01 volume  0.42300E+00 ppm1      8.721 ppm2      2.034
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HD2 ))
  OR 
   (( segid "    " and resid 1149 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5665 weight  0.10000E+01 volume  0.18600E+00 ppm1      8.722 ppm2      3.128
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1133 and name HB2 ))
  OR 
   (( segid "    " and resid 1133 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5664 weight  0.10000E+01 volume  0.17900E+00 ppm1      8.719 ppm2      3.784
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1160 and name HA  ))
  OR 
   (( segid "    " and resid 1158 and name HB1 ))
  OR 
   (( segid "    " and resid 1134 and name HA  ))
 )
      6.000     6.000     0.000 peak  5663 weight  0.10000E+01 volume  0.12200E+00 ppm1      8.720 ppm2      4.341
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HA  ))
  OR 
   (( segid "    " and resid 1135 and name HA  ))
 )
      2.700     2.700     0.000 peak  5661 weight  0.10000E+01 volume  0.39450E+01 ppm1      8.720 ppm2      5.351
 ASSI (
   (( segid "    " and resid 1150 and name HN  ))
 )(
   (( segid "    " and resid 1136 and name HD2 ))
  OR 
   (( segid "    " and resid 1136 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5657 weight  0.10000E+01 volume  0.16800E+00 ppm1      8.719 ppm2      6.594
 ASSI (
   (( segid "    " and resid 1151 and name HN  ))
 )(
   (( segid "    " and resid 1158 and name HB2 ))
  OR 
   (( segid "    " and resid 1132 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5643 weight  0.10000E+01 volume  0.44100E+00 ppm1      8.420 ppm2      4.176
 ASSI (
   (( segid "    " and resid 1151 and name HN  ))
 )(
   (( segid "    " and resid 1160 and name HA  ))
  OR 
   (( segid "    " and resid 1159 and name HA  ))
  OR 
   (( segid "    " and resid 1158 and name HB1 ))
  OR 
   (( segid "    " and resid 1134 and name HA  ))
 )
      6.000     6.000     0.000 peak  5641 weight  0.10000E+01 volume  0.31200E+00 ppm1      8.417 ppm2      4.367
 ASSI (
   (( segid "    " and resid 1151 and name HN  ))
 )(
   (( segid "    " and resid 1158 and name HA  ))
  OR 
   (( segid "    " and resid 1153 and name HA  ))
 )
      6.000     6.000     0.000 peak  5642 weight  0.10000E+01 volume  0.24400E+00 ppm1      8.416 ppm2      4.485
 ASSI (
   (( segid "    " and resid 1151 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HA  ))
 )
      6.000     6.000     0.000 peak  5639 weight  0.10000E+01 volume  0.23100E+00 ppm1      8.414 ppm2      5.013
 ASSI (
   (( segid "    " and resid 1151 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HN  ))
  OR 
   (( segid "    " and resid 1150 and name HN  ))
 )
      6.000     6.000     0.000 peak  5634 weight  0.10000E+01 volume  0.19100E+00 ppm1      8.414 ppm2      8.725
 ASSI (
   (( segid "    " and resid 1151 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
 )
      6.000     6.000     0.000 peak  5651 weight  0.10000E+01 volume  0.39700E+00 ppm1      8.417 ppm2      0.423
 ASSI (
   (( segid "    " and resid 1151 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )
      5.000     5.000     0.000 peak  5649 weight  0.10000E+01 volume  0.70600E+00 ppm1      8.416 ppm2      1.032
 ASSI (
   (( segid "    " and resid 1151 and name HN  ))
 )(
   (( segid "    " and resid 1149 and name HG2 ))
 )
      6.000     6.000     0.000 peak  5648 weight  0.10000E+01 volume  0.22000E+00 ppm1      8.421 ppm2      1.395
 ASSI (
   (( segid "    " and resid 1151 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HG1 ))
  OR 
   (( segid "    " and resid 1149 and name HG1 ))
  OR 
   (( segid "    " and resid 1134 and name HB  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )
      6.000     6.000     0.000 peak  5647 weight  0.10000E+01 volume  0.15300E+00 ppm1      8.417 ppm2      1.546
 ASSI (
   (( segid "    " and resid 1151 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5645 weight  0.10000E+01 volume  0.11500E+00 ppm1      8.416 ppm2      3.451
 ASSI (
   (( segid "    " and resid 1151 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HA  ))
 )
      5.000     5.000     0.000 peak  5638 weight  0.10000E+01 volume  0.59900E+00 ppm1      8.418 ppm2      5.414
 ASSI (
   (( segid "    " and resid 1151 and name HN  ))
 )(
   (( segid "    " and resid 1133 and name HA  ))
 )
      6.000     6.000     0.000 peak  5637 weight  0.10000E+01 volume  0.11500E+00 ppm1      8.415 ppm2      6.018
 ASSI (
   (( segid "    " and resid 1152 and name HN  ))
 )(
   (( segid "    " and resid 1158 and name HA  ))
  OR 
   (( segid "    " and resid 1153 and name HA  ))
  OR 
   (( segid "    " and resid 1109 and name HA  ))
 )
      6.000     6.000     0.000 peak  5622 weight  0.10000E+01 volume  0.12900E+00 ppm1      8.329 ppm2      4.502
 ASSI (
   (( segid "    " and resid 1152 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HA  ))
 )
      6.000     6.000     0.000 peak  5620 weight  0.10000E+01 volume  0.17100E+00 ppm1      8.327 ppm2      5.020
 ASSI (
   (( segid "    " and resid 1152 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HA  ))
 )
      2.700     2.700     0.000 peak  5619 weight  0.10000E+01 volume  0.36200E+01 ppm1      8.331 ppm2      5.414
 ASSI (
   (( segid "    " and resid 1152 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HH2 ))
 )
      5.000     5.000     0.000 peak  5616 weight  0.10000E+01 volume  0.70200E+00 ppm1      8.329 ppm2      6.730
 ASSI (
   (( segid "    " and resid 1152 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HA  ))
 )
      5.000     5.000     0.000 peak  5623 weight  0.10000E+01 volume  0.11380E+01 ppm1      8.329 ppm2      3.936
 ASSI (
   (( segid "    " and resid 1152 and name HN  ))
 )(
   (( segid "    " and resid 1133 and name HB2 ))
  OR 
   (( segid "    " and resid 1133 and name HB1 ))
  OR 
   (( segid "    " and resid 1131 and name HA  ))
 )
      5.000     5.000     0.000 peak  5624 weight  0.10000E+01 volume  0.45900E+00 ppm1      8.333 ppm2      3.787
 ASSI (
   (( segid "    " and resid 1152 and name HN  ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
 )
      6.000     6.000     0.000 peak  5633 weight  0.10000E+01 volume  0.11700E+00 ppm1      8.326 ppm2      0.067
 ASSI (
   (( segid "    " and resid 1152 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
  OR 
   (( segid "    " and resid 1150 and name HG12))
 )
      6.000     6.000     0.000 peak  5632 weight  0.10000E+01 volume  0.14500E+00 ppm1      8.327 ppm2      0.796
 ASSI (
   (( segid "    " and resid 1152 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )
      3.300     3.300     0.000 peak  5630 weight  0.10000E+01 volume  0.19920E+01 ppm1      8.328 ppm2      1.031
 ASSI (
   (( segid "    " and resid 1152 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HG1 ))
  OR 
   (( segid "    " and resid 1149 and name HG1 ))
  OR 
   (( segid "    " and resid 1134 and name HB  ))
  OR 
   (( segid "    " and resid 1131 and name HB3 ))
  OR 
   (( segid "    " and resid 1131 and name HB2 ))
  OR 
   (( segid "    " and resid 1131 and name HB1 ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )
      6.000     6.000     0.000 peak  5628 weight  0.10000E+01 volume  0.19000E+00 ppm1      8.327 ppm2      1.576
 ASSI (
   (( segid "    " and resid 1152 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HB  ))
  OR 
   (( segid "    " and resid 1109 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5629 weight  0.10000E+01 volume  0.13400E+00 ppm1      8.326 ppm2      2.012
 ASSI (
   (( segid "    " and resid 1152 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HB  ))
 )
      5.000     5.000     0.000 peak  5625 weight  0.10000E+01 volume  0.57300E+00 ppm1      8.326 ppm2      3.689
 ASSI (
   (( segid "    " and resid 1152 and name HN  ))
 )(
   (( segid "    " and resid 1158 and name HB2 ))
  OR 
   (( segid "    " and resid 1132 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5626 weight  0.10000E+01 volume  0.13700E+00 ppm1      8.323 ppm2      4.182
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5611 weight  0.10000E+01 volume  0.42100E+00 ppm1      8.715 ppm2      0.910
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )
      6.000     6.000     0.000 peak  5610 weight  0.10000E+01 volume  0.27500E+00 ppm1      8.715 ppm2      1.034
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5609 weight  0.10000E+01 volume  0.77400E+00 ppm1      8.715 ppm2      1.483
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HG2 ))
  OR 
   (( segid "    " and resid 1153 and name HG1 ))
 )
      5.000     5.000     0.000 peak  5608 weight  0.10000E+01 volume  0.86800E+00 ppm1      8.715 ppm2      1.530
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HB2 ))
  OR 
   (( segid "    " and resid 1153 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5607 weight  0.10000E+01 volume  0.26400E+01 ppm1      8.715 ppm2      1.703
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5606 weight  0.10000E+01 volume  0.44000E+00 ppm1      8.714 ppm2      1.846
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HB1 ))
  OR 
   (( segid "    " and resid 1150 and name HB  ))
  OR 
   (( segid "    " and resid 1109 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5605 weight  0.10000E+01 volume  0.18300E+00 ppm1      8.716 ppm2      2.057
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HG2 ))
  OR 
   (( segid "    " and resid 1156 and name HG1 ))
  OR 
   (( segid "    " and resid 1152 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5604 weight  0.10000E+01 volume  0.56800E+00 ppm1      8.715 ppm2      2.299
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HB2 ))
  OR 
   (( segid "    " and resid 1128 and name HB1 ))
  OR 
   (( segid "    " and resid 1113 and name HD2 ))
 )
      6.000     6.000     0.000 peak  5603 weight  0.10000E+01 volume  0.14800E+00 ppm1      8.715 ppm2      2.944
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HD2 ))
  OR 
   (( segid "    " and resid 1153 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5601 weight  0.10000E+01 volume  0.38500E+00 ppm1      8.716 ppm2      3.157
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1155 and name HA2 ))
  OR 
   (( segid "    " and resid 1112 and name HA  ))
 )
      6.000     6.000     0.000 peak  5602 weight  0.10000E+01 volume  0.11700E+00 ppm1      8.715 ppm2      3.301
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HA  ))
 )
      2.700     2.700     0.000 peak  5600 weight  0.10000E+01 volume  0.47800E+01 ppm1      8.715 ppm2      3.924
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1158 and name HB2 ))
  OR 
   (( segid "    " and resid 1154 and name HA  ))
  OR 
   (( segid "    " and resid 1132 and name HB1 ))
  OR 
   (( segid "    " and resid 1108 and name HA  ))
 )
      6.000     6.000     0.000 peak  5599 weight  0.10000E+01 volume  0.21200E+00 ppm1      8.713 ppm2      4.231
 ASSI (
   (( segid "    " and resid 1153 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HA  ))
 )
      3.300     3.300     0.000 peak  5597 weight  0.10000E+01 volume  0.17470E+01 ppm1      8.715 ppm2      4.499
 ASSI (
   (( segid "    " and resid 1154 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HG2 ))
  OR 
   (( segid "    " and resid 1153 and name HG1 ))
 )
      5.000     5.000     0.000 peak  5591 weight  0.10000E+01 volume  0.11250E+01 ppm1      9.185 ppm2      1.501
 ASSI (
   (( segid "    " and resid 1154 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HB2 ))
  OR 
   (( segid "    " and resid 1130 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5589 weight  0.10000E+01 volume  0.56000E+00 ppm1      9.187 ppm2      1.869
 ASSI (
   (( segid "    " and resid 1154 and name HN  ))
 )(
   (( segid "    " and resid 1130 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5588 weight  0.10000E+01 volume  0.43400E+00 ppm1      9.186 ppm2      2.274
 ASSI (
   (( segid "    " and resid 1154 and name HN  ))
 )(
   (( segid "    " and resid 1154 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5587 weight  0.10000E+01 volume  0.13800E+01 ppm1      9.186 ppm2      2.674
 ASSI (
   (( segid "    " and resid 1154 and name HN  ))
 )(
   (( segid "    " and resid 1154 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5586 weight  0.10000E+01 volume  0.12630E+01 ppm1      9.185 ppm2      3.000
 ASSI (
   (( segid "    " and resid 1154 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HD2 ))
 )
      6.000     6.000     0.000 peak  5584 weight  0.10000E+01 volume  0.25800E+00 ppm1      9.185 ppm2      3.134
 ASSI (
   (( segid "    " and resid 1154 and name HN  ))
 )(
   (( segid "    " and resid 1155 and name HA2 ))
 )
      6.000     6.000     0.000 peak  5585 weight  0.10000E+01 volume  0.22400E+00 ppm1      9.184 ppm2      3.287
 ASSI (
   (( segid "    " and resid 1154 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HB1 ))
  OR 
   (( segid "    " and resid 1107 and name HA2 ))
 )
      6.000     6.000     0.000 peak  5583 weight  0.10000E+01 volume  0.35500E+00 ppm1      9.186 ppm2      3.459
 ASSI (
   (( segid "    " and resid 1154 and name HN  ))
 )(
   (( segid "    " and resid 1131 and name HA  ))
  OR 
   (( segid "    " and resid 1107 and name HA1 ))
 )
      5.000     5.000     0.000 peak  5582 weight  0.10000E+01 volume  0.46900E+00 ppm1      9.185 ppm2      3.788
 ASSI (
   (( segid "    " and resid 1154 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HA  ))
  OR 
   (( segid "    " and resid 1130 and name HA  ))
 )
      6.000     6.000     0.000 peak  5581 weight  0.10000E+01 volume  0.26900E+00 ppm1      9.186 ppm2      3.939
 ASSI (
   (( segid "    " and resid 1154 and name HN  ))
 )(
   (( segid "    " and resid 1154 and name HA  ))
 )
      2.700     2.700     0.000 peak  5580 weight  0.10000E+01 volume  0.67790E+01 ppm1      9.183 ppm2      4.246
 ASSI (
   (( segid "    " and resid 1154 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HA  ))
 )
      2.700     2.700     0.000 peak  5579 weight  0.10000E+01 volume  0.72370E+01 ppm1      9.186 ppm2      4.497
 ASSI (
   (( segid "    " and resid 1154 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HN  ))
  OR 
   (( segid "    " and resid 1154 and name HD21))
 )
      5.000     5.000     0.000 peak  5541 weight  0.10000E+01 volume  0.54400E+00 ppm1      9.186 ppm2      7.538
 ASSI (
   (( segid "    " and resid 1154 and name HD21))
 )(
   (( segid "    " and resid 1153 and name HG2 ))
 )
      6.000     6.000     0.000 peak  8823 weight  0.10000E+01 volume  0.15800E+00 ppm1      7.547 ppm2      1.476
 ASSI (
   (( segid "    " and resid 1154 and name HD21))
 )(
   (( segid "    " and resid 1153 and name HG1 ))
 )
      6.000     6.000     0.000 peak  8824 weight  0.10000E+01 volume  0.11100E+00 ppm1      7.548 ppm2      1.559
 ASSI (
   (( segid "    " and resid 1154 and name HD21))
 )(
   (( segid "    " and resid 1153 and name HB2 ))
  OR 
   (( segid "    " and resid 1153 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8825 weight  0.10000E+01 volume  0.29700E+00 ppm1      7.549 ppm2      1.696
 ASSI (
   (( segid "    " and resid 1154 and name HD21))
 )(
   (( segid "    " and resid 1156 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8826 weight  0.10000E+01 volume  0.16200E+00 ppm1      7.548 ppm2      1.803
 ASSI (
   (( segid "    " and resid 1154 and name HD21))
 )(
   (( segid "    " and resid 1154 and name HB2 ))
 )
      3.300     3.300     0.000 peak  8822 weight  0.10000E+01 volume  0.22920E+01 ppm1      7.549 ppm2      2.681
 ASSI (
   (( segid "    " and resid 1154 and name HD21))
 )(
   (( segid "    " and resid 1154 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8821 weight  0.10000E+01 volume  0.12520E+01 ppm1      7.549 ppm2      3.004
 ASSI (
   (( segid "    " and resid 1154 and name HD21))
 )(
   (( segid "    " and resid 1154 and name HA  ))
 )
      6.000     6.000     0.000 peak  8828 weight  0.10000E+01 volume  0.29000E+00 ppm1      7.549 ppm2      4.247
 ASSI (
   (( segid "    " and resid 1154 and name HD22))
 )(
   (( segid "    " and resid 1153 and name HG2 ))
 )
      6.000     6.000     0.000 peak  8836 weight  0.10000E+01 volume  0.24200E+00 ppm1      6.802 ppm2      1.485
 ASSI (
   (( segid "    " and resid 1154 and name HD22))
 )(
   (( segid "    " and resid 1153 and name HB2 ))
  OR 
   (( segid "    " and resid 1153 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8838 weight  0.10000E+01 volume  0.27600E+00 ppm1      6.801 ppm2      1.691
 ASSI (
   (( segid "    " and resid 1154 and name HD22))
 )(
   (( segid "    " and resid 1154 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8833 weight  0.10000E+01 volume  0.86800E+00 ppm1      6.801 ppm2      3.003
 ASSI (
   (( segid "    " and resid 1154 and name HD22))
 )(
   (( segid "    " and resid 1154 and name HA  ))
 )
      6.000     6.000     0.000 peak  8832 weight  0.10000E+01 volume  0.17300E+00 ppm1      6.802 ppm2      4.241
 ASSI (
   (( segid "    " and resid 1155 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HB2 ))
  OR 
   (( segid "    " and resid 1153 and name HB1 ))
  OR 
   (( segid "    " and resid 1108 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5576 weight  0.10000E+01 volume -0.11100E+00 ppm1      7.655 ppm2      1.694
 ASSI (
   (( segid "    " and resid 1155 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HB2 ))
  OR 
   (( segid "    " and resid 1130 and name HG2 ))
  OR 
   (( segid "    " and resid 1130 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5575 weight  0.10000E+01 volume -0.25200E+00 ppm1      7.658 ppm2      1.856
 ASSI (
   (( segid "    " and resid 1155 and name HN  ))
 )(
   (( segid "    " and resid 1130 and name HG1 ))
  OR 
   (( segid "    " and resid 1109 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5574 weight  0.10000E+01 volume -0.14600E+00 ppm1      7.656 ppm2      2.036
 ASSI (
   (( segid "    " and resid 1155 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HG2 ))
  OR 
   (( segid "    " and resid 1156 and name HG1 ))
  OR 
   (( segid "    " and resid 1152 and name HB1 ))
  OR 
   (( segid "    " and resid 1130 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5573 weight  0.10000E+01 volume -0.27600E+00 ppm1      7.657 ppm2      2.283
 ASSI (
   (( segid "    " and resid 1155 and name HN  ))
 )(
   (( segid "    " and resid 1154 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5572 weight  0.10000E+01 volume -0.27900E+00 ppm1      7.651 ppm2      2.682
 ASSI (
   (( segid "    " and resid 1155 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HB2 ))
  OR 
   (( segid "    " and resid 1154 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5571 weight  0.10000E+01 volume -0.33900E+00 ppm1      7.661 ppm2      3.000
 ASSI (
   (( segid "    " and resid 1155 and name HN  ))
 )(
   (( segid "    " and resid 1155 and name HA2 ))
 )
      2.700     2.700     0.000 peak  5570 weight  0.10000E+01 volume -0.32900E+01 ppm1      7.660 ppm2      3.290
 ASSI (
   (( segid "    " and resid 1155 and name HN  ))
 )(
   (( segid "    " and resid 1131 and name HA  ))
  OR 
   (( segid "    " and resid 1107 and name HA1 ))
 )
      5.000     5.000     0.000 peak  5567 weight  0.10000E+01 volume -0.14580E+01 ppm1      7.657 ppm2      3.773
 ASSI (
   (( segid "    " and resid 1155 and name HN  ))
 )(
   (( segid "    " and resid 1155 and name HA1 ))
 )
      3.300     3.300     0.000 peak  5568 weight  0.10000E+01 volume -0.30440E+01 ppm1      7.657 ppm2      3.858
 ASSI (
   (( segid "    " and resid 1155 and name HN  ))
 )(
   (( segid "    " and resid 1154 and name HA  ))
 )
      3.300     3.300     0.000 peak  5566 weight  0.10000E+01 volume -0.25700E+01 ppm1      7.657 ppm2      4.245
 ASSI (
   (( segid "    " and resid 1155 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HA  ))
  OR 
   (( segid "    " and resid 1109 and name HA  ))
 )
      5.000     5.000     0.000 peak  5565 weight  0.10000E+01 volume -0.69500E+00 ppm1      7.656 ppm2      4.504
 ASSI (
   (( segid "    " and resid 1155 and name HN  ))
 )(
   (( segid "    " and resid 1107 and name HN  ))
 )
      6.000     6.000     0.000 peak  5563 weight  0.10000E+01 volume -0.11800E+00 ppm1      7.656 ppm2      8.253
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HG1 ))
 )
      6.000     6.000     0.000 peak  5559 weight  0.10000E+01 volume  0.10600E+00 ppm1      7.544 ppm2      1.547
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HB2 ))
  OR 
   (( segid "    " and resid 1153 and name HB1 ))
  OR 
   (( segid "    " and resid 1108 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5558 weight  0.10000E+01 volume  0.53900E+00 ppm1      7.548 ppm2      1.705
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HB2 ))
 )
      3.300     3.300     0.000 peak  5557 weight  0.10000E+01 volume  0.31920E+01 ppm1      7.545 ppm2      1.832
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HB1 ))
  OR 
   (( segid "    " and resid 1109 and name HB2 ))
 )
      3.300     3.300     0.000 peak  5556 weight  0.10000E+01 volume  0.19870E+01 ppm1      7.545 ppm2      2.076
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HG2 ))
  OR 
   (( segid "    " and resid 1156 and name HG1 ))
  OR 
   (( segid "    " and resid 1152 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5555 weight  0.10000E+01 volume  0.24090E+01 ppm1      7.543 ppm2      2.304
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1154 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5554 weight  0.10000E+01 volume  0.40300E+00 ppm1      7.546 ppm2      2.676
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HB2 ))
  OR 
   (( segid "    " and resid 1154 and name HB1 ))
  OR 
   (( segid "    " and resid 1128 and name HB1 ))
  OR 
   (( segid "    " and resid 1113 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5553 weight  0.10000E+01 volume  0.39100E+00 ppm1      7.546 ppm2      3.000
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1155 and name HA1 ))
 )
      5.000     5.000     0.000 peak  5550 weight  0.10000E+01 volume  0.16960E+01 ppm1      7.545 ppm2      3.872
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HA  ))
  OR 
   (( segid "    " and resid 1130 and name HA  ))
 )
      5.000     5.000     0.000 peak  5549 weight  0.10000E+01 volume  0.67400E+00 ppm1      7.545 ppm2      3.939
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1154 and name HA  ))
  OR 
   (( segid "    " and resid 1108 and name HA  ))
 )
      5.000     5.000     0.000 peak  5548 weight  0.10000E+01 volume  0.55100E+00 ppm1      7.547 ppm2      4.245
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HA  ))
  OR 
   (( segid "    " and resid 1109 and name HA  ))
 )
      5.000     5.000     0.000 peak  5547 weight  0.10000E+01 volume  0.44200E+00 ppm1      7.547 ppm2      4.484
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HA  ))
 )
      3.300     3.300     0.000 peak  5546 weight  0.10000E+01 volume  0.25630E+01 ppm1      7.545 ppm2      4.587
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HB1 ))
  OR 
   (( segid "    " and resid 1107 and name HA2 ))
 )
      6.000     6.000     0.000 peak  5552 weight  0.10000E+01 volume  0.37300E+00 ppm1      7.549 ppm2      3.465
 ASSI (
   (( segid "    " and resid 1156 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HA  ))
 )
      6.000     6.000     0.000 peak  5545 weight  0.10000E+01 volume  0.19800E+00 ppm1      7.546 ppm2      5.018
 ASSI (
   (( segid "    " and resid 1157 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
  OR 
   (( segid "    " and resid 1112 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5514 weight  0.10000E+01 volume  0.32000E+00 ppm1      8.539 ppm2      0.415
 ASSI (
   (( segid "    " and resid 1157 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HB2 ))
  OR 
   (( segid "    " and resid 1113 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5513 weight  0.10000E+01 volume  0.11280E+01 ppm1      8.539 ppm2      1.830
 ASSI (
   (( segid "    " and resid 1157 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HB1 ))
  OR 
   (( segid "    " and resid 1109 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5512 weight  0.10000E+01 volume  0.15310E+01 ppm1      8.540 ppm2      2.075
 ASSI (
   (( segid "    " and resid 1157 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HG2 ))
  OR 
   (( segid "    " and resid 1156 and name HG1 ))
  OR 
   (( segid "    " and resid 1152 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5511 weight  0.10000E+01 volume  0.10250E+01 ppm1      8.540 ppm2      2.300
 ASSI (
   (( segid "    " and resid 1157 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HB2 ))
  OR 
   (( segid "    " and resid 1113 and name HD2 ))
 )
      3.300     3.300     0.000 peak  5510 weight  0.10000E+01 volume  0.25240E+01 ppm1      8.539 ppm2      2.934
 ASSI (
   (( segid "    " and resid 1157 and name HN  ))
 )(
   (( segid "    " and resid 1153 and name HD2 ))
 )
      6.000     6.000     0.000 peak  5509 weight  0.10000E+01 volume  0.19400E+00 ppm1      8.539 ppm2      3.114
 ASSI (
   (( segid "    " and resid 1157 and name HN  ))
 )(
   (( segid "    " and resid 1155 and name HA2 ))
  OR 
   (( segid "    " and resid 1112 and name HA  ))
 )
      6.000     6.000     0.000 peak  5508 weight  0.10000E+01 volume  0.14100E+00 ppm1      8.537 ppm2      3.274
 ASSI (
   (( segid "    " and resid 1157 and name HN  ))
 )(
   (( segid "    " and resid 1155 and name HA1 ))
  OR 
   (( segid "    " and resid 1152 and name HA  ))
 )
      6.000     6.000     0.000 peak  5506 weight  0.10000E+01 volume  0.24600E+00 ppm1      8.543 ppm2      3.923
 ASSI (
   (( segid "    " and resid 1157 and name HN  ))
 )(
   (( segid "    " and resid 1158 and name HA  ))
  OR 
   (( segid "    " and resid 1153 and name HA  ))
 )
      6.000     6.000     0.000 peak  5505 weight  0.10000E+01 volume  0.37900E+00 ppm1      8.539 ppm2      4.483
 ASSI (
   (( segid "    " and resid 1157 and name HN  ))
 )(
   (( segid "    " and resid 1114 and name HA  ))
  OR 
   (( segid "    " and resid 1110 and name HA1 ))
 )
      6.000     6.000     0.000 peak  5503 weight  0.10000E+01 volume  0.29900E+00 ppm1      8.539 ppm2      4.704
 ASSI (
   (( segid "    " and resid 1157 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HD1 ))
 )
      5.000     5.000     0.000 peak  5500 weight  0.10000E+01 volume  0.93700E+00 ppm1      8.538 ppm2      7.109
 ASSI (
   (( segid "    " and resid 1157 and name HN  ))
 )(
   (( segid "    " and resid 1156 and name HN  ))
 )
      5.000     5.000     0.000 peak  5498 weight  0.10000E+01 volume  0.71700E+00 ppm1      8.538 ppm2      7.536
 ASSI (
   (( segid "    " and resid 1157 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HN  ))
 )
      6.000     6.000     0.000 peak  5496 weight  0.10000E+01 volume  0.15300E+00 ppm1      8.538 ppm2      8.300
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1157 and name HN  ))
 )
      6.000     6.000     0.000 peak  5495 weight  0.10000E+01 volume  0.25900E+00 ppm1      9.754 ppm2      8.548
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1152 and name HA  ))
  OR 
   (( segid "    " and resid 1130 and name HA  ))
  OR 
   (( segid "    " and resid 1110 and name HA2 ))
 )
      6.000     6.000     0.000 peak  5525 weight  0.10000E+01 volume  0.27200E+00 ppm1      9.752 ppm2      3.945
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1157 and name HB1 ))
  OR 
   (( segid "    " and resid 1112 and name HD2 ))
 )
      6.000     6.000     0.000 peak  5527 weight  0.10000E+01 volume  0.39200E+00 ppm1      9.749 ppm2      3.439
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1112 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5538 weight  0.10000E+01 volume  0.27400E+00 ppm1      9.750 ppm2      0.342
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
  OR 
   (( segid "    " and resid 1112 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5537 weight  0.10000E+01 volume  0.27200E+00 ppm1      9.750 ppm2      0.420
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1125 and name HB1 ))
  OR 
   (( segid "    " and resid 1112 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5535 weight  0.10000E+01 volume  0.18300E+00 ppm1      9.749 ppm2      1.287
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1134 and name HB  ))
  OR 
   (( segid "    " and resid 1125 and name HG  ))
  OR 
   (( segid "    " and resid 1112 and name HG1 ))
 )
      6.000     6.000     0.000 peak  5534 weight  0.10000E+01 volume  0.11600E+00 ppm1      9.746 ppm2      1.535
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1128 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5532 weight  0.10000E+01 volume  0.37700E+00 ppm1      9.750 ppm2      2.489
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1157 and name HB2 ))
  OR 
   (( segid "    " and resid 1128 and name HB1 ))
  OR 
   (( segid "    " and resid 1113 and name HD2 ))
 )
      5.000     5.000     0.000 peak  5531 weight  0.10000E+01 volume  0.13240E+01 ppm1      9.751 ppm2      2.932
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1155 and name HA2 ))
  OR 
   (( segid "    " and resid 1112 and name HA  ))
 )
      3.300     3.300     0.000 peak  5528 weight  0.10000E+01 volume  0.17690E+01 ppm1      9.749 ppm2      3.260
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1153 and name HA  ))
  OR 
   (( segid "    " and resid 1109 and name HA  ))
 )
      5.000     5.000     0.000 peak  5524 weight  0.10000E+01 volume  0.73200E+00 ppm1      9.752 ppm2      4.521
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1127 and name HA  ))
  OR 
   (( segid "    " and resid 1111 and name HA  ))
  OR 
   (( segid "    " and resid 1110 and name HA1 ))
 )
      6.000     6.000     0.000 peak  5523 weight  0.10000E+01 volume  0.30100E+00 ppm1      9.752 ppm2      4.727
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1157 and name HZ2 ))
 )
      5.000     5.000     0.000 peak  5521 weight  0.10000E+01 volume  0.16170E+01 ppm1      9.749 ppm2      6.513
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1128 and name HE2 ))
  OR 
   (( segid "    " and resid 1128 and name HE1 ))
 )
      6.000     6.000     0.000 peak  5520 weight  0.10000E+01 volume  0.13900E+00 ppm1      9.747 ppm2      6.801
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1131 and name HN  ))
  OR 
   (( segid "    " and resid 1128 and name HN  ))
 )
      6.000     6.000     0.000 peak  5515 weight  0.10000E+01 volume  0.10300E+00 ppm1      9.746 ppm2      8.948
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
  OR 
   (( segid "    " and resid 1112 and name HG2 ))
 )
      6.000     6.000     0.000 peak  5536 weight  0.10000E+01 volume  0.93000E-01 ppm1      9.744 ppm2      1.070
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1157 and name HB1 ))
  OR 
   (( segid "    " and resid 1112 and name HD2 ))
  OR 
   (( segid "    " and resid 1112 and name HD1 ))
 )
      5.000     5.000     0.000 peak  5526 weight  0.10000E+01 volume  0.48600E+00 ppm1      9.750 ppm2      3.501
 ASSI (
   (( segid "    " and resid 1157 and name HE1 ))
 )(
   (( segid "    " and resid 1134 and name HG23))
  OR 
   (( segid "    " and resid 1134 and name HG22))
  OR 
   (( segid "    " and resid 1134 and name HG21))
  OR 
   (( segid "    " and resid 1120 and name HG23))
  OR 
   (( segid "    " and resid 1120 and name HG22))
  OR 
   (( segid "    " and resid 1120 and name HG21))
 )
      6.000     6.000     0.000 peak  5539 weight  0.10000E+01 volume  0.15500E+00 ppm1      9.743 ppm2      0.077
 ASSI (
   (( segid "    " and resid 1158 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HN  ))
  OR 
   (( segid "    " and resid 1134 and name HN  ))
 )
      6.000     6.000     0.000 peak  5467 weight  0.10000E+01 volume  0.37900E+00 ppm1      8.154 ppm2      8.281
 ASSI (
   (( segid "    " and resid 1158 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HD13))
  OR 
   (( segid "    " and resid 1150 and name HD12))
  OR 
   (( segid "    " and resid 1150 and name HD11))
  OR 
   (( segid "    " and resid 1112 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5492 weight  0.10000E+01 volume  0.56300E+00 ppm1      8.153 ppm2      0.417
 ASSI (
   (( segid "    " and resid 1158 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HG23))
  OR 
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
  OR 
   (( segid "    " and resid 1150 and name HG12))
 )
      5.000     5.000     0.000 peak  5491 weight  0.10000E+01 volume  0.46400E+00 ppm1      8.155 ppm2      0.741
 ASSI (
   (( segid "    " and resid 1158 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HG23))
  OR 
   (( segid "    " and resid 1151 and name HG22))
  OR 
   (( segid "    " and resid 1151 and name HG21))
 )
      6.000     6.000     0.000 peak  5490 weight  0.10000E+01 volume  0.13400E+00 ppm1      8.157 ppm2      1.042
 ASSI (
   (( segid "    " and resid 1158 and name HN  ))
 )(
   (( segid "    " and resid 1159 and name HB1 ))
  OR 
   (( segid "    " and resid 1150 and name HB  ))
 )
      5.000     5.000     0.000 peak  5488 weight  0.10000E+01 volume  0.61900E+00 ppm1      8.155 ppm2      2.013
 ASSI (
   (( segid "    " and resid 1158 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HB2 ))
  OR 
   (( segid "    " and resid 1113 and name HD2 ))
 )
      5.000     5.000     0.000 peak  5487 weight  0.10000E+01 volume  0.69900E+00 ppm1      8.155 ppm2      2.933
 ASSI (
   (( segid "    " and resid 1158 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5486 weight  0.10000E+01 volume  0.95800E+00 ppm1      8.155 ppm2      3.466
 ASSI (
   (( segid "    " and resid 1158 and name HN  ))
 )(
   (( segid "    " and resid 1160 and name HD2 ))
  OR 
   (( segid "    " and resid 1151 and name HB  ))
  OR 
   (( segid "    " and resid 1114 and name HD2 ))
 )
      6.000     6.000     0.000 peak  5485 weight  0.10000E+01 volume  0.23900E+00 ppm1      8.158 ppm2      3.676
 ASSI (
   (( segid "    " and resid 1158 and name HN  ))
 )(
   (( segid "    " and resid 1152 and name HA  ))
 )
      5.000     5.000     0.000 peak  5484 weight  0.10000E+01 volume  0.95600E+00 ppm1      8.156 ppm2      3.925
 ASSI (
   (( segid "    " and resid 1158 and name HN  ))
 )(
   (( segid "    " and resid 1159 and name HA  ))
  OR 
   (( segid "    " and resid 1158 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5482 weight  0.10000E+01 volume  0.97200E+00 ppm1      8.156 ppm2      4.362
 ASSI (
   (( segid "    " and resid 1158 and name HN  ))
 )(
   (( segid "    " and resid 1157 and name HA  ))
 )
      2.700     2.700     0.000 peak  5479 weight  0.10000E+01 volume  0.39090E+01 ppm1      8.156 ppm2      5.011
 ASSI (
   (( segid "    " and resid 1158 and name HN  ))
 )(
   (( segid "    " and resid 1151 and name HA  ))
  OR 
   (( segid "    " and resid 1149 and name HA  ))
 )
      6.000     6.000     0.000 peak  5478 weight  0.10000E+01 volume  0.11900E+00 ppm1      8.155 ppm2      5.411
 ASSI (
   (( segid "    " and resid 1158 and name HN  ))
 )(
   (( segid "    " and resid 1160 and name HG2 ))
  OR 
   (( segid "    " and resid 1153 and name HB2 ))
  OR 
   (( segid "    " and resid 1153 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5489 weight  0.10000E+01 volume  0.15800E+00 ppm1      8.152 ppm2      1.712
 ASSI (
   (( segid "    " and resid 1159 and name HN  ))
 )(
   (( segid "    " and resid 1160 and name HG2 ))
  OR 
   (( segid "    " and resid 1113 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5466 weight  0.10000E+01 volume  0.18700E+00 ppm1      7.965 ppm2      1.788
 ASSI (
   (( segid "    " and resid 1159 and name HN  ))
 )(
   (( segid "    " and resid 1160 and name HD2 ))
  OR 
   (( segid "    " and resid 1114 and name HD2 ))
 )
      6.000     6.000     0.000 peak  5462 weight  0.10000E+01 volume  0.36900E+00 ppm1      7.954 ppm2      3.664
 ASSI (
   (( segid "    " and resid 1159 and name HN  ))
 )(
   (( segid "    " and resid 1160 and name HD1 ))
  OR 
   (( segid "    " and resid 1152 and name HA  ))
 )
      5.000     5.000     0.000 peak  5461 weight  0.10000E+01 volume  0.42200E+00 ppm1      7.955 ppm2      3.975
 ASSI (
   (( segid "    " and resid 1159 and name HN  ))
 )(
   (( segid "    " and resid 1158 and name HB2 ))
 )
      3.300     3.300     0.000 peak  5460 weight  0.10000E+01 volume  0.20690E+01 ppm1      7.955 ppm2      4.178
 ASSI (
   (( segid "    " and resid 1159 and name HN  ))
 )(
   (( segid "    " and resid 1159 and name HA  ))
  OR 
   (( segid "    " and resid 1158 and name HB1 ))
 )
      2.700     2.700     0.000 peak  5459 weight  0.10000E+01 volume  0.33320E+01 ppm1      7.954 ppm2      4.375
 ASSI (
   (( segid "    " and resid 1159 and name HN  ))
 )(
   (( segid "    " and resid 1161 and name HA  ))
  OR 
   (( segid "    " and resid 1156 and name HA  ))
  OR 
   (( segid "    " and resid 1150 and name HA  ))
  OR 
   (( segid "    " and resid 1114 and name HA  ))
  OR 
   (( segid "    " and resid 1113 and name HA  ))
 )
      5.000     5.000     0.000 peak  5457 weight  0.10000E+01 volume  0.74500E+00 ppm1      7.956 ppm2      4.620
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1162 and name HE2 ))
  OR 
   (( segid "    " and resid 1162 and name HE1 ))
  OR 
   (( segid "    " and resid 1147 and name HB1 ))
  OR 
   (( segid "    " and resid 1138 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5440 weight  0.10000E+01 volume  0.16100E+00 ppm1      8.035 ppm2      2.957
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      6.000     6.000     0.000 peak  5452 weight  0.10000E+01 volume  0.15700E+00 ppm1      8.039 ppm2      0.171
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      5.000     5.000     0.000 peak  5451 weight  0.10000E+01 volume  0.61900E+00 ppm1      8.041 ppm2      0.573
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1150 and name HG22))
  OR 
   (( segid "    " and resid 1150 and name HG21))
  OR 
   (( segid "    " and resid 1144 and name HD13))
  OR 
   (( segid "    " and resid 1144 and name HD12))
  OR 
   (( segid "    " and resid 1144 and name HD11))
 )
      5.000     5.000     0.000 peak  5450 weight  0.10000E+01 volume  0.40400E+00 ppm1      8.042 ppm2      0.743
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
  OR 
   (( segid "    " and resid 1144 and name HG  ))
 )
      3.300     3.300     0.000 peak  5448 weight  0.10000E+01 volume  0.18040E+01 ppm1      8.041 ppm2      1.335
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1162 and name HB1 ))
  OR 
   (( segid "    " and resid 1144 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5446 weight  0.10000E+01 volume  0.19710E+01 ppm1      8.040 ppm2      1.664
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1161 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5445 weight  0.10000E+01 volume  0.16860E+01 ppm1      8.041 ppm2      1.791
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1145 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5444 weight  0.10000E+01 volume  0.67600E+00 ppm1      8.041 ppm2      1.954
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5443 weight  0.10000E+01 volume  0.16900E+00 ppm1      8.042 ppm2      2.115
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1145 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG1 ))
  OR 
   (( segid "    " and resid 1142 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5442 weight  0.10000E+01 volume  0.33900E+00 ppm1      8.042 ppm2      2.246
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1161 and name HD2 ))
  OR 
   (( segid "    " and resid 1159 and name HG2 ))
  OR 
   (( segid "    " and resid 1159 and name HG1 ))
 )
      6.000     6.000     0.000 peak  5441 weight  0.10000E+01 volume  0.26200E+00 ppm1      8.041 ppm2      2.434
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1161 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5439 weight  0.10000E+01 volume  0.19000E+00 ppm1      8.041 ppm2      3.349
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HA  ))
  OR 
   (( segid "    " and resid 1160 and name HA  ))
  OR 
   (( segid "    " and resid 1159 and name HA  ))
 )
      6.000     6.000     0.000 peak  5437 weight  0.10000E+01 volume  0.29600E+00 ppm1      8.041 ppm2      4.382
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HA  ))
 )
      6.000     6.000     0.000 peak  5434 weight  0.10000E+01 volume  0.10700E+00 ppm1      8.041 ppm2      5.049
 ASSI (
   (( segid "    " and resid 1162 and name HN  ))
 )(
   (( segid "    " and resid 1146 and name HA2 ))
 )
      6.000     6.000     0.000 peak  5438 weight  0.10000E+01 volume  0.15700E+00 ppm1      8.040 ppm2      3.598
 ASSI (
   (( segid "    " and resid 1163 and name HN  ))
 )(
   (( segid "    " and resid 1148 and name HB1 ))
  OR 
   (( segid "    " and resid 1117 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5424 weight  0.10000E+01 volume  0.14700E+00 ppm1      8.991 ppm2      2.075
 ASSI (
   (( segid "    " and resid 1163 and name HN  ))
 )(
   (( segid "    " and resid 1115 and name HD13))
  OR 
   (( segid "    " and resid 1115 and name HD12))
  OR 
   (( segid "    " and resid 1115 and name HD11))
 )
      5.000     5.000     0.000 peak  5431 weight  0.10000E+01 volume  0.57000E+00 ppm1      8.997 ppm2      0.171
 ASSI (
   (( segid "    " and resid 1163 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
  OR 
   (( segid "    " and resid 1144 and name HD23))
  OR 
   (( segid "    " and resid 1144 and name HD22))
  OR 
   (( segid "    " and resid 1144 and name HD21))
 )
      5.000     5.000     0.000 peak  5429 weight  0.10000E+01 volume  0.40400E+00 ppm1      8.999 ppm2      0.628
 ASSI (
   (( segid "    " and resid 1163 and name HN  ))
 )(
   (( segid "    " and resid 1162 and name HG2 ))
  OR 
   (( segid "    " and resid 1162 and name HG1 ))
 )
      5.000     5.000     0.000 peak  5428 weight  0.10000E+01 volume  0.13230E+01 ppm1      8.997 ppm2      1.349
 ASSI (
   (( segid "    " and resid 1163 and name HN  ))
 )(
   (( segid "    " and resid 1161 and name HB1 ))
  OR 
   (( segid "    " and resid 1160 and name HG2 ))
  OR 
   (( segid "    " and resid 1160 and name HG1 ))
  OR 
   (( segid "    " and resid 1148 and name HB2 ))
  OR 
   (( segid "    " and resid 1145 and name HB2 ))
  OR 
   (( segid "    " and resid 1143 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5425 weight  0.10000E+01 volume  0.26300E+00 ppm1      8.995 ppm2      1.793
 ASSI (
   (( segid "    " and resid 1163 and name HN  ))
 )(
   (( segid "    " and resid 1145 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG1 ))
  OR 
   (( segid "    " and resid 1142 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5423 weight  0.10000E+01 volume  0.22500E+00 ppm1      8.998 ppm2      2.260
 ASSI (
   (( segid "    " and resid 1163 and name HN  ))
 )(
   (( segid "    " and resid 1162 and name HE2 ))
  OR 
   (( segid "    " and resid 1162 and name HE1 ))
  OR 
   (( segid "    " and resid 1138 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5420 weight  0.10000E+01 volume  0.22800E+00 ppm1      8.999 ppm2      2.942
 ASSI (
   (( segid "    " and resid 1163 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HA  ))
  OR 
   (( segid "    " and resid 1160 and name HA  ))
  OR 
   (( segid "    " and resid 1142 and name HA  ))
  OR 
   (( segid "    " and resid 1116 and name HA  ))
 )
      6.000     6.000     0.000 peak  5419 weight  0.10000E+01 volume  0.23400E+00 ppm1      8.998 ppm2      4.366
 ASSI (
   (( segid "    " and resid 1163 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
  OR 
   (( segid "    " and resid 1117 and name HD22))
 )
      6.000     6.000     0.000 peak  5415 weight  0.10000E+01 volume  0.18700E+00 ppm1      9.000 ppm2      6.646
 ASSI (
   (( segid "    " and resid 1164 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HB2 ))
  OR 
   (( segid "    " and resid 1138 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5402 weight  0.10000E+01 volume  0.29200E+00 ppm1      9.531 ppm2      2.500
 ASSI (
   (( segid "    " and resid 1164 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
 )
      3.300     3.300     0.000 peak  5408 weight  0.10000E+01 volume  0.20030E+01 ppm1      9.530 ppm2      0.630
 ASSI (
   (( segid "    " and resid 1164 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5404 weight  0.10000E+01 volume  0.23140E+01 ppm1      9.529 ppm2      1.626
 ASSI (
   (( segid "    " and resid 1164 and name HN  ))
 )(
   (( segid "    " and resid 1220 and name HB2 ))
  OR 
   (( segid "    " and resid 1145 and name HB2 ))
  OR 
   (( segid "    " and resid 1143 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5405 weight  0.10000E+01 volume  0.43300E+00 ppm1      9.528 ppm2      1.788
 ASSI (
   (( segid "    " and resid 1164 and name HN  ))
 )(
   (( segid "    " and resid 1166 and name HD2 ))
  OR 
   (( segid "    " and resid 1145 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5406 weight  0.10000E+01 volume  0.20500E+00 ppm1      9.534 ppm2      1.952
 ASSI (
   (( segid "    " and resid 1164 and name HN  ))
 )(
   (( segid "    " and resid 1145 and name HG2 ))
  OR 
   (( segid "    " and resid 1145 and name HG1 ))
  OR 
   (( segid "    " and resid 1142 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5403 weight  0.10000E+01 volume  0.36900E+00 ppm1      9.531 ppm2      2.246
 ASSI (
   (( segid "    " and resid 1164 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5401 weight  0.10000E+01 volume  0.28500E+00 ppm1      9.530 ppm2      2.786
 ASSI (
   (( segid "    " and resid 1164 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HA  ))
  OR 
   (( segid "    " and resid 1142 and name HA  ))
 )
      5.000     5.000     0.000 peak  5400 weight  0.10000E+01 volume  0.65900E+00 ppm1      9.532 ppm2      4.345
 ASSI (
   (( segid "    " and resid 1164 and name HN  ))
 )(
   (( segid "    " and resid 1220 and name HA  ))
  OR 
   (( segid "    " and resid 1162 and name HA  ))
  OR 
   (( segid "    " and resid 1146 and name HA1 ))
  OR 
   (( segid "    " and resid 1137 and name HA  ))
  OR 
   (( segid "    " and resid 1118 and name HA1 ))
 )
      6.000     6.000     0.000 peak  5399 weight  0.10000E+01 volume  0.33600E+00 ppm1      9.532 ppm2      4.494
 ASSI (
   (( segid "    " and resid 1165 and name HN  ))
 )(
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )
      6.000     6.000     0.000 peak  5392 weight  0.10000E+01 volume  0.13500E+00 ppm1      9.774 ppm2      0.386
 ASSI (
   (( segid "    " and resid 1165 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
 )
      5.000     5.000     0.000 peak  5391 weight  0.10000E+01 volume  0.12110E+01 ppm1      9.778 ppm2      0.641
 ASSI (
   (( segid "    " and resid 1165 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5390 weight  0.10000E+01 volume  0.38400E+00 ppm1      9.776 ppm2      1.120
 ASSI (
   (( segid "    " and resid 1165 and name HN  ))
 )(
   (( segid "    " and resid 1164 and name HB1 ))
  OR 
   (( segid "    " and resid 1162 and name HD1 ))
 )
      5.000     5.000     0.000 peak  5389 weight  0.10000E+01 volume  0.55200E+00 ppm1      9.776 ppm2      1.625
 ASSI (
   (( segid "    " and resid 1165 and name HN  ))
 )(
   (( segid "    " and resid 1220 and name HB2 ))
  OR 
   (( segid "    " and resid 1166 and name HB2 ))
  OR 
   (( segid "    " and resid 1162 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5388 weight  0.10000E+01 volume  0.35100E+00 ppm1      9.780 ppm2      1.733
 ASSI (
   (( segid "    " and resid 1165 and name HN  ))
 )(
   (( segid "    " and resid 1163 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5386 weight  0.10000E+01 volume  0.64600E+00 ppm1      9.775 ppm2      2.480
 ASSI (
   (( segid "    " and resid 1165 and name HN  ))
 )(
   (( segid "    " and resid 1166 and name HD1 ))
  OR 
   (( segid "    " and resid 1162 and name HE2 ))
  OR 
   (( segid "    " and resid 1162 and name HE1 ))
  OR 
   (( segid "    " and resid 1138 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5385 weight  0.10000E+01 volume  0.15400E+00 ppm1      9.772 ppm2      2.922
 ASSI (
   (( segid "    " and resid 1165 and name HN  ))
 )(
   (( segid "    " and resid 1142 and name HD2 ))
  OR 
   (( segid "    " and resid 1142 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5377 weight  0.10000E+01 volume  0.12100E+00 ppm1      9.773 ppm2      6.652
 ASSI (
   (( segid "    " and resid 1165 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HB2 ))
  OR 
   (( segid "    " and resid 1222 and name HB1 ))
  OR 
   (( segid "    " and resid 1168 and name HB  ))
  OR 
   (( segid "    " and resid 1166 and name HD2 ))
  OR 
   (( segid "    " and resid 1145 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5387 weight  0.10000E+01 volume  0.14600E+00 ppm1      9.779 ppm2      1.938
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1166 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5341 weight  0.10000E+01 volume  0.19800E+00 ppm1      9.414 ppm2      2.901
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1193 and name HN  ))
 )
      6.000     6.000     0.000 peak  5317 weight  0.10000E+01 volume  0.18400E+00 ppm1      9.417 ppm2      9.039
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
  OR 
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
  OR 
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )
      6.000     6.000     0.000 peak  5339 weight  0.10000E+01 volume  0.25100E+00 ppm1      9.417 ppm2      0.395
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )
      6.000     6.000     0.000 peak  5338 weight  0.10000E+01 volume  0.15700E+00 ppm1      9.418 ppm2      0.652
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1168 and name HG23))
  OR 
   (( segid "    " and resid 1168 and name HG22))
  OR 
   (( segid "    " and resid 1168 and name HG21))
  OR 
   (( segid "    " and resid 1168 and name HG13))
  OR 
   (( segid "    " and resid 1168 and name HG12))
  OR 
   (( segid "    " and resid 1168 and name HG11))
 )
      6.000     6.000     0.000 peak  5337 weight  0.10000E+01 volume  0.18500E+00 ppm1      9.416 ppm2      0.803
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HB2 ))
  OR 
   (( segid "    " and resid 1164 and name HB2 ))
  OR 
   (( segid "    " and resid 1141 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5336 weight  0.10000E+01 volume  0.19400E+00 ppm1      9.416 ppm2      1.163
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1166 and name HG2 ))
  OR 
   (( segid "    " and resid 1141 and name HG  ))
 )
      6.000     6.000     0.000 peak  5335 weight  0.10000E+01 volume  0.26600E+00 ppm1      9.414 ppm2      1.385
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1192 and name HB2 ))
  OR 
   (( segid "    " and resid 1166 and name HG1 ))
 )
      6.000     6.000     0.000 peak  5334 weight  0.10000E+01 volume  0.32100E+00 ppm1      9.417 ppm2      1.492
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1192 and name HB1 ))
  OR 
   (( segid "    " and resid 1164 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5333 weight  0.10000E+01 volume  0.24800E+00 ppm1      9.415 ppm2      1.649
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1166 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5332 weight  0.10000E+01 volume  0.92800E+00 ppm1      9.417 ppm2      1.767
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HB2 ))
  OR 
   (( segid "    " and resid 1222 and name HB1 ))
  OR 
   (( segid "    " and resid 1168 and name HB  ))
 )
      6.000     6.000     0.000 peak  5340 weight  0.10000E+01 volume  0.25400E+00 ppm1      9.414 ppm2      1.922
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1166 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5331 weight  0.10000E+01 volume  0.83200E+00 ppm1      9.418 ppm2      2.192
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1193 and name HA  ))
  OR 
   (( segid "    " and resid 1141 and name HA  ))
 )
      6.000     6.000     0.000 peak  5328 weight  0.10000E+01 volume  0.16800E+00 ppm1      9.410 ppm2      3.665
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1190 and name HA  ))
 )
      6.000     6.000     0.000 peak  5322 weight  0.10000E+01 volume  0.27700E+00 ppm1      9.416 ppm2      5.332
 ASSI (
   (( segid "    " and resid 1167 and name HN  ))
 )(
   (( segid "    " and resid 1168 and name HN  ))
 )
      6.000     6.000     0.000 peak  5295 weight  0.10000E+01 volume  0.34100E+00 ppm1      9.414 ppm2      8.533
 ASSI (
   (( segid "    " and resid 1168 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
  OR 
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      6.000     6.000     0.000 peak  5314 weight  0.10000E+01 volume  0.18700E+00 ppm1      8.533 ppm2      0.660
 ASSI (
   (( segid "    " and resid 1168 and name HN  ))
 )(
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5301 weight  0.10000E+01 volume  0.10800E+00 ppm1      8.525 ppm2      6.840
 ASSI (
   (( segid "    " and resid 1168 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HG  ))
 )
      6.000     6.000     0.000 peak  5312 weight  0.10000E+01 volume  0.18000E+00 ppm1      8.533 ppm2      1.082
 ASSI (
   (( segid "    " and resid 1168 and name HN  ))
 )(
   (( segid "    " and resid 1222 and name HG2 ))
  OR 
   (( segid "    " and resid 1222 and name HG1 ))
  OR 
   (( segid "    " and resid 1169 and name HG11))
  OR 
   (( segid "    " and resid 1166 and name HG2 ))
 )
      6.000     6.000     0.000 peak  5311 weight  0.10000E+01 volume  0.15000E+00 ppm1      8.538 ppm2      1.382
 ASSI (
   (( segid "    " and resid 1168 and name HN  ))
 )(
   (( segid "    " and resid 1166 and name HD2 ))
 )
      6.000     6.000     0.000 peak  5310 weight  0.10000E+01 volume  0.13000E+00 ppm1      8.533 ppm2      2.022
 ASSI (
   (( segid "    " and resid 1168 and name HN  ))
 )(
   (( segid "    " and resid 1220 and name HB1 ))
  OR 
   (( segid "    " and resid 1218 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5306 weight  0.10000E+01 volume  0.96000E-01 ppm1      8.527 ppm2      3.072
 ASSI (
   (( segid "    " and resid 1168 and name HN  ))
 )(
   (( segid "    " and resid 1221 and name HA1 ))
  OR 
   (( segid "    " and resid 1165 and name HA  ))
 )
      6.000     6.000     0.000 peak  5304 weight  0.10000E+01 volume  0.24500E+00 ppm1      8.536 ppm2      4.045
 ASSI (
   (( segid "    " and resid 1168 and name HN  ))
 )(
   (( segid "    " and resid 1167 and name HA  ))
 )
      2.700     2.700     0.000 peak  5302 weight  0.10000E+01 volume  0.38370E+01 ppm1      8.527 ppm2      4.774
 ASSI (
   (( segid "    " and resid 1168 and name HN  ))
 )(
   (( segid "    " and resid 1192 and name HN  ))
  OR 
   (( segid "    " and resid 1191 and name HN  ))
 )
      6.000     6.000     0.000 peak  5297 weight  0.10000E+01 volume  0.19400E+00 ppm1      8.534 ppm2      8.805
 ASSI (
   (( segid "    " and resid 1168 and name HN  ))
 )(
   (( segid "    " and resid 1220 and name HN  ))
  OR 
   (( segid "    " and resid 1219 and name HN  ))
 )
      6.000     6.000     0.000 peak  5299 weight  0.10000E+01 volume  0.15700E+00 ppm1      8.533 ppm2      8.918
 ASSI (
   (( segid "    " and resid 1168 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
 )
      6.000     6.000     0.000 peak  5316 weight  0.10000E+01 volume  0.12200E+00 ppm1      8.533 ppm2      0.387
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HG  ))
  OR 
   (( segid "    " and resid 1189 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5286 weight  0.10000E+01 volume  0.43200E+00 ppm1      8.214 ppm2      1.526
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1190 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5278 weight  0.10000E+01 volume  0.19200E+00 ppm1      8.220 ppm2      6.823
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      5.000     5.000     0.000 peak  5291 weight  0.10000E+01 volume  0.91600E+00 ppm1      8.220 ppm2      0.680
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HD13))
  OR 
   (( segid "    " and resid 1189 and name HD12))
  OR 
   (( segid "    " and resid 1189 and name HD11))
  OR 
   (( segid "    " and resid 1169 and name HG12))
 )
      5.000     5.000     0.000 peak  5289 weight  0.10000E+01 volume  0.98000E+00 ppm1      8.220 ppm2      0.914
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )
      5.000     5.000     0.000 peak  5288 weight  0.10000E+01 volume  0.11350E+01 ppm1      8.220 ppm2      1.011
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1169 and name HG11))
 )
      5.000     5.000     0.000 peak  5287 weight  0.10000E+01 volume  0.11220E+01 ppm1      8.221 ppm2      1.350
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1169 and name HB  ))
 )
      3.300     3.300     0.000 peak  5285 weight  0.10000E+01 volume  0.23460E+01 ppm1      8.217 ppm2      1.686
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1171 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HB1 ))
  OR 
   (( segid "    " and resid 1168 and name HB  ))
 )
      5.000     5.000     0.000 peak  5284 weight  0.10000E+01 volume  0.49200E+00 ppm1      8.216 ppm2      1.879
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1167 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5283 weight  0.10000E+01 volume  0.23400E+00 ppm1      8.217 ppm2      2.714
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HA  ))
 )
      5.000     5.000     0.000 peak  5280 weight  0.10000E+01 volume  0.82500E+00 ppm1      8.222 ppm2      4.316
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1218 and name HB2 ))
  OR 
   (( segid "    " and resid 1190 and name HB2 ))
  OR 
   (( segid "    " and resid 1190 and name HB1 ))
  OR 
   (( segid "    " and resid 1167 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5282 weight  0.10000E+01 volume  0.26000E+00 ppm1      8.215 ppm2      2.796
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1190 and name HN  ))
  OR 
   (( segid "    " and resid 1173 and name HN  ))
 )
      6.000     6.000     0.000 peak  5276 weight  0.10000E+01 volume  0.12000E+00 ppm1      8.213 ppm2      7.357
 ASSI (
   (( segid "    " and resid 1169 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
  OR 
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )
      6.000     6.000     0.000 peak  5292 weight  0.10000E+01 volume  0.18900E+00 ppm1      8.221 ppm2      0.525
 ASSI (
   (( segid "    " and resid 1170 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )
      6.000     6.000     0.000 peak  5271 weight  0.10000E+01 volume  0.16300E+00 ppm1      7.924 ppm2     -0.437
 ASSI (
   (( segid "    " and resid 1170 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
  OR 
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )
      6.000     6.000     0.000 peak  5269 weight  0.10000E+01 volume  0.21700E+00 ppm1      7.924 ppm2      0.505
 ASSI (
   (( segid "    " and resid 1170 and name HN  ))
 )(
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      5.000     5.000     0.000 peak  5267 weight  0.10000E+01 volume  0.82800E+00 ppm1      7.923 ppm2      0.658
 ASSI (
   (( segid "    " and resid 1170 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
  OR 
   (( segid "    " and resid 1173 and name HG12))
  OR 
   (( segid "    " and resid 1168 and name HG23))
  OR 
   (( segid "    " and resid 1168 and name HG22))
  OR 
   (( segid "    " and resid 1168 and name HG21))
  OR 
   (( segid "    " and resid 1168 and name HG13))
  OR 
   (( segid "    " and resid 1168 and name HG12))
  OR 
   (( segid "    " and resid 1168 and name HG11))
 )
      5.000     5.000     0.000 peak  5268 weight  0.10000E+01 volume  0.44500E+00 ppm1      7.922 ppm2      0.777
 ASSI (
   (( segid "    " and resid 1170 and name HN  ))
 )(
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )
      3.300     3.300     0.000 peak  5265 weight  0.10000E+01 volume  0.22920E+01 ppm1      7.924 ppm2      1.012
 ASSI (
   (( segid "    " and resid 1170 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HB2 ))
  OR 
   (( segid "    " and resid 1173 and name HB  ))
 )
      5.000     5.000     0.000 peak  5266 weight  0.10000E+01 volume  0.53600E+00 ppm1      7.924 ppm2      1.113
 ASSI (
   (( segid "    " and resid 1170 and name HN  ))
 )(
   (( segid "    " and resid 1169 and name HB  ))
 )
      6.000     6.000     0.000 peak  5264 weight  0.10000E+01 volume  0.39700E+00 ppm1      7.923 ppm2      1.676
 ASSI (
   (( segid "    " and resid 1170 and name HN  ))
 )(
   (( segid "    " and resid 1174 and name HG1 ))
 )
      6.000     6.000     0.000 peak  5263 weight  0.10000E+01 volume  0.13800E+00 ppm1      7.923 ppm2      2.840
 ASSI (
   (( segid "    " and resid 1170 and name HN  ))
 )(
   (( segid "    " and resid 1169 and name HA  ))
 )
      2.700     2.700     0.000 peak  5260 weight  0.10000E+01 volume  0.44270E+01 ppm1      7.923 ppm2      4.146
 ASSI (
   (( segid "    " and resid 1170 and name HN  ))
 )(
   (( segid "    " and resid 1225 and name HE2 ))
  OR 
   (( segid "    " and resid 1225 and name HE1 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )
      5.000     5.000     0.000 peak  5257 weight  0.10000E+01 volume  0.75500E+00 ppm1      7.924 ppm2      6.704
 ASSI (
   (( segid "    " and resid 1170 and name HN  ))
 )(
   (( segid "    " and resid 1225 and name HD2 ))
  OR 
   (( segid "    " and resid 1225 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5258 weight  0.10000E+01 volume  0.25700E+00 ppm1      7.922 ppm2      6.788
 ASSI (
   (( segid "    " and resid 1170 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
  OR 
   (( segid "    " and resid 1179 and name HD13))
  OR 
   (( segid "    " and resid 1179 and name HD12))
  OR 
   (( segid "    " and resid 1179 and name HD11))
 )
      6.000     6.000     0.000 peak  5270 weight  0.10000E+01 volume  0.18400E+00 ppm1      7.927 ppm2      0.394
 ASSI (
   (( segid "    " and resid 1171 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
  OR 
   (( segid "    " and resid 1173 and name HG12))
  OR 
   (( segid "    " and resid 1168 and name HG23))
 )
      6.000     6.000     0.000 peak  5252 weight  0.10000E+01 volume  0.38800E+00 ppm1      8.989 ppm2      0.792
 ASSI (
   (( segid "    " and resid 1171 and name HN  ))
 )(
   (( segid "    " and resid 1171 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5248 weight  0.10000E+01 volume  0.88100E+00 ppm1      8.992 ppm2      1.651
 ASSI (
   (( segid "    " and resid 1171 and name HN  ))
 )(
   (( segid "    " and resid 1171 and name HG1 ))
 )
      2.700     2.700     0.000 peak  5250 weight  0.10000E+01 volume  0.36130E+01 ppm1      8.989 ppm2      1.804
 ASSI (
   (( segid "    " and resid 1171 and name HN  ))
 )(
   (( segid "    " and resid 1187 and name HG2 ))
  OR 
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
  OR 
   (( segid "    " and resid 1172 and name HG2 ))
  OR 
   (( segid "    " and resid 1172 and name HG1 ))
 )
      6.000     6.000     0.000 peak  5246 weight  0.10000E+01 volume  0.35700E+00 ppm1      8.991 ppm2      2.191
 ASSI (
   (( segid "    " and resid 1171 and name HN  ))
 )(
   (( segid "    " and resid 1170 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5245 weight  0.10000E+01 volume  0.38800E+00 ppm1      8.991 ppm2      3.702
 ASSI (
   (( segid "    " and resid 1171 and name HN  ))
 )(
   (( segid "    " and resid 1172 and name HA  ))
  OR 
   (( segid "    " and resid 1170 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5244 weight  0.10000E+01 volume  0.57200E+00 ppm1      8.989 ppm2      3.918
 ASSI (
   (( segid "    " and resid 1171 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HA  ))
  OR 
   (( segid "    " and resid 1171 and name HD2 ))
  OR 
   (( segid "    " and resid 1171 and name HD1 ))
 )
      5.000     5.000     0.000 peak  5240 weight  0.10000E+01 volume  0.69900E+00 ppm1      8.992 ppm2      3.210
 ASSI (
   (( segid "    " and resid 1173 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
 )
      5.000     5.000     0.000 peak  5237 weight  0.10000E+01 volume  0.71600E+00 ppm1      7.357 ppm2      0.645
 ASSI (
   (( segid "    " and resid 1173 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
  OR 
   (( segid "    " and resid 1173 and name HG12))
  OR 
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      5.000     5.000     0.000 peak  5236 weight  0.10000E+01 volume  0.74400E+00 ppm1      7.358 ppm2      0.729
 ASSI (
   (( segid "    " and resid 1173 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HG11))
 )
      5.000     5.000     0.000 peak  5234 weight  0.10000E+01 volume  0.12590E+01 ppm1      7.357 ppm2      1.307
 ASSI (
   (( segid "    " and resid 1173 and name HN  ))
 )(
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
  OR 
   (( segid "    " and resid 1172 and name HG2 ))
  OR 
   (( segid "    " and resid 1172 and name HG1 ))
 )
      5.000     5.000     0.000 peak  5233 weight  0.10000E+01 volume  0.42300E+00 ppm1      7.357 ppm2      2.196
 ASSI (
   (( segid "    " and resid 1173 and name HN  ))
 )(
   (( segid "    " and resid 1176 and name HB2 ))
  OR 
   (( segid "    " and resid 1176 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5230 weight  0.10000E+01 volume  0.13500E+00 ppm1      7.358 ppm2      2.625
 ASSI (
   (( segid "    " and resid 1173 and name HN  ))
 )(
   (( segid "    " and resid 1170 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5228 weight  0.10000E+01 volume  0.51900E+00 ppm1      7.356 ppm2      3.704
 ASSI (
   (( segid "    " and resid 1173 and name HN  ))
 )(
   (( segid "    " and resid 1172 and name HA  ))
  OR 
   (( segid "    " and resid 1170 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5227 weight  0.10000E+01 volume  0.56700E+00 ppm1      7.357 ppm2      3.903
 ASSI (
   (( segid "    " and resid 1173 and name HN  ))
 )(
   (( segid "    " and resid 1225 and name HE2 ))
  OR 
   (( segid "    " and resid 1225 and name HE1 ))
 )
      6.000     6.000     0.000 peak  5239 weight  0.10000E+01 volume  0.15300E+00 ppm1      7.355 ppm2      6.737
 ASSI (
   (( segid "    " and resid 1173 and name HN  ))
 )(
   (( segid "    " and resid 1175 and name HN  ))
 )
      6.000     6.000     0.000 peak  5207 weight  0.10000E+01 volume  0.18000E+00 ppm1      7.356 ppm2      7.798
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
  OR 
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      6.000     6.000     0.000 peak  5191 weight  0.10000E+01 volume  0.38500E+00 ppm1      7.442 ppm2      0.653
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
  OR 
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG21))
  OR 
   (( segid "    " and resid 1173 and name HG12))
  OR 
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      6.000     6.000     0.000 peak  5192 weight  0.10000E+01 volume  0.27700E+00 ppm1      7.437 ppm2      0.731
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HG12))
  OR 
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )
      5.000     5.000     0.000 peak  5195 weight  0.10000E+01 volume  0.53200E+00 ppm1      7.441 ppm2      1.002
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HG11))
  OR 
   (( segid "    " and resid 1173 and name HB  ))
 )
      5.000     5.000     0.000 peak  5194 weight  0.10000E+01 volume  0.13070E+01 ppm1      7.441 ppm2      1.110
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HG11))
 )
      6.000     6.000     0.000 peak  5193 weight  0.10000E+01 volume  0.22000E+00 ppm1      7.437 ppm2      1.311
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HB  ))
  OR 
   (( segid "    " and resid 1172 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HG1 ))
  OR 
   (( segid "    " and resid 1171 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5199 weight  0.10000E+01 volume  0.36600E+00 ppm1      7.439 ppm2      1.831
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1174 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5198 weight  0.10000E+01 volume  0.11320E+01 ppm1      7.441 ppm2      1.989
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5197 weight  0.10000E+01 volume  0.13390E+01 ppm1      7.441 ppm2      2.067
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5196 weight  0.10000E+01 volume  0.23270E+01 ppm1      7.441 ppm2      2.202
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1174 and name HG1 ))
 )
      5.000     5.000     0.000 peak  5200 weight  0.10000E+01 volume  0.14560E+01 ppm1      7.440 ppm2      2.840
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HA  ))
 )
      5.000     5.000     0.000 peak  5201 weight  0.10000E+01 volume  0.42300E+00 ppm1      7.440 ppm2      3.180
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1177 and name HB1 ))
  OR 
   (( segid "    " and resid 1170 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5202 weight  0.10000E+01 volume  0.35200E+00 ppm1      7.438 ppm2      3.703
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1225 and name HE2 ))
  OR 
   (( segid "    " and resid 1225 and name HE1 ))
 )
      6.000     6.000     0.000 peak  5206 weight  0.10000E+01 volume  0.30800E+00 ppm1      7.441 ppm2      6.708
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1199 and name HE1 ))
 )
      6.000     6.000     0.000 peak  5185 weight  0.10000E+01 volume  0.29500E+00 ppm1      7.437 ppm2      7.177
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1172 and name HN  ))
 )
      6.000     6.000     0.000 peak  5179 weight  0.10000E+01 volume  0.22300E+00 ppm1      7.441 ppm2      8.320
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HG23))
  OR 
   (( segid "    " and resid 1173 and name HG22))
  OR 
   (( segid "    " and resid 1173 and name HG21))
 )
      5.000     5.000     0.000 peak  5189 weight  0.10000E+01 volume  0.47200E+00 ppm1      7.439 ppm2     -0.427
 ASSI (
   (( segid "    " and resid 1174 and name HN  ))
 )(
   (( segid "    " and resid 1175 and name HA  ))
  OR 
   (( segid "    " and resid 1172 and name HA  ))
  OR 
   (( segid "    " and resid 1170 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5188 weight  0.10000E+01 volume  0.31600E+00 ppm1      7.439 ppm2      3.940
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HG12))
  OR 
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
 )
      6.000     6.000     0.000 peak  5220 weight  0.10000E+01 volume  0.18400E+00 ppm1      7.787 ppm2      1.016
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HG11))
  OR 
   (( segid "    " and resid 1173 and name HB  ))
 )
      6.000     6.000     0.000 peak  5219 weight  0.10000E+01 volume  0.28200E+00 ppm1      7.786 ppm2      1.116
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HB  ))
  OR 
   (( segid "    " and resid 1172 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HG1 ))
  OR 
   (( segid "    " and resid 1171 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5218 weight  0.10000E+01 volume  0.35100E+00 ppm1      7.785 ppm2      1.814
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5216 weight  0.10000E+01 volume  0.18850E+01 ppm1      7.786 ppm2      2.221
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( segid "    " and resid 1187 and name HG1 ))
  OR 
   (( segid "    " and resid 1175 and name HG2 ))
  OR 
   (( segid "    " and resid 1175 and name HG1 ))
 )
      3.300     3.300     0.000 peak  5215 weight  0.10000E+01 volume  0.18450E+01 ppm1      7.787 ppm2      2.325
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( segid "    " and resid 1176 and name HB2 ))
  OR 
   (( segid "    " and resid 1176 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5214 weight  0.10000E+01 volume  0.38400E+00 ppm1      7.787 ppm2      2.606
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( segid "    " and resid 1174 and name HG1 ))
 )
      5.000     5.000     0.000 peak  5213 weight  0.10000E+01 volume  0.44300E+00 ppm1      7.787 ppm2      2.833
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HA  ))
  OR 
   (( segid "    " and resid 1171 and name HD2 ))
  OR 
   (( segid "    " and resid 1171 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5212 weight  0.10000E+01 volume  0.29200E+00 ppm1      7.786 ppm2      3.186
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( segid "    " and resid 1174 and name HA  ))
 )
      6.000     6.000     0.000 peak  5211 weight  0.10000E+01 volume  0.38600E+00 ppm1      7.787 ppm2      3.482
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( segid "    " and resid 1175 and name HA  ))
  OR 
   (( segid "    " and resid 1172 and name HA  ))
 )
      3.300     3.300     0.000 peak  5208 weight  0.10000E+01 volume  0.26410E+01 ppm1      7.787 ppm2      3.944
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( segid "    " and resid 1171 and name HA  ))
 )
      5.000     5.000     0.000 peak  5209 weight  0.10000E+01 volume  0.59100E+00 ppm1      7.787 ppm2      4.090
 ASSI (
   (( segid "    " and resid 1175 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HA  ))
  OR 
   (( segid "    " and resid 1188 and name HA  ))
  OR 
   (( segid "    " and resid 1181 and name HA  ))
  OR 
   (( segid "    " and resid 1176 and name HA  ))
 )
      6.000     6.000     0.000 peak  5210 weight  0.10000E+01 volume  0.23400E+00 ppm1      7.791 ppm2      4.365
 ASSI (
   (( segid "    " and resid 1176 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
 )
      6.000     6.000     0.000 peak  5181 weight  0.10000E+01 volume  0.14600E+00 ppm1      7.540 ppm2      0.640
 ASSI (
   (( segid "    " and resid 1176 and name HN  ))
 )(
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
  OR 
   (( segid "    " and resid 1172 and name HG2 ))
  OR 
   (( segid "    " and resid 1172 and name HG1 ))
 )
      5.000     5.000     0.000 peak  5177 weight  0.10000E+01 volume  0.42400E+00 ppm1      7.539 ppm2      2.228
 ASSI (
   (( segid "    " and resid 1176 and name HN  ))
 )(
   (( segid "    " and resid 1175 and name HG2 ))
  OR 
   (( segid "    " and resid 1175 and name HG1 ))
 )
      5.000     5.000     0.000 peak  5176 weight  0.10000E+01 volume  0.40300E+00 ppm1      7.538 ppm2      2.330
 ASSI (
   (( segid "    " and resid 1176 and name HN  ))
 )(
   (( segid "    " and resid 1180 and name HA  ))
  OR 
   (( segid "    " and resid 1177 and name HA  ))
  OR 
   (( segid "    " and resid 1170 and name HA  ))
 )
      6.000     6.000     0.000 peak  5171 weight  0.10000E+01 volume  0.16400E+00 ppm1      7.538 ppm2      4.721
 ASSI (
   (( segid "    " and resid 1176 and name HN  ))
 )(
   (( segid "    " and resid 1178 and name HD22))
  OR 
   (( segid "    " and resid 1177 and name HD2 ))
  OR 
   (( segid "    " and resid 1177 and name HD1 ))
  OR 
   (( segid "    " and resid 1176 and name HD22))
 )
      5.000     5.000     0.000 peak  5170 weight  0.10000E+01 volume  0.40200E+00 ppm1      7.540 ppm2      6.809
 ASSI (
   (( segid "    " and resid 1176 and name HN  ))
 )(
   (( segid "    " and resid 1176 and name HD21))
 )
      6.000     6.000     0.000 peak  5169 weight  0.10000E+01 volume  0.33800E+00 ppm1      7.539 ppm2      6.984
 ASSI (
   (( segid "    " and resid 1176 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HG11))
  OR 
   (( segid "    " and resid 1173 and name HB  ))
 )
      6.000     6.000     0.000 peak  5180 weight  0.10000E+01 volume  0.15200E+00 ppm1      7.538 ppm2      1.120
 ASSI (
   (( segid "    " and resid 1176 and name HN  ))
 )(
   (( segid "    " and resid 1177 and name HB1 ))
  OR 
   (( segid "    " and resid 1170 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5182 weight  0.10000E+01 volume  0.10100E+00 ppm1      7.540 ppm2      3.675
 ASSI (
   (( segid "    " and resid 1176 and name HD21))
 )(
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
 )
      6.000     6.000     0.000 peak  8510 weight  0.10000E+01 volume  0.24400E+00 ppm1      6.984 ppm2      0.640
 ASSI (
   (( segid "    " and resid 1176 and name HD21))
 )(
   (( segid "    " and resid 1172 and name HG2 ))
  OR 
   (( segid "    " and resid 1172 and name HG1 ))
 )
      6.000     6.000     0.000 peak  8503 weight  0.10000E+01 volume  0.29900E+00 ppm1      6.976 ppm2      2.194
 ASSI (
   (( segid "    " and resid 1176 and name HD21))
 )(
   (( segid "    " and resid 1173 and name HA  ))
 )
      5.000     5.000     0.000 peak  8505 weight  0.10000E+01 volume  0.41700E+00 ppm1      6.981 ppm2      3.183
 ASSI (
   (( segid "    " and resid 1176 and name HD21))
 )(
   (( segid "    " and resid 1176 and name HA  ))
 )
      6.000     6.000     0.000 peak  8442 weight  0.10000E+01 volume  0.30000E+00 ppm1      6.985 ppm2      4.362
 ASSI (
   (( segid "    " and resid 1176 and name HD22))
 )(
   (( segid "    " and resid 1173 and name HA  ))
 )
      6.000     6.000     0.000 peak  8506 weight  0.10000E+01 volume  0.30400E+00 ppm1      6.810 ppm2      3.179
 ASSI (
   (( segid "    " and resid 1176 and name HD22))
 )(
   (( segid "    " and resid 1172 and name HG2 ))
  OR 
   (( segid "    " and resid 1172 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8504 weight  0.10000E+01 volume  0.42900E+00 ppm1      6.809 ppm2      2.189
 ASSI (
   (( segid "    " and resid 1176 and name HD22))
 )(
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
 )
      6.000     6.000     0.000 peak  8446 weight  0.10000E+01 volume  0.21900E+00 ppm1      6.809 ppm2      0.629
 ASSI (
   (( segid "    " and resid 1176 and name HD22))
 )(
   (( segid "    " and resid 1176 and name HA  ))
 )
      6.000     6.000     0.000 peak  8443 weight  0.10000E+01 volume  0.31700E+00 ppm1      6.811 ppm2      4.362
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1227 and name HG23))
  OR 
   (( segid "    " and resid 1227 and name HG22))
  OR 
   (( segid "    " and resid 1227 and name HG21))
  OR 
   (( segid "    " and resid 1173 and name HD13))
  OR 
   (( segid "    " and resid 1173 and name HD12))
  OR 
   (( segid "    " and resid 1173 and name HD11))
 )
      6.000     6.000     0.000 peak  6563 weight  0.10000E+01 volume  0.23000E+00 ppm1      7.878 ppm2      0.641
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
  OR 
   (( segid "    " and resid 1173 and name HG12))
  OR 
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      6.000     6.000     0.000 peak  6564 weight  0.10000E+01 volume  0.19900E+00 ppm1      7.875 ppm2      0.712
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HG11))
  OR 
   (( segid "    " and resid 1173 and name HB  ))
 )
      6.000     6.000     0.000 peak  6567 weight  0.10000E+01 volume  0.33300E+00 ppm1      7.875 ppm2      1.146
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HG11))
 )
      6.000     6.000     0.000 peak  6570 weight  0.10000E+01 volume  0.14100E+00 ppm1      7.874 ppm2      1.346
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
  OR 
   (( segid "    " and resid 1174 and name HG2 ))
 )
      6.000     6.000     0.000 peak  6568 weight  0.10000E+01 volume  0.18300E+00 ppm1      7.876 ppm2      2.035
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HB1 ))
  OR 
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
  OR 
   (( segid "    " and resid 1172 and name HG2 ))
  OR 
   (( segid "    " and resid 1172 and name HG1 ))
 )
      6.000     6.000     0.000 peak  6569 weight  0.10000E+01 volume  0.18400E+00 ppm1      7.875 ppm2      2.221
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1177 and name HB2 ))
  OR 
   (( segid "    " and resid 1176 and name HB1 ))
 )
      3.300     3.300     0.000 peak  6559 weight  0.10000E+01 volume  0.28070E+01 ppm1      7.874 ppm2      2.656
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1173 and name HA  ))
 )
      6.000     6.000     0.000 peak  6558 weight  0.10000E+01 volume  0.23500E+00 ppm1      7.875 ppm2      3.184
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1176 and name HA  ))
 )
      5.000     5.000     0.000 peak  6554 weight  0.10000E+01 volume  0.80500E+00 ppm1      7.876 ppm2      4.360
 ASSI (
   (( segid "    " and resid 1177 and name HN  ))
 )(
   (( segid "    " and resid 1227 and name HA  ))
 )
      6.000     6.000     0.000 peak  6553 weight  0.10000E+01 volume  0.27500E+00 ppm1      7.876 ppm2      4.529
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1227 and name HG23))
  OR 
   (( segid "    " and resid 1227 and name HG22))
  OR 
   (( segid "    " and resid 1227 and name HG21))
 )
      6.000     6.000     0.000 peak  5164 weight  0.10000E+01 volume  0.15700E+00 ppm1      7.582 ppm2      0.629
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )
      6.000     6.000     0.000 peak  5163 weight  0.10000E+01 volume  0.29700E+00 ppm1      7.582 ppm2      0.717
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
  OR 
   (( segid "    " and resid 1179 and name HG12))
 )
      5.000     5.000     0.000 peak  5162 weight  0.10000E+01 volume  0.69100E+00 ppm1      7.580 ppm2      1.016
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HG1 ))
  OR 
   (( segid "    " and resid 1179 and name HG11))
  OR 
   (( segid "    " and resid 1178 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5161 weight  0.10000E+01 volume  0.99400E+00 ppm1      7.583 ppm2      1.164
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HD2 ))
  OR 
   (( segid "    " and resid 1173 and name HG11))
 )
      5.000     5.000     0.000 peak  5160 weight  0.10000E+01 volume  0.42600E+00 ppm1      7.583 ppm2      1.285
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HD1 ))
 )
      5.000     5.000     0.000 peak  5159 weight  0.10000E+01 volume  0.44200E+00 ppm1      7.582 ppm2      1.378
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1177 and name HB2 ))
  OR 
   (( segid "    " and resid 1176 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5156 weight  0.10000E+01 volume  0.63100E+00 ppm1      7.582 ppm2      2.659
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HD1 ))
  OR 
   (( segid "    " and resid 1174 and name HA  ))
 )
      6.000     6.000     0.000 peak  5154 weight  0.10000E+01 volume  0.27400E+00 ppm1      7.581 ppm2      3.485
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1176 and name HA  ))
 )
      6.000     6.000     0.000 peak  5151 weight  0.10000E+01 volume  0.26700E+00 ppm1      7.582 ppm2      4.361
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HN  ))
  OR 
   (( segid "    " and resid 1177 and name HN  ))
 )
      2.700     2.700     0.000 peak  5127 weight  0.10000E+01 volume  0.41020E+01 ppm1      7.578 ppm2      7.870
 ASSI (
   (( segid "    " and resid 1178 and name HN  ))
 )(
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
  OR 
   (( segid "    " and resid 1174 and name HG2 ))
 )
      6.000     6.000     0.000 peak  5158 weight  0.10000E+01 volume  0.17500E+00 ppm1      7.589 ppm2      2.010
 ASSI (
   (( segid "    " and resid 1178 and name HD21))
 )(
   (( segid "    " and resid 1230 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
  OR 
   (( segid "    " and resid 1202 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8449 weight  0.10000E+01 volume  0.22800E+00 ppm1      7.115 ppm2      1.417
 ASSI (
   (( segid "    " and resid 1178 and name HD21))
 )(
   (( segid "    " and resid 1205 and name HB2 ))
  OR 
   (( segid "    " and resid 1177 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8490 weight  0.10000E+01 volume  0.21200E+00 ppm1      7.121 ppm2      2.660
 ASSI (
   (( segid "    " and resid 1178 and name HD21))
 )(
   (( segid "    " and resid 1230 and name HA  ))
  OR 
   (( segid "    " and resid 1228 and name HB1 ))
  OR 
   (( segid "    " and resid 1227 and name HB  ))
  OR 
   (( segid "    " and resid 1177 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8487 weight  0.10000E+01 volume  0.25700E+00 ppm1      7.120 ppm2      3.688
 ASSI (
   (( segid "    " and resid 1178 and name HD21))
 )(
   (( segid "    " and resid 1178 and name HA  ))
 )
      6.000     6.000     0.000 peak  8486 weight  0.10000E+01 volume  0.25300E+00 ppm1      7.120 ppm2      3.906
 ASSI (
   (( segid "    " and resid 1178 and name HD21))
 )(
   (( segid "    " and resid 1205 and name HE2 ))
  OR 
   (( segid "    " and resid 1205 and name HE1 ))
  OR 
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8478 weight  0.10000E+01 volume  0.98500E+00 ppm1      7.116 ppm2      6.657
 ASSI (
   (( segid "    " and resid 1178 and name HD21))
 )(
   (( segid "    " and resid 1178 and name HD22))
 )
      2.700     2.700     0.000 peak  8481 weight  0.10000E+01 volume  0.53520E+01 ppm1      7.114 ppm2      6.791
 ASSI (
   (( segid "    " and resid 1178 and name HD21))
 )(
   (( segid "    " and resid 1228 and name HN  ))
  OR 
   (( segid "    " and resid 1205 and name HN  ))
 )
      6.000     6.000     0.000 peak  8484 weight  0.10000E+01 volume  0.15400E+00 ppm1      7.116 ppm2      8.341
 ASSI (
   (( segid "    " and resid 1178 and name HD21))
 )(
   (( segid "    " and resid 1230 and name HN  ))
 )
      6.000     6.000     0.000 peak  8485 weight  0.10000E+01 volume  0.11400E+00 ppm1      7.115 ppm2      8.789
 ASSI (
   (( segid "    " and resid 1178 and name HD22))
 )(
   (( segid "    " and resid 1178 and name HB2 ))
 )
      5.000     5.000     0.000 peak  8448 weight  0.10000E+01 volume  0.69800E+00 ppm1      6.792 ppm2      1.179
 ASSI (
   (( segid "    " and resid 1178 and name HD22))
 )(
   (( segid "    " and resid 1230 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB3 ))
  OR 
   (( segid "    " and resid 1229 and name HB2 ))
  OR 
   (( segid "    " and resid 1229 and name HB1 ))
  OR 
   (( segid "    " and resid 1202 and name HD1 ))
 )
      6.000     6.000     0.000 peak  8450 weight  0.10000E+01 volume  0.34500E+00 ppm1      6.793 ppm2      1.416
 ASSI (
   (( segid "    " and resid 1178 and name HD22))
 )(
   (( segid "    " and resid 1228 and name HB2 ))
  OR 
   (( segid "    " and resid 1205 and name HB2 ))
  OR 
   (( segid "    " and resid 1177 and name HB2 ))
 )
      6.000     6.000     0.000 peak  8491 weight  0.10000E+01 volume  0.32700E+00 ppm1      6.787 ppm2      2.673
 ASSI (
   (( segid "    " and resid 1178 and name HD22))
 )(
   (( segid "    " and resid 1178 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8434 weight  0.10000E+01 volume  0.98600E+00 ppm1      6.792 ppm2      2.803
 ASSI (
   (( segid "    " and resid 1178 and name HD22))
 )(
   (( segid "    " and resid 1230 and name HA  ))
  OR 
   (( segid "    " and resid 1228 and name HB1 ))
  OR 
   (( segid "    " and resid 1227 and name HB  ))
  OR 
   (( segid "    " and resid 1177 and name HB1 ))
 )
      6.000     6.000     0.000 peak  8488 weight  0.10000E+01 volume  0.22200E+00 ppm1      6.791 ppm2      3.691
 ASSI (
   (( segid "    " and resid 1178 and name HD22))
 )(
   (( segid "    " and resid 1202 and name HA  ))
  OR 
   (( segid "    " and resid 1178 and name HA  ))
 )
      6.000     6.000     0.000 peak  8489 weight  0.10000E+01 volume  0.17700E+00 ppm1      6.792 ppm2      3.917
 ASSI (
   (( segid "    " and resid 1178 and name HD22))
 )(
   (( segid "    " and resid 1205 and name HE2 ))
  OR 
   (( segid "    " and resid 1205 and name HE1 ))
  OR 
   (( segid "    " and resid 1205 and name HD2 ))
  OR 
   (( segid "    " and resid 1205 and name HD1 ))
 )
      5.000     5.000     0.000 peak  8479 weight  0.10000E+01 volume  0.11140E+01 ppm1      6.790 ppm2      6.660
 ASSI (
   (( segid "    " and resid 1178 and name HD22))
 )(
   (( segid "    " and resid 1228 and name HN  ))
  OR 
   (( segid "    " and resid 1205 and name HN  ))
 )
      6.000     6.000     0.000 peak  8483 weight  0.10000E+01 volume  0.21800E+00 ppm1      6.787 ppm2      8.331
 ASSI (
   (( segid "    " and resid 1178 and name HD22))
 )(
   (( segid "    " and resid 1230 and name HN  ))
 )
      6.000     6.000     0.000 peak  8482 weight  0.10000E+01 volume  0.16900E+00 ppm1      6.791 ppm2      8.781
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1201 and name HA  ))
 )
      6.000     6.000     0.000 peak  5134 weight  0.10000E+01 volume  0.20900E+00 ppm1      7.870 ppm2      5.070
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1180 and name HA  ))
  OR 
   (( segid "    " and resid 1177 and name HA  ))
 )
      6.000     6.000     0.000 peak  5135 weight  0.10000E+01 volume  0.16900E+00 ppm1      7.868 ppm2      4.694
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1228 and name HB1 ))
  OR 
   (( segid "    " and resid 1177 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5132 weight  0.10000E+01 volume  0.36700E+00 ppm1      7.870 ppm2      3.690
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HG2 ))
 )
      6.000     6.000     0.000 peak  5145 weight  0.10000E+01 volume  0.25800E+00 ppm1      7.861 ppm2      1.969
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HE2 ))
  OR 
   (( segid "    " and resid 1202 and name HE1 ))
  OR 
   (( segid "    " and resid 1178 and name HB1 ))
  OR 
   (( segid "    " and resid 1174 and name HG1 ))
 )
      5.000     5.000     0.000 peak  5136 weight  0.10000E+01 volume  0.52700E+00 ppm1      7.867 ppm2      2.821
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HG23))
  OR 
   (( segid "    " and resid 1179 and name HG22))
  OR 
   (( segid "    " and resid 1179 and name HG21))
 )
      5.000     5.000     0.000 peak  5142 weight  0.10000E+01 volume  0.14050E+01 ppm1      7.865 ppm2      0.718
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HG12))
 )
      3.300     3.300     0.000 peak  5140 weight  0.10000E+01 volume  0.17530E+01 ppm1      7.869 ppm2      0.996
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HG11))
 )
      3.300     3.300     0.000 peak  5141 weight  0.10000E+01 volume  0.18510E+01 ppm1      7.868 ppm2      1.116
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HB  ))
 )
      5.000     5.000     0.000 peak  5139 weight  0.10000E+01 volume  0.49000E+00 ppm1      7.868 ppm2      1.787
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HB1 ))
  OR 
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5138 weight  0.10000E+01 volume  0.52500E+00 ppm1      7.867 ppm2      2.211
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1201 and name HB2 ))
  OR 
   (( segid "    " and resid 1177 and name HB2 ))
  OR 
   (( segid "    " and resid 1176 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5137 weight  0.10000E+01 volume  0.50000E+00 ppm1      7.868 ppm2      2.653
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HD1 ))
  OR 
   (( segid "    " and resid 1174 and name HA  ))
 )
      5.000     5.000     0.000 peak  5133 weight  0.10000E+01 volume  0.89500E+00 ppm1      7.868 ppm2      3.480
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1178 and name HA  ))
 )
      3.300     3.300     0.000 peak  5131 weight  0.10000E+01 volume  0.26090E+01 ppm1      7.866 ppm2      3.913
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1178 and name HD22))
  OR 
   (( segid "    " and resid 1177 and name HD2 ))
  OR 
   (( segid "    " and resid 1177 and name HD1 ))
  OR 
   (( segid "    " and resid 1176 and name HD22))
 )
      6.000     6.000     0.000 peak  5128 weight  0.10000E+01 volume  0.30600E+00 ppm1      7.868 ppm2      6.760
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
  OR 
   (( segid "    " and resid 1178 and name HD21))
 )
      6.000     6.000     0.000 peak  5129 weight  0.10000E+01 volume  0.20400E+00 ppm1      7.868 ppm2      7.155
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1174 and name HN  ))
 )
      6.000     6.000     0.000 peak  5146 weight  0.10000E+01 volume  0.26400E+00 ppm1      7.866 ppm2      7.449
 ASSI (
   (( segid "    " and resid 1179 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
  OR 
   (( segid "    " and resid 1174 and name HG2 ))
 )
      6.000     6.000     0.000 peak  5144 weight  0.10000E+01 volume  0.30600E+00 ppm1      7.861 ppm2      2.035
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )
      5.000     5.000     0.000 peak  5123 weight  0.10000E+01 volume  0.98100E+00 ppm1      8.982 ppm2      0.597
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HG2 ))
  OR 
   (( segid "    " and resid 1179 and name HG12))
 )
      5.000     5.000     0.000 peak  5121 weight  0.10000E+01 volume  0.70200E+00 ppm1      8.984 ppm2      0.995
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HB2 ))
  OR 
   (( segid "    " and resid 1184 and name HG23))
  OR 
   (( segid "    " and resid 1184 and name HG22))
  OR 
   (( segid "    " and resid 1184 and name HG21))
  OR 
   (( segid "    " and resid 1179 and name HG12))
  OR 
   (( segid "    " and resid 1179 and name HG11))
 )
      5.000     5.000     0.000 peak  5120 weight  0.10000E+01 volume  0.47600E+00 ppm1      8.982 ppm2      1.071
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5119 weight  0.10000E+01 volume  0.25000E+01 ppm1      8.985 ppm2      1.205
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HD2 ))
  OR 
   (( segid "    " and resid 1181 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5118 weight  0.10000E+01 volume  0.16400E+00 ppm1      8.984 ppm2      1.340
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HB2 ))
  OR 
   (( segid "    " and resid 1214 and name HB2 ))
  OR 
   (( segid "    " and resid 1203 and name HG2 ))
  OR 
   (( segid "    " and resid 1202 and name HB1 ))
  OR 
   (( segid "    " and resid 1188 and name HB2 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
 )
      6.000     6.000     0.000 peak  5117 weight  0.10000E+01 volume  0.18900E+00 ppm1      8.985 ppm2      1.634
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1179 and name HB  ))
 )
      3.300     3.300     0.000 peak  5097 weight  0.10000E+01 volume  0.19070E+01 ppm1      8.984 ppm2      1.789
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1200 and name HB  ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5115 weight  0.10000E+01 volume  0.44900E+00 ppm1      8.984 ppm2      2.079
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HB1 ))
  OR 
   (( segid "    " and resid 1214 and name HB1 ))
  OR 
   (( segid "    " and resid 1198 and name HG1 ))
  OR 
   (( segid "    " and resid 1174 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5116 weight  0.10000E+01 volume  0.14000E+00 ppm1      8.981 ppm2      2.214
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1228 and name HB2 ))
  OR 
   (( segid "    " and resid 1205 and name HB2 ))
  OR 
   (( segid "    " and resid 1201 and name HB2 ))
  OR 
   (( segid "    " and resid 1177 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5114 weight  0.10000E+01 volume  0.15200E+00 ppm1      8.987 ppm2      2.670
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HD2 ))
  OR 
   (( segid "    " and resid 1202 and name HE2 ))
  OR 
   (( segid "    " and resid 1202 and name HE1 ))
  OR 
   (( segid "    " and resid 1199 and name HB2 ))
  OR 
   (( segid "    " and resid 1174 and name HG1 ))
 )
      6.000     6.000     0.000 peak  5113 weight  0.10000E+01 volume  0.29100E+00 ppm1      8.985 ppm2      2.885
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1199 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5112 weight  0.10000E+01 volume  0.41700E+00 ppm1      8.985 ppm2      3.121
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HD1 ))
  OR 
   (( segid "    " and resid 1174 and name HA  ))
 )
      6.000     6.000     0.000 peak  5111 weight  0.10000E+01 volume  0.83000E-01 ppm1      8.984 ppm2      3.496
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1202 and name HA  ))
  OR 
   (( segid "    " and resid 1184 and name HA  ))
  OR 
   (( segid "    " and resid 1178 and name HA  ))
  OR 
   (( segid "    " and resid 1175 and name HA  ))
 )
      6.000     6.000     0.000 peak  5110 weight  0.10000E+01 volume  0.18000E+00 ppm1      8.984 ppm2      3.942
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1227 and name HA  ))
  OR 
   (( segid "    " and resid 1200 and name HA  ))
 )
      6.000     6.000     0.000 peak  5109 weight  0.10000E+01 volume  0.22000E+00 ppm1      8.984 ppm2      4.576
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1180 and name HA  ))
 )
      5.000     5.000     0.000 peak  5108 weight  0.10000E+01 volume  0.83500E+00 ppm1      8.984 ppm2      4.707
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1201 and name HA  ))
 )
      5.000     5.000     0.000 peak  5107 weight  0.10000E+01 volume  0.71900E+00 ppm1      8.984 ppm2      5.086
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1199 and name HE1 ))
  OR 
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
  OR 
   (( segid "    " and resid 1178 and name HD21))
 )
      5.000     5.000     0.000 peak  5104 weight  0.10000E+01 volume  0.50400E+00 ppm1      8.983 ppm2      7.143
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1203 and name HN  ))
  OR 
   (( segid "    " and resid 1181 and name HN  ))
 )
      6.000     6.000     0.000 peak  5098 weight  0.10000E+01 volume  0.30700E+00 ppm1      8.984 ppm2      8.333
 ASSI (
   (( segid "    " and resid 1180 and name HN  ))
 )(
   (( segid "    " and resid 1201 and name HN  ))
  OR 
   (( segid "    " and resid 1199 and name HN  ))
  OR 
   (( segid "    " and resid 1183 and name HN  ))
 )
      6.000     6.000     0.000 peak  5105 weight  0.10000E+01 volume  0.90000E-01 ppm1      8.983 ppm2      8.437
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1199 and name HE2 ))
  OR 
   (( segid "    " and resid 1199 and name HE1 ))
  OR 
   (( segid "    " and resid 1199 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HD1 ))
  OR 
   (( segid "    " and resid 1183 and name HH2 ))
  OR 
   (( segid "    " and resid 1183 and name HZ3 ))
 )
      6.000     6.000     0.000 peak  5081 weight  0.10000E+01 volume  0.33700E+00 ppm1      8.085 ppm2      7.142
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )
      5.000     5.000     0.000 peak  5096 weight  0.10000E+01 volume  0.83500E+00 ppm1      8.084 ppm2      0.472
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
  OR 
   (( segid "    " and resid 1182 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5095 weight  0.10000E+01 volume  0.53900E+00 ppm1      8.085 ppm2      0.597
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      5.000     5.000     0.000 peak  5093 weight  0.10000E+01 volume  0.76800E+00 ppm1      8.084 ppm2      0.763
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      6.000     6.000     0.000 peak  5094 weight  0.10000E+01 volume  0.36800E+00 ppm1      8.083 ppm2      0.847
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1182 and name HB2 ))
 )
      3.300     3.300     0.000 peak  5092 weight  0.10000E+01 volume  0.17300E+01 ppm1      8.083 ppm2      1.120
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5091 weight  0.10000E+01 volume  0.12500E+01 ppm1      8.083 ppm2      1.180
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1181 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5090 weight  0.10000E+01 volume  0.49600E+00 ppm1      8.083 ppm2      1.341
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1181 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5089 weight  0.10000E+01 volume  0.40600E+00 ppm1      8.084 ppm2      1.513
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1188 and name HD1 ))
  OR 
   (( segid "    " and resid 1188 and name HB2 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
 )
      6.000     6.000     0.000 peak  5088 weight  0.10000E+01 volume  0.30400E+00 ppm1      8.082 ppm2      1.601
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HB  ))
  OR 
   (( segid "    " and resid 1198 and name HG2 ))
 )
      6.000     6.000     0.000 peak  5087 weight  0.10000E+01 volume  0.28500E+00 ppm1      8.083 ppm2      2.086
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1181 and name HA  ))
 )
      3.300     3.300     0.000 peak  5085 weight  0.10000E+01 volume  0.18530E+01 ppm1      8.082 ppm2      4.333
 ASSI (
   (( segid "    " and resid 1182 and name HN  ))
 )(
   (( segid "    " and resid 1181 and name HN  ))
 )
      6.000     6.000     0.000 peak  5080 weight  0.10000E+01 volume  0.14400E+00 ppm1      8.081 ppm2      8.347
 ASSI (
   (( segid "    " and resid 1182 and name HE  ))
 )(
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      5.000     5.000     0.000 peak  8049 weight  0.10000E+01 volume  0.48900E+00 ppm1      6.752 ppm2      0.768
 ASSI (
   (( segid "    " and resid 1182 and name HE  ))
 )(
   (( segid "    " and resid 1182 and name HG1 ))
 )
      5.000     5.000     0.000 peak  8048 weight  0.10000E+01 volume  0.85100E+00 ppm1      6.754 ppm2      0.867
 ASSI (
   (( segid "    " and resid 1182 and name HE  ))
 )(
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
 )
      5.000     5.000     0.000 peak  8050 weight  0.10000E+01 volume  0.41100E+00 ppm1      6.755 ppm2      1.133
 ASSI (
   (( segid "    " and resid 1182 and name HE  ))
 )(
   (( segid "    " and resid 1182 and name HG2 ))
 )
      6.000     6.000     0.000 peak  8042 weight  0.10000E+01 volume  0.36500E+00 ppm1      6.753 ppm2      0.585
 ASSI (
   (( segid "    " and resid 1183 and name HN  ))
 )(
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )
      6.000     6.000     0.000 peak  5079 weight  0.10000E+01 volume  0.16400E+00 ppm1      8.468 ppm2      0.477
 ASSI (
   (( segid "    " and resid 1183 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
  OR 
   (( segid "    " and resid 1182 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5078 weight  0.10000E+01 volume  0.49500E+00 ppm1      8.467 ppm2      0.585
 ASSI (
   (( segid "    " and resid 1183 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      6.000     6.000     0.000 peak  5077 weight  0.10000E+01 volume  0.31300E+00 ppm1      8.465 ppm2      0.774
 ASSI (
   (( segid "    " and resid 1183 and name HN  ))
 )(
   (( segid "    " and resid 1182 and name HG1 ))
 )
      6.000     6.000     0.000 peak  5076 weight  0.10000E+01 volume  0.27100E+00 ppm1      8.468 ppm2      0.864
 ASSI (
   (( segid "    " and resid 1183 and name HN  ))
 )(
   (( segid "    " and resid 1184 and name HG23))
  OR 
   (( segid "    " and resid 1184 and name HG22))
  OR 
   (( segid "    " and resid 1184 and name HG21))
  OR 
   (( segid "    " and resid 1182 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5075 weight  0.10000E+01 volume  0.11550E+01 ppm1      8.469 ppm2      1.123
 ASSI (
   (( segid "    " and resid 1183 and name HN  ))
 )(
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
  OR 
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( segid "    " and resid 1180 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5074 weight  0.10000E+01 volume  0.74200E+00 ppm1      8.469 ppm2      1.180
 ASSI (
   (( segid "    " and resid 1183 and name HN  ))
 )(
   (( segid "    " and resid 1181 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5073 weight  0.10000E+01 volume  0.40000E+00 ppm1      8.467 ppm2      1.337
 ASSI (
   (( segid "    " and resid 1183 and name HN  ))
 )(
   (( segid "    " and resid 1181 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5071 weight  0.10000E+01 volume  0.19300E+00 ppm1      8.471 ppm2      1.515
 ASSI (
   (( segid "    " and resid 1183 and name HN  ))
 )(
   (( segid "    " and resid 1188 and name HD2 ))
  OR 
   (( segid "    " and resid 1188 and name HD1 ))
  OR 
   (( segid "    " and resid 1188 and name HB2 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
 )
      6.000     6.000     0.000 peak  5072 weight  0.10000E+01 volume  0.26900E+00 ppm1      8.469 ppm2      1.591
 ASSI (
   (( segid "    " and resid 1183 and name HN  ))
 )(
   (( segid "    " and resid 1183 and name HB2 ))
  OR 
   (( segid "    " and resid 1183 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5070 weight  0.10000E+01 volume  0.19200E+01 ppm1      8.467 ppm2      3.233
 ASSI (
   (( segid "    " and resid 1183 and name HN  ))
 )(
   (( segid "    " and resid 1199 and name HA  ))
 )
      6.000     6.000     0.000 peak  5065 weight  0.10000E+01 volume  0.13800E+00 ppm1      8.466 ppm2      5.246
 ASSI (
   (( segid "    " and resid 1183 and name HN  ))
 )(
   (( segid "    " and resid 1181 and name HA  ))
 )
      6.000     6.000     0.000 peak  5068 weight  0.10000E+01 volume  0.28600E+00 ppm1      8.467 ppm2      4.336
 ASSI (
   (( segid "    " and resid 1183 and name HE1 ))
 )(
   (( segid "    " and resid 1198 and name HG2 ))
 )
      6.000     6.000     0.000 peak  5360 weight  0.10000E+01 volume  0.22500E+00 ppm1     10.076 ppm2      2.026
 ASSI (
   (( segid "    " and resid 1183 and name HE1 ))
 )(
   (( segid "    " and resid 1188 and name HG1 ))
  OR 
   (( segid "    " and resid 1185 and name HB3 ))
  OR 
   (( segid "    " and resid 1185 and name HB2 ))
  OR 
   (( segid "    " and resid 1185 and name HB1 ))
  OR 
   (( segid "    " and resid 1181 and name HB2 ))
 )
      6.000     6.000     0.000 peak  5357 weight  0.10000E+01 volume  0.18000E+00 ppm1     10.079 ppm2      1.394
 ASSI (
   (( segid "    " and resid 1183 and name HE1 ))
 )(
   (( segid "    " and resid 1182 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5365 weight  0.10000E+01 volume  0.71300E+00 ppm1     10.076 ppm2      0.583
 ASSI (
   (( segid "    " and resid 1183 and name HE1 ))
 )(
   (( segid "    " and resid 1182 and name HG1 ))
 )
      6.000     6.000     0.000 peak  5364 weight  0.10000E+01 volume  0.32700E+00 ppm1     10.078 ppm2      0.868
 ASSI (
   (( segid "    " and resid 1183 and name HE1 ))
 )(
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5363 weight  0.10000E+01 volume  0.55900E+00 ppm1     10.077 ppm2      1.138
 ASSI (
   (( segid "    " and resid 1183 and name HE1 ))
 )(
   (( segid "    " and resid 1182 and name HD2 ))
 )
      5.000     5.000     0.000 peak  5362 weight  0.10000E+01 volume  0.99200E+00 ppm1     10.074 ppm2      2.530
 ASSI (
   (( segid "    " and resid 1183 and name HE1 ))
 )(
   (( segid "    " and resid 1182 and name HD1 ))
 )
      5.000     5.000     0.000 peak  5374 weight  0.10000E+01 volume  0.60300E+00 ppm1     10.076 ppm2      2.719
 ASSI (
   (( segid "    " and resid 1183 and name HE1 ))
 )(
   (( segid "    " and resid 1183 and name HB2 ))
  OR 
   (( segid "    " and resid 1183 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5375 weight  0.10000E+01 volume  0.50100E+00 ppm1     10.074 ppm2      3.238
 ASSI (
   (( segid "    " and resid 1183 and name HE1 ))
 )(
   (( segid "    " and resid 1182 and name HA  ))
 )
      6.000     6.000     0.000 peak  5372 weight  0.10000E+01 volume  0.79000E-01 ppm1     10.077 ppm2      3.786
 ASSI (
   (( segid "    " and resid 1183 and name HE1 ))
 )(
   (( segid "    " and resid 1183 and name HH2 ))
  OR 
   (( segid "    " and resid 1183 and name HZ3 ))
 )
      5.000     5.000     0.000 peak  5367 weight  0.10000E+01 volume  0.10360E+01 ppm1     10.077 ppm2      7.163
 ASSI (
   (( segid "    " and resid 1183 and name HE1 ))
 )(
   (( segid "    " and resid 1183 and name HZ2 ))
 )
      2.700     2.700     0.000 peak  5368 weight  0.10000E+01 volume  0.43710E+01 ppm1     10.073 ppm2      7.408
 ASSI (
   (( segid "    " and resid 1183 and name HE1 ))
 )(
   (( segid "    " and resid 1183 and name HN  ))
 )
      6.000     6.000     0.000 peak  5370 weight  0.10000E+01 volume  0.32800E+00 ppm1     10.074 ppm2      8.465
 ASSI (
   (( segid "    " and resid 1183 and name HE1 ))
 )(
   (( segid "    " and resid 1198 and name HB2 ))
  OR 
   (( segid "    " and resid 1188 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5358 weight  0.10000E+01 volume  0.49000E+00 ppm1     10.073 ppm2      1.763
 ASSI (
   (( segid "    " and resid 1184 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
  OR 
   (( segid "    " and resid 1182 and name HG2 ))
 )
      6.000     6.000     0.000 peak  5060 weight  0.10000E+01 volume  0.26100E+00 ppm1      7.566 ppm2      0.603
 ASSI (
   (( segid "    " and resid 1184 and name HN  ))
 )(
   (( segid "    " and resid 1198 and name HG2 ))
  OR 
   (( segid "    " and resid 1186 and name HD2 ))
  OR 
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5054 weight  0.10000E+01 volume  0.11200E+00 ppm1      7.560 ppm2      2.011
 ASSI (
   (( segid "    " and resid 1184 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      6.000     6.000     0.000 peak  5059 weight  0.10000E+01 volume  0.24800E+00 ppm1      7.562 ppm2      0.811
 ASSI (
   (( segid "    " and resid 1184 and name HN  ))
 )(
   (( segid "    " and resid 1188 and name HG1 ))
  OR 
   (( segid "    " and resid 1185 and name HB3 ))
  OR 
   (( segid "    " and resid 1185 and name HB2 ))
  OR 
   (( segid "    " and resid 1185 and name HB1 ))
  OR 
   (( segid "    " and resid 1181 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5056 weight  0.10000E+01 volume  0.58200E+00 ppm1      7.563 ppm2      1.390
 ASSI (
   (( segid "    " and resid 1184 and name HN  ))
 )(
   (( segid "    " and resid 1181 and name HG  ))
  OR 
   (( segid "    " and resid 1181 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5055 weight  0.10000E+01 volume  0.14400E+00 ppm1      7.561 ppm2      1.555
 ASSI (
   (( segid "    " and resid 1184 and name HN  ))
 )(
   (( segid "    " and resid 1183 and name HD1 ))
 )
      6.000     6.000     0.000 peak  5046 weight  0.10000E+01 volume  0.37900E+00 ppm1      7.564 ppm2      7.303
 ASSI (
   (( segid "    " and resid 1184 and name HN  ))
 )(
   (( segid "    " and resid 1184 and name HB  ))
 )
      5.000     5.000     0.000 peak  5051 weight  0.10000E+01 volume  0.13750E+01 ppm1      7.565 ppm2      4.180
 ASSI (
   (( segid "    " and resid 1184 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      6.000     6.000     0.000 peak  5058 weight  0.10000E+01 volume  0.18900E+00 ppm1      7.558 ppm2      0.759
 ASSI (
   (( segid "    " and resid 1184 and name HN  ))
 )(
   (( segid "    " and resid 1183 and name HB2 ))
  OR 
   (( segid "    " and resid 1183 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5053 weight  0.10000E+01 volume  0.10440E+01 ppm1      7.562 ppm2      3.225
 ASSI (
   (( segid "    " and resid 1185 and name HN  ))
 )(
   (( segid "    " and resid 1183 and name HA  ))
 )
      6.000     6.000     0.000 peak  5034 weight  0.10000E+01 volume  0.35300E+00 ppm1      8.257 ppm2      4.858
 ASSI (
   (( segid "    " and resid 1185 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      6.000     6.000     0.000 peak  5041 weight  0.10000E+01 volume  0.15700E+00 ppm1      8.253 ppm2      0.782
 ASSI (
   (( segid "    " and resid 1185 and name HN  ))
 )(
   (( segid "    " and resid 1185 and name HB3 ))
  OR 
   (( segid "    " and resid 1185 and name HB2 ))
  OR 
   (( segid "    " and resid 1185 and name HB1 ))
  OR 
   (( segid "    " and resid 1181 and name HB2 ))
 )
      2.700     2.700     0.000 peak  5039 weight  0.10000E+01 volume  0.42330E+01 ppm1      8.252 ppm2      1.397
 ASSI (
   (( segid "    " and resid 1185 and name HN  ))
 )(
   (( segid "    " and resid 1183 and name HB2 ))
  OR 
   (( segid "    " and resid 1183 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5042 weight  0.10000E+01 volume  0.17300E+00 ppm1      8.252 ppm2      3.231
 ASSI (
   (( segid "    " and resid 1185 and name HN  ))
 )(
   (( segid "    " and resid 1184 and name HA  ))
 )
      3.300     3.300     0.000 peak  5036 weight  0.10000E+01 volume  0.17750E+01 ppm1      8.254 ppm2      3.951
 ASSI (
   (( segid "    " and resid 1185 and name HN  ))
 )(
   (( segid "    " and resid 1186 and name HA  ))
  OR 
   (( segid "    " and resid 1185 and name HA  ))
  OR 
   (( segid "    " and resid 1184 and name HB  ))
 )
      3.300     3.300     0.000 peak  5037 weight  0.10000E+01 volume  0.17540E+01 ppm1      8.255 ppm2      4.233
 ASSI (
   (( segid "    " and resid 1186 and name HN  ))
 )(
   (( segid "    " and resid 1187 and name HB2 ))
  OR 
   (( segid "    " and resid 1187 and name HB1 ))
  OR 
   (( segid "    " and resid 1186 and name HD2 ))
  OR 
   (( segid "    " and resid 1175 and name HB2 ))
  OR 
   (( segid "    " and resid 1175 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5026 weight  0.10000E+01 volume  0.32800E+00 ppm1      7.723 ppm2      2.011
 ASSI (
   (( segid "    " and resid 1186 and name HN  ))
 )(
   (( segid "    " and resid 1184 and name HA  ))
  OR 
   (( segid "    " and resid 1175 and name HA  ))
 )
      6.000     6.000     0.000 peak  5024 weight  0.10000E+01 volume  0.15600E+00 ppm1      7.722 ppm2      3.945
 ASSI (
   (( segid "    " and resid 1186 and name HN  ))
 )(
   (( segid "    " and resid 1184 and name HG23))
  OR 
   (( segid "    " and resid 1184 and name HG22))
  OR 
   (( segid "    " and resid 1184 and name HG21))
  OR 
   (( segid "    " and resid 1179 and name HG11))
 )
      6.000     6.000     0.000 peak  5031 weight  0.10000E+01 volume  0.12600E+00 ppm1      7.719 ppm2      1.094
 ASSI (
   (( segid "    " and resid 1186 and name HN  ))
 )(
   (( segid "    " and resid 1186 and name HG2 ))
  OR 
   (( segid "    " and resid 1185 and name HB3 ))
  OR 
   (( segid "    " and resid 1185 and name HB2 ))
  OR 
   (( segid "    " and resid 1185 and name HB1 ))
 )
      3.300     3.300     0.000 peak  5030 weight  0.10000E+01 volume  0.26250E+01 ppm1      7.719 ppm2      1.385
 ASSI (
   (( segid "    " and resid 1186 and name HN  ))
 )(
   (( segid "    " and resid 1188 and name HD2 ))
  OR 
   (( segid "    " and resid 1188 and name HD1 ))
  OR 
   (( segid "    " and resid 1186 and name HG1 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
  OR 
   (( segid "    " and resid 1181 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5029 weight  0.10000E+01 volume  0.47100E+00 ppm1      7.721 ppm2      1.565
 ASSI (
   (( segid "    " and resid 1186 and name HN  ))
 )(
   (( segid "    " and resid 1188 and name HB1 ))
  OR 
   (( segid "    " and resid 1186 and name HB2 ))
 )
      3.300     3.300     0.000 peak  5028 weight  0.10000E+01 volume  0.18030E+01 ppm1      7.719 ppm2      1.712
 ASSI (
   (( segid "    " and resid 1186 and name HN  ))
 )(
   (( segid "    " and resid 1186 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5027 weight  0.10000E+01 volume  0.14680E+01 ppm1      7.721 ppm2      1.800
 ASSI (
   (( segid "    " and resid 1186 and name HN  ))
 )(
   (( segid "    " and resid 1183 and name HB2 ))
  OR 
   (( segid "    " and resid 1183 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5025 weight  0.10000E+01 volume  0.24200E+00 ppm1      7.719 ppm2      3.243
 ASSI (
   (( segid "    " and resid 1186 and name HN  ))
 )(
   (( segid "    " and resid 1186 and name HA  ))
  OR 
   (( segid "    " and resid 1185 and name HA  ))
 )
      2.700     2.700     0.000 peak  5023 weight  0.10000E+01 volume  0.38100E+01 ppm1      7.721 ppm2      4.244
 ASSI (
   (( segid "    " and resid 1187 and name HN  ))
 )(
   (( segid "    " and resid 1188 and name HG1 ))
  OR 
   (( segid "    " and resid 1186 and name HG2 ))
  OR 
   (( segid "    " and resid 1185 and name HB3 ))
  OR 
   (( segid "    " and resid 1185 and name HB2 ))
  OR 
   (( segid "    " and resid 1185 and name HB1 ))
  OR 
   (( segid "    " and resid 1181 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5006 weight  0.10000E+01 volume  0.10420E+01 ppm1      8.040 ppm2      1.373
 ASSI (
   (( segid "    " and resid 1187 and name HN  ))
 )(
   (( segid "    " and resid 1188 and name HD2 ))
  OR 
   (( segid "    " and resid 1188 and name HD1 ))
  OR 
   (( segid "    " and resid 1188 and name HB2 ))
  OR 
   (( segid "    " and resid 1186 and name HG1 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
 )
      5.000     5.000     0.000 peak  5007 weight  0.10000E+01 volume  0.42900E+00 ppm1      8.042 ppm2      1.576
 ASSI (
   (( segid "    " and resid 1187 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HB1 ))
  OR 
   (( segid "    " and resid 1188 and name HB1 ))
  OR 
   (( segid "    " and resid 1186 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5008 weight  0.10000E+01 volume  0.79400E+00 ppm1      8.043 ppm2      1.719
 ASSI (
   (( segid "    " and resid 1187 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HB1 ))
  OR 
   (( segid "    " and resid 1186 and name HB1 ))
  OR 
   (( segid "    " and resid 1171 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HB1 ))
 )
      5.000     5.000     0.000 peak  5009 weight  0.10000E+01 volume  0.87500E+00 ppm1      8.042 ppm2      1.811
 ASSI (
   (( segid "    " and resid 1187 and name HN  ))
 )(
   (( segid "    " and resid 1187 and name HA  ))
 )
      3.300     3.300     0.000 peak  5017 weight  0.10000E+01 volume  0.30320E+01 ppm1      8.042 ppm2      4.137
 ASSI (
   (( segid "    " and resid 1187 and name HN  ))
 )(
   (( segid "    " and resid 1186 and name HA  ))
 )
      3.300     3.300     0.000 peak  5015 weight  0.10000E+01 volume  0.26410E+01 ppm1      8.041 ppm2      4.258
 ASSI (
   (( segid "    " and resid 1187 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HA  ))
  OR 
   (( segid "    " and resid 1188 and name HA  ))
  OR 
   (( segid "    " and resid 1181 and name HA  ))
  OR 
   (( segid "    " and resid 1176 and name HA  ))
 )
      6.000     6.000     0.000 peak  5016 weight  0.10000E+01 volume  0.25800E+00 ppm1      8.041 ppm2      4.378
 ASSI (
   (( segid "    " and resid 1187 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      6.000     6.000     0.000 peak  5014 weight  0.10000E+01 volume  0.21300E+00 ppm1      8.042 ppm2      0.783
 ASSI (
   (( segid "    " and resid 1188 and name HN  ))
 )(
   (( segid "    " and resid 1186 and name HB1 ))
  OR 
   (( segid "    " and resid 1171 and name HG1 ))
  OR 
   (( segid "    " and resid 1171 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HB1 ))
 )
      6.000     6.000     0.000 peak  5001 weight  0.10000E+01 volume  0.24000E+00 ppm1      8.039 ppm2      1.825
 ASSI (
   (( segid "    " and resid 1188 and name HN  ))
 )(
   (( segid "    " and resid 1188 and name HA  ))
 )
      5.000     5.000     0.000 peak  4991 weight  0.10000E+01 volume  0.13970E+01 ppm1      8.045 ppm2      4.371
 ASSI (
   (( segid "    " and resid 1188 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      6.000     6.000     0.000 peak  5004 weight  0.10000E+01 volume  0.24000E+00 ppm1      8.044 ppm2      0.780
 ASSI (
   (( segid "    " and resid 1188 and name HN  ))
 )(
   (( segid "    " and resid 1188 and name HG2 ))
 )
      5.000     5.000     0.000 peak  5003 weight  0.10000E+01 volume  0.63100E+00 ppm1      8.046 ppm2      1.293
 ASSI (
   (( segid "    " and resid 1188 and name HN  ))
 )(
   (( segid "    " and resid 1188 and name HG1 ))
  OR 
   (( segid "    " and resid 1186 and name HG2 ))
  OR 
   (( segid "    " and resid 1185 and name HB3 ))
  OR 
   (( segid "    " and resid 1185 and name HB2 ))
  OR 
   (( segid "    " and resid 1185 and name HB1 ))
  OR 
   (( segid "    " and resid 1181 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5002 weight  0.10000E+01 volume  0.10150E+01 ppm1      8.047 ppm2      1.378
 ASSI (
   (( segid "    " and resid 1188 and name HN  ))
 )(
   (( segid "    " and resid 1188 and name HD2 ))
  OR 
   (( segid "    " and resid 1188 and name HD1 ))
  OR 
   (( segid "    " and resid 1188 and name HB2 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
 )
      5.000     5.000     0.000 peak  4999 weight  0.10000E+01 volume  0.16460E+01 ppm1      8.045 ppm2      1.586
 ASSI (
   (( segid "    " and resid 1188 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HB1 ))
  OR 
   (( segid "    " and resid 1188 and name HB1 ))
  OR 
   (( segid "    " and resid 1186 and name HB2 ))
 )
      5.000     5.000     0.000 peak  5000 weight  0.10000E+01 volume  0.10410E+01 ppm1      8.047 ppm2      1.727
 ASSI (
   (( segid "    " and resid 1188 and name HN  ))
 )(
   (( segid "    " and resid 1187 and name HB2 ))
  OR 
   (( segid "    " and resid 1187 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4998 weight  0.10000E+01 volume  0.68300E+00 ppm1      8.044 ppm2      1.990
 ASSI (
   (( segid "    " and resid 1188 and name HN  ))
 )(
   (( segid "    " and resid 1186 and name HA  ))
  OR 
   (( segid "    " and resid 1185 and name HA  ))
 )
      5.000     5.000     0.000 peak  4993 weight  0.10000E+01 volume  0.47700E+00 ppm1      8.045 ppm2      4.230
 ASSI (
   (( segid "    " and resid 1188 and name HN  ))
 )(
   (( segid "    " and resid 1188 and name HE2 ))
  OR 
   (( segid "    " and resid 1188 and name HE1 ))
  OR 
   (( segid "    " and resid 1186 and name HE2 ))
  OR 
   (( segid "    " and resid 1186 and name HE1 ))
 )
      6.000     6.000     0.000 peak  4995 weight  0.10000E+01 volume  0.12400E+00 ppm1      8.044 ppm2      2.925
 ASSI (
   (( segid "    " and resid 1189 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HB1 ))
  OR 
   (( segid "    " and resid 1188 and name HB1 ))
 )
      3.300     3.300     0.000 peak  4983 weight  0.10000E+01 volume  0.26100E+01 ppm1      8.428 ppm2      1.735
 ASSI (
   (( segid "    " and resid 1189 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HB2 ))
  OR 
   (( segid "    " and resid 1188 and name HD2 ))
  OR 
   (( segid "    " and resid 1188 and name HD1 ))
  OR 
   (( segid "    " and resid 1188 and name HB2 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
 )
      3.300     3.300     0.000 peak  4984 weight  0.10000E+01 volume  0.23120E+01 ppm1      8.429 ppm2      1.596
 ASSI (
   (( segid "    " and resid 1189 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
 )
      5.000     5.000     0.000 peak  4986 weight  0.10000E+01 volume  0.53000E+00 ppm1      8.433 ppm2      0.753
 ASSI (
   (( segid "    " and resid 1189 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HD13))
  OR 
   (( segid "    " and resid 1189 and name HD12))
  OR 
   (( segid "    " and resid 1189 and name HD11))
 )
      5.000     5.000     0.000 peak  4985 weight  0.10000E+01 volume  0.50100E+00 ppm1      8.432 ppm2      0.899
 ASSI (
   (( segid "    " and resid 1189 and name HN  ))
 )(
   (( segid "    " and resid 1188 and name HG2 ))
  OR 
   (( segid "    " and resid 1181 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4987 weight  0.10000E+01 volume  0.36400E+00 ppm1      8.430 ppm2      1.305
 ASSI (
   (( segid "    " and resid 1189 and name HN  ))
 )(
   (( segid "    " and resid 1186 and name HB1 ))
  OR 
   (( segid "    " and resid 1171 and name HB2 ))
  OR 
   (( segid "    " and resid 1171 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4982 weight  0.10000E+01 volume  0.19700E+00 ppm1      8.435 ppm2      1.857
 ASSI (
   (( segid "    " and resid 1189 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HA  ))
  OR 
   (( segid "    " and resid 1188 and name HA  ))
 )
      3.300     3.300     0.000 peak  4981 weight  0.10000E+01 volume  0.28390E+01 ppm1      8.437 ppm2      4.370
 ASSI (
   (( segid "    " and resid 1189 and name HN  ))
 )(
   (( segid "    " and resid 1190 and name HE2 ))
  OR 
   (( segid "    " and resid 1190 and name HE1 ))
 )
      6.000     6.000     0.000 peak  4978 weight  0.10000E+01 volume  0.13100E+00 ppm1      8.436 ppm2      6.711
 ASSI (
   (( segid "    " and resid 1189 and name HN  ))
 )(
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )
      6.000     6.000     0.000 peak  4979 weight  0.10000E+01 volume  0.20600E+00 ppm1      8.436 ppm2      6.825
 ASSI (
   (( segid "    " and resid 1190 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
  OR 
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )
      6.000     6.000     0.000 peak  4973 weight  0.10000E+01 volume  0.11300E+00 ppm1      7.364 ppm2      0.416
 ASSI (
   (( segid "    " and resid 1190 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
  OR 
   (( segid "    " and resid 1169 and name HD13))
  OR 
   (( segid "    " and resid 1169 and name HD12))
  OR 
   (( segid "    " and resid 1169 and name HD11))
 )
      6.000     6.000     0.000 peak  4972 weight  0.10000E+01 volume  0.26000E+00 ppm1      7.368 ppm2      0.662
 ASSI (
   (( segid "    " and resid 1190 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
 )
      5.000     5.000     0.000 peak  4971 weight  0.10000E+01 volume  0.48400E+00 ppm1      7.370 ppm2      0.758
 ASSI (
   (( segid "    " and resid 1190 and name HN  ))
 )(
   (( segid "    " and resid 1188 and name HG1 ))
  OR 
   (( segid "    " and resid 1181 and name HB2 ))
  OR 
   (( segid "    " and resid 1169 and name HG11))
  OR 
   (( segid "    " and resid 1166 and name HG2 ))
 )
      6.000     6.000     0.000 peak  4969 weight  0.10000E+01 volume  0.36300E+00 ppm1      7.366 ppm2      1.367
 ASSI (
   (( segid "    " and resid 1190 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HG  ))
  OR 
   (( segid "    " and resid 1189 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4968 weight  0.10000E+01 volume  0.10500E+01 ppm1      7.368 ppm2      1.531
 ASSI (
   (( segid "    " and resid 1190 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4967 weight  0.10000E+01 volume  0.10020E+01 ppm1      7.367 ppm2      1.597
 ASSI (
   (( segid "    " and resid 1190 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HB1 ))
  OR 
   (( segid "    " and resid 1169 and name HB  ))
 )
      5.000     5.000     0.000 peak  4966 weight  0.10000E+01 volume  0.12020E+01 ppm1      7.368 ppm2      1.737
 ASSI (
   (( segid "    " and resid 1190 and name HN  ))
 )(
   (( segid "    " and resid 1187 and name HA  ))
  OR 
   (( segid "    " and resid 1169 and name HA  ))
  OR 
   (( segid "    " and resid 1168 and name HA  ))
 )
      6.000     6.000     0.000 peak  4962 weight  0.10000E+01 volume  0.13100E+00 ppm1      7.367 ppm2      4.171
 ASSI (
   (( segid "    " and resid 1190 and name HN  ))
 )(
   (( segid "    " and resid 1190 and name HD1 ))
 )
      5.000     5.000     0.000 peak  4959 weight  0.10000E+01 volume  0.91200E+00 ppm1      7.367 ppm2      6.832
 ASSI (
   (( segid "    " and resid 1190 and name HN  ))
 )(
   (( segid "    " and resid 1169 and name HN  ))
 )
      6.000     6.000     0.000 peak  4957 weight  0.10000E+01 volume  0.15200E+00 ppm1      7.370 ppm2      8.201
 ASSI (
   (( segid "    " and resid 1190 and name HN  ))
 )(
   (( segid "    " and resid 1190 and name HB2 ))
  OR 
   (( segid "    " and resid 1190 and name HB1 ))
  OR 
   (( segid "    " and resid 1167 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4965 weight  0.10000E+01 volume  0.14550E+01 ppm1      7.363 ppm2      2.739
 ASSI (
   (( segid "    " and resid 1190 and name HN  ))
 )(
   (( segid "    " and resid 1188 and name HN  ))
 )
      6.000     6.000     0.000 peak  4958 weight  0.10000E+01 volume  0.98000E-01 ppm1      7.365 ppm2      8.050
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HD23))
  OR 
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1223 and name HD21))
  OR 
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG21))
  OR 
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )
      6.000     6.000     0.000 peak  4952 weight  0.10000E+01 volume  0.18700E+00 ppm1      8.837 ppm2      0.417
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
  OR 
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )
      5.000     5.000     0.000 peak  4953 weight  0.10000E+01 volume  0.45400E+00 ppm1      8.838 ppm2      0.664
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1189 and name HD23))
  OR 
   (( segid "    " and resid 1189 and name HD22))
  OR 
   (( segid "    " and resid 1189 and name HD21))
  OR 
   (( segid "    " and resid 1181 and name HD13))
  OR 
   (( segid "    " and resid 1181 and name HD12))
  OR 
   (( segid "    " and resid 1181 and name HD11))
  OR 
   (( segid "    " and resid 1168 and name HG23))
  OR 
   (( segid "    " and resid 1168 and name HG22))
  OR 
   (( segid "    " and resid 1168 and name HG21))
  OR 
   (( segid "    " and resid 1168 and name HG13))
  OR 
   (( segid "    " and resid 1168 and name HG12))
  OR 
   (( segid "    " and resid 1168 and name HG11))
 )
      6.000     6.000     0.000 peak  4954 weight  0.10000E+01 volume  0.31600E+00 ppm1      8.838 ppm2      0.815
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1169 and name HG11))
  OR 
   (( segid "    " and resid 1166 and name HG2 ))
 )
      6.000     6.000     0.000 peak  4951 weight  0.10000E+01 volume  0.28400E+00 ppm1      8.839 ppm2      1.361
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HB  ))
  OR 
   (( segid "    " and resid 1192 and name HB2 ))
  OR 
   (( segid "    " and resid 1189 and name HG  ))
  OR 
   (( segid "    " and resid 1189 and name HB2 ))
  OR 
   (( segid "    " and resid 1166 and name HG1 ))
 )
      6.000     6.000     0.000 peak  4950 weight  0.10000E+01 volume  0.11500E+00 ppm1      8.836 ppm2      1.515
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1192 and name HB1 ))
  OR 
   (( segid "    " and resid 1188 and name HD2 ))
  OR 
   (( segid "    " and resid 1188 and name HD1 ))
  OR 
   (( segid "    " and resid 1188 and name HB2 ))
  OR 
   (( segid "    " and resid 1181 and name HG  ))
  OR 
   (( segid "    " and resid 1169 and name HB  ))
 )
      6.000     6.000     0.000 peak  4949 weight  0.10000E+01 volume  0.22000E+00 ppm1      8.837 ppm2      1.651
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1190 and name HB2 ))
  OR 
   (( segid "    " and resid 1190 and name HB1 ))
  OR 
   (( segid "    " and resid 1167 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4945 weight  0.10000E+01 volume  0.14480E+01 ppm1      8.838 ppm2      2.727
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1190 and name HB2 ))
  OR 
   (( segid "    " and resid 1190 and name HB1 ))
  OR 
   (( segid "    " and resid 1167 and name HB1 ))
 )
      3.300     3.300     0.000 peak  4944 weight  0.10000E+01 volume  0.23080E+01 ppm1      8.839 ppm2      2.786
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1169 and name HA  ))
  OR 
   (( segid "    " and resid 1168 and name HA  ))
 )
      5.000     5.000     0.000 peak  4941 weight  0.10000E+01 volume  0.59300E+00 ppm1      8.839 ppm2      4.191
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1167 and name HA  ))
  OR 
   (( segid "    " and resid 1166 and name HA  ))
 )
      6.000     6.000     0.000 peak  4939 weight  0.10000E+01 volume  0.29600E+00 ppm1      8.839 ppm2      4.818
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1190 and name HD2 ))
  OR 
   (( segid "    " and resid 1190 and name HD1 ))
 )
      5.000     5.000     0.000 peak  4937 weight  0.10000E+01 volume  0.55000E+00 ppm1      8.841 ppm2      6.829
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
  OR 
   (( segid "    " and resid 1141 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4947 weight  0.10000E+01 volume  0.25900E+00 ppm1      8.837 ppm2      2.092
 ASSI (
   (( segid "    " and resid 1191 and name HN  ))
 )(
   (( segid "    " and resid 1169 and name HG23))
  OR 
   (( segid "    " and resid 1169 and name HG22))
  OR 
   (( segid "    " and resid 1169 and name HG21))
  OR 
   (( segid "    " and resid 1169 and name HG12))
 )
      6.000     6.000     0.000 peak  4955 weight  0.10000E+01 volume  0.13100E+00 ppm1      8.832 ppm2      0.981
 ASSI (
   (( segid "    " and resid 1192 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
  OR 
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )
      6.000     6.000     0.000 peak  4925 weight  0.10000E+01 volume  0.37900E+00 ppm1      8.771 ppm2      0.606
 ASSI (
   (( segid "    " and resid 1192 and name HN  ))
 )(
   (( segid "    " and resid 1192 and name HB2 ))
 )
      3.300     3.300     0.000 peak  4924 weight  0.10000E+01 volume  0.18550E+01 ppm1      8.769 ppm2      1.441
 ASSI (
   (( segid "    " and resid 1192 and name HN  ))
 )(
   (( segid "    " and resid 1192 and name HB1 ))
 )
      2.700     2.700     0.000 peak  4923 weight  0.10000E+01 volume  0.38840E+01 ppm1      8.767 ppm2      1.635
 ASSI (
   (( segid "    " and resid 1192 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
 )
      3.300     3.300     0.000 peak  4922 weight  0.10000E+01 volume  0.17730E+01 ppm1      8.770 ppm2      2.123
 ASSI (
   (( segid "    " and resid 1192 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HG2 ))
  OR 
   (( segid "    " and resid 1195 and name HG1 ))
  OR 
   (( segid "    " and resid 1166 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4921 weight  0.10000E+01 volume  0.11720E+01 ppm1      8.769 ppm2      2.227
 ASSI (
   (( segid "    " and resid 1192 and name HN  ))
 )(
   (( segid "    " and resid 1218 and name HB1 ))
  OR 
   (( segid "    " and resid 1192 and name HD2 ))
  OR 
   (( segid "    " and resid 1192 and name HD1 ))
 )
      5.000     5.000     0.000 peak  4920 weight  0.10000E+01 volume  0.96000E+00 ppm1      8.769 ppm2      3.114
 ASSI (
   (( segid "    " and resid 1192 and name HN  ))
 )(
   (( segid "    " and resid 1191 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4919 weight  0.10000E+01 volume  0.13830E+01 ppm1      8.769 ppm2      3.418
 ASSI (
   (( segid "    " and resid 1192 and name HN  ))
 )(
   (( segid "    " and resid 1191 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4918 weight  0.10000E+01 volume  0.13230E+01 ppm1      8.768 ppm2      3.528
 ASSI (
   (( segid "    " and resid 1192 and name HN  ))
 )(
   (( segid "    " and resid 1167 and name HN  ))
 )
      6.000     6.000     0.000 peak  4930 weight  0.10000E+01 volume  0.14800E+00 ppm1      8.769 ppm2      9.429
 ASSI (
   (( segid "    " and resid 1192 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HD21))
  OR 
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
  OR 
   (( segid "    " and resid 1141 and name HD13))
  OR 
   (( segid "    " and resid 1141 and name HD12))
  OR 
   (( segid "    " and resid 1141 and name HD11))
 )
      6.000     6.000     0.000 peak  4926 weight  0.10000E+01 volume  0.10900E+00 ppm1      8.769 ppm2      0.387
 ASSI (
   (( segid "    " and resid 1192 and name HN  ))
 )(
   (( segid "    " and resid 1194 and name HA1 ))
  OR 
   (( segid "    " and resid 1189 and name HA  ))
  OR 
   (( segid "    " and resid 1142 and name HA  ))
 )
      6.000     6.000     0.000 peak  4928 weight  0.10000E+01 volume  0.15200E+00 ppm1      8.767 ppm2      4.367
 ASSI (
   (( segid "    " and resid 1193 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
  OR 
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
  OR 
   (( segid "    " and resid 1141 and name HD23))
  OR 
   (( segid "    " and resid 1141 and name HD22))
  OR 
   (( segid "    " and resid 1141 and name HD21))
 )
      6.000     6.000     0.000 peak  4913 weight  0.10000E+01 volume  0.14600E+00 ppm1      9.055 ppm2      0.630
 ASSI (
   (( segid "    " and resid 1193 and name HN  ))
 )(
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )
      5.000     5.000     0.000 peak  4914 weight  0.10000E+01 volume  0.67600E+00 ppm1      9.054 ppm2      0.393
 ASSI (
   (( segid "    " and resid 1193 and name HN  ))
 )(
   (( segid "    " and resid 1192 and name HB2 ))
  OR 
   (( segid "    " and resid 1166 and name HG2 ))
 )
      6.000     6.000     0.000 peak  4912 weight  0.10000E+01 volume  0.34100E+00 ppm1      9.055 ppm2      1.450
 ASSI (
   (( segid "    " and resid 1193 and name HN  ))
 )(
   (( segid "    " and resid 1192 and name HB1 ))
  OR 
   (( segid "    " and resid 1164 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4911 weight  0.10000E+01 volume  0.10780E+01 ppm1      9.055 ppm2      1.652
 ASSI (
   (( segid "    " and resid 1193 and name HN  ))
 )(
   (( segid "    " and resid 1166 and name HB2 ))
  OR 
   (( segid "    " and resid 1143 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4910 weight  0.10000E+01 volume  0.36600E+00 ppm1      9.054 ppm2      1.787
 ASSI (
   (( segid "    " and resid 1193 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HG2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
  OR 
   (( segid "    " and resid 1166 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HG2 ))
  OR 
   (( segid "    " and resid 1143 and name HG1 ))
 )
      5.000     5.000     0.000 peak  4909 weight  0.10000E+01 volume  0.49600E+00 ppm1      9.053 ppm2      2.163
 ASSI (
   (( segid "    " and resid 1193 and name HN  ))
 )(
   (( segid "    " and resid 1219 and name HB2 ))
  OR 
   (( segid "    " and resid 1218 and name HB1 ))
  OR 
   (( segid "    " and resid 1192 and name HD2 ))
  OR 
   (( segid "    " and resid 1192 and name HD1 ))
 )
      6.000     6.000     0.000 peak  4908 weight  0.10000E+01 volume  0.23000E+00 ppm1      9.054 ppm2      3.103
 ASSI (
   (( segid "    " and resid 1193 and name HN  ))
 )(
   (( segid "    " and resid 1193 and name HA  ))
 )
      5.000     5.000     0.000 peak  4906 weight  0.10000E+01 volume  0.59400E+00 ppm1      9.053 ppm2      3.650
 ASSI (
   (( segid "    " and resid 1193 and name HN  ))
 )(
   (( segid "    " and resid 1194 and name HA1 ))
  OR 
   (( segid "    " and resid 1164 and name HA  ))
  OR 
   (( segid "    " and resid 1142 and name HA  ))
 )
      6.000     6.000     0.000 peak  4905 weight  0.10000E+01 volume  0.24900E+00 ppm1      9.054 ppm2      4.368
 ASSI (
   (( segid "    " and resid 1193 and name HN  ))
 )(
   (( segid "    " and resid 1220 and name HN  ))
  OR 
   (( segid "    " and resid 1219 and name HN  ))
 )
      6.000     6.000     0.000 peak  4899 weight  0.10000E+01 volume  0.12200E+00 ppm1      9.051 ppm2      8.908
 ASSI (
   (( segid "    " and resid 1193 and name HN  ))
 )(
   (( segid "    " and resid 1194 and name HN  ))
 )
      6.000     6.000     0.000 peak  4898 weight  0.10000E+01 volume  0.21400E+00 ppm1      9.049 ppm2      9.162
 ASSI (
   (( segid "    " and resid 1194 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
  OR 
   (( segid "    " and resid 1164 and name HD23))
  OR 
   (( segid "    " and resid 1164 and name HD22))
  OR 
   (( segid "    " and resid 1164 and name HD21))
  OR 
   (( segid "    " and resid 1164 and name HD13))
  OR 
   (( segid "    " and resid 1164 and name HD12))
  OR 
   (( segid "    " and resid 1164 and name HD11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
 )
      6.000     6.000     0.000 peak  4894 weight  0.10000E+01 volume  0.17400E+00 ppm1      9.151 ppm2      0.621
 ASSI (
   (( segid "    " and resid 1194 and name HN  ))
 )(
   (( segid "    " and resid 1192 and name HB1 ))
  OR 
   (( segid "    " and resid 1164 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4892 weight  0.10000E+01 volume  0.10100E+00 ppm1      9.150 ppm2      1.639
 ASSI (
   (( segid "    " and resid 1194 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HG2 ))
  OR 
   (( segid "    " and resid 1143 and name HG1 ))
 )
      6.000     6.000     0.000 peak  4891 weight  0.10000E+01 volume  0.27000E+00 ppm1      9.148 ppm2      2.128
 ASSI (
   (( segid "    " and resid 1194 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HG1 ))
  OR 
   (( segid "    " and resid 1166 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4890 weight  0.10000E+01 volume  0.13700E+00 ppm1      9.148 ppm2      2.230
 ASSI (
   (( segid "    " and resid 1194 and name HN  ))
 )(
   (( segid "    " and resid 1219 and name HB2 ))
  OR 
   (( segid "    " and resid 1218 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4888 weight  0.10000E+01 volume  0.43600E+00 ppm1      9.148 ppm2      3.069
 ASSI (
   (( segid "    " and resid 1194 and name HN  ))
 )(
   (( segid "    " and resid 1219 and name HB1 ))
  OR 
   (( segid "    " and resid 1191 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4887 weight  0.10000E+01 volume  0.12900E+00 ppm1      9.145 ppm2      3.406
 ASSI (
   (( segid "    " and resid 1194 and name HN  ))
 )(
   (( segid "    " and resid 1194 and name HA2 ))
  OR 
   (( segid "    " and resid 1193 and name HB  ))
 )
      5.000     5.000     0.000 peak  4886 weight  0.10000E+01 volume  0.16480E+01 ppm1      9.145 ppm2      3.561
 ASSI (
   (( segid "    " and resid 1194 and name HN  ))
 )(
   (( segid "    " and resid 1193 and name HA  ))
 )
      3.300     3.300     0.000 peak  4885 weight  0.10000E+01 volume  0.26270E+01 ppm1      9.149 ppm2      3.649
 ASSI (
   (( segid "    " and resid 1194 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HA  ))
  OR 
   (( segid "    " and resid 1194 and name HA1 ))
 )
      5.000     5.000     0.000 peak  4884 weight  0.10000E+01 volume  0.11450E+01 ppm1      9.147 ppm2      4.395
 ASSI (
   (( segid "    " and resid 1194 and name HN  ))
 )(
   (( segid "    " and resid 1217 and name HA  ))
  OR 
   (( segid "    " and resid 1167 and name HA  ))
 )
      6.000     6.000     0.000 peak  4882 weight  0.10000E+01 volume  0.17300E+00 ppm1      9.148 ppm2      4.780
 ASSI (
   (( segid "    " and resid 1194 and name HN  ))
 )(
   (( segid "    " and resid 1219 and name HE3 ))
 )
      6.000     6.000     0.000 peak  4880 weight  0.10000E+01 volume  0.34100E+00 ppm1      9.146 ppm2      7.579
 ASSI (
   (( segid "    " and resid 1194 and name HN  ))
 )(
   (( segid "    " and resid 1220 and name HN  ))
  OR 
   (( segid "    " and resid 1219 and name HN  ))
  OR 
   (( segid "    " and resid 1197 and name HN  ))
 )
      6.000     6.000     0.000 peak  4878 weight  0.10000E+01 volume  0.28500E+00 ppm1      9.147 ppm2      8.910
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HD22))
  OR 
   (( segid "    " and resid 1193 and name HG23))
  OR 
   (( segid "    " and resid 1193 and name HG22))
  OR 
   (( segid "    " and resid 1193 and name HG21))
 )
      6.000     6.000     0.000 peak  4875 weight  0.10000E+01 volume  0.35600E+00 ppm1      8.022 ppm2      0.392
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
  OR 
   (( segid "    " and resid 1164 and name HG  ))
 )
      6.000     6.000     0.000 peak  4876 weight  0.10000E+01 volume  0.22200E+00 ppm1      8.022 ppm2      0.602
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
 )
      5.000     5.000     0.000 peak  4873 weight  0.10000E+01 volume  0.70800E+00 ppm1      8.022 ppm2      1.025
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1192 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4872 weight  0.10000E+01 volume  0.28200E+00 ppm1      8.022 ppm2      1.436
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1192 and name HB1 ))
  OR 
   (( segid "    " and resid 1164 and name HB1 ))
  OR 
   (( segid "    " and resid 1143 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4871 weight  0.10000E+01 volume  0.43000E+00 ppm1      8.021 ppm2      1.636
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1166 and name HB2 ))
  OR 
   (( segid "    " and resid 1143 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4870 weight  0.10000E+01 volume  0.13400E+00 ppm1      8.020 ppm2      1.811
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
 )
      2.700     2.700     0.000 peak  4869 weight  0.10000E+01 volume  0.42690E+01 ppm1      8.021 ppm2      2.118
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HG2 ))
  OR 
   (( segid "    " and resid 1195 and name HG1 ))
 )
      3.300     3.300     0.000 peak  4868 weight  0.10000E+01 volume  0.17390E+01 ppm1      8.021 ppm2      2.213
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1218 and name HB2 ))
  OR 
   (( segid "    " and resid 1167 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4867 weight  0.10000E+01 volume  0.41700E+00 ppm1      8.021 ppm2      2.787
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1219 and name HB2 ))
  OR 
   (( segid "    " and resid 1218 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4866 weight  0.10000E+01 volume  0.57900E+00 ppm1      8.021 ppm2      3.069
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1219 and name HB1 ))
  OR 
   (( segid "    " and resid 1191 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4865 weight  0.10000E+01 volume  0.18100E+00 ppm1      8.021 ppm2      3.420
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1194 and name HA2 ))
  OR 
   (( segid "    " and resid 1193 and name HB  ))
  OR 
   (( segid "    " and resid 1191 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4864 weight  0.10000E+01 volume  0.12960E+01 ppm1      8.024 ppm2      3.567
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1193 and name HA  ))
 )
      5.000     5.000     0.000 peak  4863 weight  0.10000E+01 volume  0.95300E+00 ppm1      8.024 ppm2      3.658
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HA  ))
  OR 
   (( segid "    " and resid 1194 and name HA1 ))
 )
      3.300     3.300     0.000 peak  4862 weight  0.10000E+01 volume  0.23850E+01 ppm1      8.024 ppm2      4.409
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1217 and name HA  ))
  OR 
   (( segid "    " and resid 1167 and name HA  ))
 )
      6.000     6.000     0.000 peak  4860 weight  0.10000E+01 volume  0.14200E+00 ppm1      8.024 ppm2      4.772
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1193 and name HN  ))
 )
      6.000     6.000     0.000 peak  4854 weight  0.10000E+01 volume  0.15900E+00 ppm1      8.020 ppm2      9.021
 ASSI (
   (( segid "    " and resid 1195 and name HN  ))
 )(
   (( segid "    " and resid 1196 and name HN  ))
 )
      5.000     5.000     0.000 peak  4850 weight  0.10000E+01 volume  0.81900E+00 ppm1      8.025 ppm2      8.478
 ASSI (
   (( segid "    " and resid 1196 and name HN  ))
 )(
   (( segid "    " and resid 1217 and name HA  ))
  OR 
   (( segid "    " and resid 1198 and name HA  ))
 )
      6.000     6.000     0.000 peak  4764 weight  0.10000E+01 volume  0.39800E+00 ppm1      8.481 ppm2      4.778
 ASSI (
   (( segid "    " and resid 1196 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
 )
      2.700     2.700     0.000 peak  4769 weight  0.10000E+01 volume  0.34670E+01 ppm1      8.474 ppm2      2.116
 ASSI (
   (( segid "    " and resid 1196 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HG2 ))
  OR 
   (( segid "    " and resid 1195 and name HG1 ))
 )
      5.000     5.000     0.000 peak  4771 weight  0.10000E+01 volume  0.13040E+01 ppm1      8.474 ppm2      2.213
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )
      5.000     5.000     0.000 peak  4849 weight  0.10000E+01 volume  0.73500E+00 ppm1      8.953 ppm2      0.124
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
 )
      6.000     6.000     0.000 peak  4848 weight  0.10000E+01 volume  0.26500E+00 ppm1      8.953 ppm2      0.511
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
 )
      5.000     5.000     0.000 peak  4847 weight  0.10000E+01 volume  0.16950E+01 ppm1      8.952 ppm2      0.607
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HG  ))
  OR 
   (( segid "    " and resid 1217 and name HG23))
  OR 
   (( segid "    " and resid 1217 and name HG22))
  OR 
   (( segid "    " and resid 1217 and name HG21))
 )
      6.000     6.000     0.000 peak  4846 weight  0.10000E+01 volume  0.39900E+00 ppm1      8.952 ppm2      1.024
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
 )
      5.000     5.000     0.000 peak  4845 weight  0.10000E+01 volume  0.67500E+00 ppm1      8.952 ppm2      1.124
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1215 and name HG2 ))
  OR 
   (( segid "    " and resid 1215 and name HG1 ))
 )
      5.000     5.000     0.000 peak  4844 weight  0.10000E+01 volume  0.40100E+00 ppm1      8.952 ppm2      1.429
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1224 and name HB2 ))
  OR 
   (( segid "    " and resid 1224 and name HB1 ))
  OR 
   (( segid "    " and resid 1215 and name HB2 ))
  OR 
   (( segid "    " and resid 1214 and name HB2 ))
 )
      6.000     6.000     0.000 peak  4842 weight  0.10000E+01 volume  0.15300E+00 ppm1      8.952 ppm2      1.667
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1196 and name HB2 ))
  OR 
   (( segid "    " and resid 1196 and name HB1 ))
 )
      3.300     3.300     0.000 peak  4841 weight  0.10000E+01 volume  0.23420E+01 ppm1      8.953 ppm2      3.634
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HA  ))
 )
      5.000     5.000     0.000 peak  4840 weight  0.10000E+01 volume  0.11230E+01 ppm1      8.953 ppm2      4.025
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1195 and name HA  ))
  OR 
   (( segid "    " and resid 1194 and name HA1 ))
 )
      6.000     6.000     0.000 peak  4839 weight  0.10000E+01 volume  0.18000E+00 ppm1      8.952 ppm2      4.409
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1216 and name HA  ))
 )
      6.000     6.000     0.000 peak  4837 weight  0.10000E+01 volume  0.27800E+00 ppm1      8.952 ppm2      4.888
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1196 and name HA  ))
 )
      2.700     2.700     0.000 peak  4835 weight  0.10000E+01 volume  0.41250E+01 ppm1      8.951 ppm2      5.124
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1215 and name HA  ))
  OR 
   (( segid "    " and resid 1199 and name HA  ))
 )
      5.000     5.000     0.000 peak  4833 weight  0.10000E+01 volume  0.44400E+00 ppm1      8.950 ppm2      5.256
 ASSI (
   (( segid "    " and resid 1197 and name HN  ))
 )(
   (( segid "    " and resid 1218 and name HN  ))
  OR 
   (( segid "    " and resid 1217 and name HN  ))
 )
      5.000     5.000     0.000 peak  4834 weight  0.10000E+01 volume  0.48400E+00 ppm1      8.952 ppm2      8.278
 ASSI (
   (( segid "    " and resid 1198 and name HN  ))
 )(
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )
      6.000     6.000     0.000 peak  4830 weight  0.10000E+01 volume  0.18300E+00 ppm1      7.957 ppm2      0.475
 ASSI (
   (( segid "    " and resid 1198 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HG13))
  OR 
   (( segid "    " and resid 1197 and name HG12))
  OR 
   (( segid "    " and resid 1197 and name HG11))
  OR 
   (( segid "    " and resid 1182 and name HG2 ))
 )
      5.000     5.000     0.000 peak  4829 weight  0.10000E+01 volume  0.69200E+00 ppm1      7.958 ppm2      0.605
 ASSI (
   (( segid "    " and resid 1198 and name HN  ))
 )(
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
  OR 
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4828 weight  0.10000E+01 volume  0.17600E+00 ppm1      7.957 ppm2      1.133
 ASSI (
   (( segid "    " and resid 1198 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HB  ))
  OR 
   (( segid "    " and resid 1181 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4827 weight  0.10000E+01 volume  0.35500E+00 ppm1      7.957 ppm2      1.524
 ASSI (
   (( segid "    " and resid 1198 and name HN  ))
 )(
   (( segid "    " and resid 1198 and name HG2 ))
 )
      6.000     6.000     0.000 peak  4824 weight  0.10000E+01 volume  0.38800E+00 ppm1      7.955 ppm2      2.030
 ASSI (
   (( segid "    " and resid 1198 and name HN  ))
 )(
   (( segid "    " and resid 1198 and name HG1 ))
  OR 
   (( segid "    " and resid 1195 and name HB2 ))
  OR 
   (( segid "    " and resid 1195 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4823 weight  0.10000E+01 volume  0.45700E+00 ppm1      7.955 ppm2      2.147
 ASSI (
   (( segid "    " and resid 1198 and name HN  ))
 )(
   (( segid "    " and resid 1198 and name HA  ))
 )
      5.000     5.000     0.000 peak  4819 weight  0.10000E+01 volume  0.55100E+00 ppm1      7.959 ppm2      4.762
 ASSI (
   (( segid "    " and resid 1198 and name HN  ))
 )(
   (( segid "    " and resid 1215 and name HA  ))
  OR 
   (( segid "    " and resid 1199 and name HA  ))
 )
      6.000     6.000     0.000 peak  4818 weight  0.10000E+01 volume  0.18400E+00 ppm1      7.960 ppm2      5.253
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1197 and name HG23))
  OR 
   (( segid "    " and resid 1197 and name HG22))
  OR 
   (( segid "    " and resid 1197 and name HG21))
 )
      6.000     6.000     0.000 peak  4815 weight  0.10000E+01 volume  0.14500E+00 ppm1      8.436 ppm2      0.126
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HD13))
  OR 
   (( segid "    " and resid 1223 and name HD12))
  OR 
   (( segid "    " and resid 1223 and name HD11))
  OR 
   (( segid "    " and resid 1181 and name HD23))
  OR 
   (( segid "    " and resid 1181 and name HD22))
  OR 
   (( segid "    " and resid 1181 and name HD21))
 )
      6.000     6.000     0.000 peak  4814 weight  0.10000E+01 volume  0.13200E+00 ppm1      8.434 ppm2      0.511
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HG  ))
  OR 
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
  OR 
   (( segid "    " and resid 1179 and name HG11))
 )
      6.000     6.000     0.000 peak  4811 weight  0.10000E+01 volume  0.33700E+00 ppm1      8.430 ppm2      1.082
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1223 and name HB2 ))
  OR 
   (( segid "    " and resid 1216 and name HG23))
  OR 
   (( segid "    " and resid 1216 and name HG22))
  OR 
   (( segid "    " and resid 1216 and name HG21))
  OR 
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
  OR 
   (( segid "    " and resid 1179 and name HG11))
 )
      6.000     6.000     0.000 peak  4810 weight  0.10000E+01 volume  0.16200E+00 ppm1      8.433 ppm2      1.160
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1215 and name HG2 ))
  OR 
   (( segid "    " and resid 1215 and name HG1 ))
 )
      6.000     6.000     0.000 peak  4812 weight  0.10000E+01 volume  0.11100E+00 ppm1      8.434 ppm2      1.428
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HG2 ))
  OR 
   (( segid "    " and resid 1215 and name HB2 ))
  OR 
   (( segid "    " and resid 1214 and name HG  ))
  OR 
   (( segid "    " and resid 1214 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4809 weight  0.10000E+01 volume  0.45900E+00 ppm1      8.434 ppm2      1.654
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1215 and name HB1 ))
  OR 
   (( segid "    " and resid 1198 and name HB2 ))
  OR 
   (( segid "    " and resid 1179 and name HB  ))
 )
      5.000     5.000     0.000 peak  4808 weight  0.10000E+01 volume  0.51000E+00 ppm1      8.434 ppm2      1.778
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1198 and name HB1 ))
 )
      6.000     6.000     0.000 peak  4807 weight  0.10000E+01 volume  0.32400E+00 ppm1      8.433 ppm2      1.880
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HG1 ))
  OR 
   (( segid "    " and resid 1198 and name HG2 ))
 )
      6.000     6.000     0.000 peak  4806 weight  0.10000E+01 volume  0.37600E+00 ppm1      8.434 ppm2      2.036
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1214 and name HB1 ))
  OR 
   (( segid "    " and resid 1198 and name HG1 ))
 )
      6.000     6.000     0.000 peak  4804 weight  0.10000E+01 volume  0.38300E+00 ppm1      8.433 ppm2      2.223
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1226 and name HD2 ))
  OR 
   (( segid "    " and resid 1199 and name HB2 ))
 )
      5.000     5.000     0.000 peak  4803 weight  0.10000E+01 volume  0.57000E+00 ppm1      8.435 ppm2      2.891
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1199 and name HB1 ))
 )
      5.000     5.000     0.000 peak  4802 weight  0.10000E+01 volume  0.46000E+00 ppm1      8.433 ppm2      3.125
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1225 and name HA  ))
 )
      6.000     6.000     0.000 peak  4801 weight  0.10000E+01 volume  0.15300E+00 ppm1      8.434 ppm2      4.146
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1215 and name HA  ))
  OR 
   (( segid "    " and resid 1199 and name HA  ))
 )
      5.000     5.000     0.000 peak  4794 weight  0.10000E+01 volume  0.13150E+01 ppm1      8.433 ppm2      5.253
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1198 and name HN  ))
 )
      6.000     6.000     0.000 peak  4798 weight  0.10000E+01 volume  0.19900E+00 ppm1      8.434 ppm2      7.959
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1216 and name HN  ))
 )
      6.000     6.000     0.000 peak  4797 weight  0.10000E+01 volume  0.22900E+00 ppm1      8.433 ppm2      8.749
 ASSI (
   (( segid "    " and resid 1199 and name HN  ))
 )(
   (( segid "    " and resid 1199 and name HD2 ))
 )
      5.000     5.000     0.000 peak  4795 weight  0.10000E+01 volume  0.86100E+00 ppm1      8.433 ppm2      7.146
 ASSI (
   (( segid "    " and resid 1200 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HG23))
  OR 
   (( segid "    " and resid 1200 and name HG22))
  OR 
   (( segid "    " and resid 1200 and name HG21))
 )
      3.300     3.300     0.000 peak  4792 weight  0.10000E+01 volume  0.24120E+01 ppm1      9.044 ppm2      0.598
 ASSI (
   (( segid "    " and resid 1200 and name HN  ))
 )(
   (( segid "    " and resid 1200 and name HG13))
  OR 
   (( segid "    " and resid 1200 and name HG12))
  OR 
   (( segid "    " and resid 1200 and name HG11))
 )
      5.000     5.000     0.000 peak  4793 weight  0.10000E+01 volume  0.11610E+01 ppm1      9.045 ppm2      0.753
 ASSI (
   (( segid "    " and resid 1200 and name HN  ))
 )(
   (( segid "    " and resid 1214 and name HD13))
  OR 
   (( segid "    " and resid 1214 and name HD12))
  OR 
   (( segid "    " and resid 1214 and name HD11))
  OR 
   (( segid "    " and resid 1202 and name HB2 ))
  OR 
   (( segid "    " and resid 1184 and name HG23))
  OR 
   (( segid "    " and resid 1184 and name HG22))
  OR 
   (( segid "    " and resid 1184 and name HG21))
  OR 
   (( segid "    " and resid 1179 and name HG12))
  OR 
   (( segid "    " and resid 1179 and name HG11))
 )
      6.000     6.000     0.000 peak  4790 weight  0.10000E+01 volume  0.32300E+00 ppm1      9.045 ppm2      1.069
 ASSI (
   (( segid "    " and resid 1200 and name HN  ))
 )(
   (( segid "    " and resid 1182 and name HB2 ))
  OR 
   (( segid "    " and resid 1182 and name HB1 ))
  OR 
   (( segid "    " and resid 1180 and name HB3 ))
  OR 
   (( segid "    " and resid 1180 and name HB2 ))
  OR 
   (( seg